*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   23-OCT-09   2KQ1              
*TITLE     SOLUTION STRUCTURE OF PROTEIN BH0266 FROM BACILLUS                    
*TITLE    2 HALODURANS. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET          
*TITLE    3 BHR97A                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: BH0266 PROTEIN;                                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SEQUENCE DATABASE RESIDUES 39-148;                         
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS HALODURANS;                            
*SOURCE   3 ORGANISM_TAXID: 86665;                                               
*SOURCE   4 GENE: BH0266;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: BL21(DE3)+ MAGIC                           
*KEYWDS    METHODS DEVELOPMENT, SOLUTION NMR, NESG, STRUCTURAL                   
*KEYWDS   2 GENOMICS, PSI-2, PROTEIN STRUCTURE INITIATIVE, NORTHEAST             
*KEYWDS   3 STRUCTURAL GENOMICS CONSORTIUM                                       
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.WU, A.ELETSKY, D.LEE, B.SATHYAMOORTHY, W.BUCHWALD, J.HUA,           
*AUTHOR   2 C.CICCOSANTI, Y.HE, K.HAMILTON, T.ACTON, R.XIAO, J.EVERETT,          
*AUTHOR   3 H.LEE, J.PRESTEGARD, G.T.MONTELIONE, T.SZYPERSKI, NORTHEAST          
*AUTHOR   4 STRUCTURAL GENOMICS CONSORTIUM (NESG)                                
*REVDAT   1   22-DEC-09 2KQ1    0                                                


  3 THR  HA      4 PHE  H       2.80            #peak     7
  3 THR  HB      4 PHE  H       3.59            #peak     8
  4 PHE  HB2     5 ASP  H       4.02            #peak    12
  4 PHE  HB3     5 ASP  H       4.02            #peak    13
  5 ASP  H       6 HIS  H       3.52            #peak    17
  5 ASP  HB2     6 HIS  H       5.42            #peak    19
  5 ASP  HB3     6 HIS  H       5.10            #peak    20
  6 HIS  HA      7 GLY  H       2.98            #peak    22
  7 GLY  H       8 ASN  H       4.45            #peak    26
  7 GLY  HA2     8 ASN  H       2.94            #peak    27
  7 GLY  HA3     8 ASN  H       2.94            #peak    28
  9 LEU  HA     10 SER  H       2.72            #peak    36
  9 LEU  HB2    10 SER  H       5.60            #peak    37
  9 LEU  HB3    10 SER  H       5.60            #peak    38
 12 GLY  HA2    13 GLU  H       2.98            #peak    53
 12 GLY  HA3    13 GLU  H       2.98            #peak    54
 13 GLU  HA     14 LEU  H       3.05            #peak    56
 13 GLU  HB2    14 LEU  H       4.42            #peak    57
 13 GLU  HB3    14 LEU  H       4.42            #peak    58
 14 LEU  HA     15 GLU  H       2.76            #peak    62
 14 LEU  HB3    15 GLU  H       3.70            #peak    63
 14 LEU  HB2    15 GLU  H       4.45            #peak    64
 15 GLU  HA     16 LEU  H       2.94            #peak    69
 16 LEU  HA     17 THR  H       3.34            #peak    74
 17 THR  HA     18 VAL  H       2.83            #peak    81
 19 LEU  HA     20 TYR  H       3.08            #peak    90
 21 ASP  HA     22 GLU  H       2.94            #peak   103
 22 GLU  HB2    23 GLU  H       4.85            #peak   108
 22 GLU  HB3    23 GLU  H       4.85            #peak   109
 23 GLU  H      24 ARG  H       3.01            #peak   112
 23 GLU  HB2    24 ARG  H       4.74            #peak   114
 24 ARG  H      25 TYR  H       2.90            #peak   117
 25 TYR  HA     26 ASP  H       3.26            #peak   124
 26 ASP  HB2    27 ILE  H       3.80            #peak   131
 28 VAL  H      29 GLU  H       3.16            #peak   140
 28 VAL  HB     29 GLU  H       3.12            #peak   142
 29 GLU  HA     30 GLN  H       2.62            #peak   146
 30 GLN  HA     31 THR  H       3.12            #peak   150
 31 THR  HB     32 GLU  H       4.88            #peak   158
 32 GLU  H      33 THR  H       3.08            #peak   160
 32 GLU  HB2    33 THR  H       3.91            #peak   162
 32 GLU  HB3    33 THR  H       3.91            #peak   163
 33 THR  HA     34 VAL  H       3.01            #peak   167
 33 THR  HB     34 VAL  H       3.52            #peak   168
 34 VAL  HA     35 GLN  H       3.01            #peak   171
 34 VAL  HB     35 GLN  H       3.77            #peak   172
 35 GLN  HA     36 VAL  H       3.12            #peak   176
 37 ASP  HA     38 LEU  H       3.08            #peak   188
 37 ASP  HB2    38 LEU  H       5.68            #peak   189
 37 ASP  HB3    38 LEU  H       4.92            #peak   190
 38 LEU  HA     39 GLU  H       3.26            #peak   192
 38 LEU  HB2    39 GLU  H       5.06            #peak   193
 39 GLU  HA     40 GLY  H       2.94            #peak   199
 41 PRO  HA     42 ARG  H       3.55            #peak   204
 43 GLY  H      44 VAL  H       5.17            #peak   216
 45 LEU  H      46 THR  H       3.59            #peak   223
 45 LEU  HB3    46 THR  H       4.60            #peak   226
 46 THR  H      47 VAL  H       3.48            #peak   230
 49 ARG  H      50 PHE  H       3.48            #peak   245
 50 PHE  H      51 ALA  H       2.83            #peak   252
 51 ALA  H      52 ARG  H       4.45            #peak   259
 51 ALA  HA     52 ARG  H       2.76            #peak   260
 53 PRO  HA     54 SER  H       2.76            #peak   262
 53 PRO  HB2    54 SER  H       3.80            #peak   263
 53 PRO  HB3    54 SER  H       3.80            #peak   264
 54 SER  H      55 TYR  H       2.94            #peak   268
 54 SER  HA     55 TYR  H       3.08            #peak   269
 54 SER  HB2    55 TYR  H       4.24            #peak   270
 55 TYR  HA     56 GLU  H       3.19            #peak   273
 56 GLU  HA     57 VAL  H       2.80            #peak   279
 56 GLU  HB2    57 VAL  H       4.13            #peak   280
 57 VAL  HA     58 PHE  H       3.30            #peak   284
 58 PHE  HA     59 VAL  H       3.52            #peak   289
 59 VAL  HA     60 ASP  H       3.19            #peak   295
 59 VAL  HB     60 ASP  H       3.80            #peak   296
 60 ASP  HA     61 LEU  H       3.34            #peak   300
 61 LEU  H      62 THR  H       4.38            #peak   303
 62 THR  H      63 GLU  H       3.91            #peak   310
 63 GLU  H      64 ALA  H       2.87            #peak   314
 63 GLU  HA     64 ALA  H       3.41            #peak   315
 63 GLU  HB3    64 ALA  H       4.85            #peak   317
 64 ALA  HA     65 GLY  H       2.87            #peak   321
 65 GLY  HA2    66 GLU  H       3.34            #peak   324
 65 GLY  HA3    66 GLU  H       3.34            #peak   325
 66 GLU  HA     67 GLY  H       3.12            #peak   327
 67 GLY  H      68 SER  H       4.34            #peak   331
 67 GLY  HA3    68 SER  H       3.01            #peak   333
 68 SER  HA     69 HIS  H       2.98            #peak   335
 69 HIS  HA     70 THR  H       3.19            #peak   339
 70 THR  HA     71 VAL  H       3.05            #peak   344
 71 VAL  HA     72 ASP  H       2.90            #peak   348
 72 ASP  HA     73 VAL  H       2.98            #peak   353
 72 ASP  HB2    73 VAL  H       4.16            #peak   354
 72 ASP  HB3    73 VAL  H       4.16            #peak   355
 75 HIS  HA     76 ARG  H       3.41            #peak   366
 76 ARG  HA     77 GLY  H       3.19            #peak   371
 80 GLY  H      81 ASP  H       3.34            #peak   384
 81 ASP  HA     82 LEU  H       3.44            #peak   388
 81 ASP  HB3    82 LEU  H       3.98            #peak   390
 82 LEU  HA     83 ALA  H       3.26            #peak   392
 83 ALA  H      84 VAL  H       4.81            #peak   398
 83 ALA  HA     84 VAL  H       2.87            #peak   399
 84 VAL  HA     85 THR  H       3.12            #peak   402
 86 VAL  HA     87 GLU  H       2.87            #peak   411
 88 PRO  HA     89 ARG  H       2.90            #peak   415
 88 PRO  HB2    89 ARG  H       3.73            #peak   416
 88 PRO  HB3    89 ARG  H       3.73            #peak   417
 89 ARG  H      90 MET  H       2.98            #peak   421
 90 MET  HA     91 ALA  H       3.05            #peak   429
 91 ALA  HA     92 ARG  H       2.94            #peak   434
 92 ARG  HB3    93 VAL  H       5.46            #peak   439
 93 VAL  HA     94 GLN  H       3.23            #peak   444
 93 VAL  HB     94 GLN  H       4.70            #peak   445
 94 GLN  HA     95 LEU  H       3.30            #peak   449
 95 LEU  HA     96 GLU  H       2.98            #peak   456
 96 GLU  HA     97 GLU  H       3.01            #peak   463
 96 GLU  HB3    97 GLU  H       4.20            #peak   465
 97 GLU  HA     98 ARG  H       3.12            #peak   469
 97 GLU  HB3    98 ARG  H       4.67            #peak   471
 98 ARG  H      99 GLN  H       5.86            #peak   473
 98 ARG  HB2    99 GLN  H       3.98            #peak   475
 98 ARG  HB3    99 GLN  H       3.95            #peak   476
 99 GLN  HA    100 THR  H       3.44            #peak   481
 99 GLN  HB2   100 THR  H       4.81            #peak   482
101 VAL  HB    102 SER  H       4.58            #peak   493
105 VAL  HB    106 THR  H       4.90            #peak   508
107 VAL  HB    108 GLU  H       5.23            #peak   517
109 MET  HA    110 ILE  H       4.15            #peak   526
110 ILE  H     111 ASN  H       5.32            #peak   532
110 ILE  HA    111 ASN  H       4.00            #peak   533
110 ILE  HB    111 ASN  H       6.40            #peak   534
111 ASN  HA    112 LEU  H       4.15            #peak   540
  4 PHE  H       4 PHE  HB2     3.41            #peak   551
  4 PHE  H       4 PHE  HB3     3.41            #peak   552
  5 ASP  H       5 ASP  HB3     3.52            #peak   559
  8 ASN  H       8 ASN  HB2     3.84            #peak   570
  8 ASN  H       8 ASN  HB3     3.84            #peak   571
 10 SER  H      10 SER  HB2     3.80            #peak   583
 10 SER  H      10 SER  HB3     3.80            #peak   584
 13 GLU  H      13 GLU  HB2     3.66            #peak   596
 13 GLU  H      13 GLU  HB3     3.66            #peak   597
 14 LEU  H      14 LEU  HB2     3.88            #peak   603
 16 LEU  H      16 LEU  HB2     3.73            #peak   614
 16 LEU  H      16 LEU  HB3     3.73            #peak   615
 18 VAL  H      18 VAL  HB      3.52            #peak   625
 21 ASP  H      21 ASP  HB2     4.20            #peak   643
 21 ASP  H      21 ASP  HB3     4.20            #peak   644
 22 GLU  H      22 GLU  HB2     3.70            #peak   647
 23 GLU  H      23 GLU  HB2     3.52            #peak   653
 24 ARG  H      24 ARG  HB2     3.59            #peak   658
 24 ARG  H      24 ARG  HB3     3.59            #peak   659
 25 TYR  H      25 TYR  HB2     3.80            #peak   664
 25 TYR  H      25 TYR  HB3     3.80            #peak   665
 27 ILE  H      27 ILE  HB      3.19            #peak   674
 31 THR  H      31 THR  HB      3.55            #peak   697
 32 GLU  H      32 GLU  HB3     3.84            #peak   702
 36 VAL  H      36 VAL  HB      3.44            #peak   723
 38 LEU  H      38 LEU  HB2     4.13            #peak   732
 38 LEU  H      38 LEU  HB3     4.13            #peak   733
 39 GLU  H      39 GLU  HB3     4.16            #peak   739
 39 GLU  H      39 GLU  HB2     3.91            #peak   740
 44 VAL  H      44 VAL  HB      3.16            #peak   756
 45 LEU  H      45 LEU  HB2     3.23            #peak   761
 45 LEU  H      45 LEU  HB3     3.62            #peak   762
 52 ARG  H      52 ARG  HB2     2.90            #peak   800
 52 ARG  H      52 ARG  HB3     3.30            #peak   801
 56 GLU  H      56 GLU  HB2     3.98            #peak   817
 60 ASP  H      60 ASP  HB2     3.88            #peak   838
 60 ASP  H      60 ASP  HB3     3.88            #peak   839
 63 GLU  H      63 GLU  HB2     3.88            #peak   853
 63 GLU  H      63 GLU  HB3     3.62            #peak   854
 66 GLU  H      66 GLU  HB2     3.55            #peak   865
 66 GLU  H      66 GLU  HB3     3.55            #peak   866
 72 ASP  H      72 ASP  HB2     3.77            #peak   891
 72 ASP  H      72 ASP  HB3     3.77            #peak   892
 73 VAL  H      73 VAL  HB      3.34            #peak   895
 81 ASP  H      81 ASP  HB2     3.34            #peak   928
 82 LEU  H      82 LEU  HB2     3.59            #peak   932
 82 LEU  H      82 LEU  HB3     3.59            #peak   933
 84 VAL  H      84 VAL  HB      3.34            #peak   942
 93 VAL  H      93 VAL  HB      4.20            #peak   982
100 THR  H     100 THR  HB      3.96            #peak  1026
103 VAL  H     103 VAL  HB      3.87            #peak  1038
105 VAL  H     105 VAL  HB      3.77            #peak  1043
108 GLU  H     108 GLU  HB2     4.62            #peak  1057
109 MET  H     109 MET  HB2     5.46            #peak  1062
110 ILE  H     110 ILE  HB      4.62            #peak  1069
  6 HIS  H       7 GLY  H       4.81            #peak  1090
 11 LEU  H      12 GLY  H       3.59            #peak  1095
 22 GLU  H      23 GLU  H       3.12            #peak  1106
 42 ARG  H      43 GLY  H       4.67            #peak  1124
 44 VAL  H      45 LEU  H       3.23            #peak  1126
 47 VAL  H      48 PHE  H       3.12            #peak  1129
 64 ALA  H      65 GLY  H       4.67            #peak  1144
 65 GLY  H      66 GLU  H       3.84            #peak  1145
 81 ASP  H      82 LEU  H       3.08            #peak  1159
 99 GLN  H     100 THR  H       5.75            #peak  1175
102 SER  H     103 VAL  H       4.67            #peak  1178
 42 ARG  HA     45 LEU  H       4.27            #peak  4045
  7 GLY  H      40 GLY  H       3.41            #peak  6002
  9 LEU  H      39 GLU  HA      3.84            #peak  6014
 14 LEU  H      34 VAL  H       3.70            #peak  6029
 16 LEU  H      33 THR  HA      3.77            #peak  6044
 17 THR  H      58 PHE  HA      3.98            #peak  6053
 21 ASP  HA     23 GLU  H       4.31            #peak  6091
 26 ASP  H      96 GLU  H       3.84            #peak  6118
 27 ILE  HA     29 GLU  H       3.95            #peak  6136
 29 GLU  H      94 GLN  H       3.62            #peak  6137
 16 LEU  H      34 VAL  H       4.63            #peak  6173
 12 GLY  H      36 VAL  H       4.16            #peak  6193
  8 ASN  HA     40 GLY  H       5.50            #peak  6236
  6 HIS  HA     42 ARG  H       3.84            #peak  6239
 47 VAL  H      48 PHE  QB      5.62            #peak  6284
 47 VAL  HA     50 PHE  H       4.20            #peak  6304
 48 PHE  HA     51 ALA  H       4.06            #peak  6305
 49 ARG  H      51 ALA  H       4.45            #peak  6310
 53 PRO  HA     55 TYR  H       3.62            #peak  6322
 18 VAL  HA     59 VAL  H       3.95            #peak  6353
 61 LEU  HA     64 ALA  H       4.02            #peak  6376
 61 LEU  HA     63 GLU  H       4.88            #peak  6377
 71 VAL  H      91 ALA  H       3.48            #peak  6409
 73 VAL  H      91 ALA  H       4.67            #peak  6411
 73 VAL  H      90 MET  HA      3.77            #peak  6416
 56 GLU  H      76 ARG  H       3.95            #peak  6425
 36 VAL  HA     85 THR  H       4.56            #peak  6505
 38 LEU  HA     85 THR  H       5.21            #peak  6506
 37 ASP  H      85 THR  H       4.02            #peak  6510
 35 GLN  H      87 GLU  H       3.88            #peak  6535
 88 PRO  HA     90 MET  H       4.42            #peak  6545
 28 VAL  H      96 GLU  H       4.42            #peak  6608
 25 TYR  HA     98 ARG  H       3.62            #peak  6616
 26 ASP  H      98 ARG  H       4.31            #peak  6619
  8 ASN  H       9 LEU  H       4.42            #peak  6648
 30 GLN  HA     94 GLN  H       3.91            #peak  6731
 68 SER  H      69 HIS  H       4.56            #peak  6738
 55 TYR  H      56 GLU  H       4.49            #peak  6739
 45 LEU  HA     48 PHE  H       4.45            #peak  6804
 19 LEU  H      59 VAL  H       4.45            #peak  6812
 39 GLU  H      83 ALA  H       3.88            #peak  6834
  7 GLY  H      42 ARG  H       4.27            #peak  6889
 79 PRO  QB     81 ASP  H       5.05            #peak  7049
  9 LEU  HG     10 SER  H       4.60            #peak    39
 14 LEU  HG     15 GLU  H       4.96            #peak    65
 20 TYR  QD     21 ASP  H       8.13            #peak   100
 22 GLU  HG2    23 GLU  H       5.10            #peak   110
 22 GLU  HG3    23 GLU  H       5.10            #peak   111
 32 GLU  HG2    33 THR  H       4.88            #peak   164
 35 GLN  HG2    36 VAL  H       4.85            #peak   178
 56 GLU  QG     57 VAL  H       5.30            #peak   282
 63 GLU  HG3    64 ALA  H       4.81            #peak   319
 66 GLU  QG     67 GLY  H       6.05            #peak   330
 89 ARG  HG2    90 MET  H       4.63            #peak   424
 89 ARG  HG3    90 MET  H       4.63            #peak   425
 98 ARG  HG2    99 GLN  H       4.45            #peak   477
 98 ARG  HG3    99 GLN  H       4.45            #peak   478
 99 GLN  QG    100 THR  H       7.40            #peak   484
  9 LEU  H       9 LEU  HG      4.88            #peak   578
 13 GLU  H      13 GLU  HG2     3.59            #peak   598
 13 GLU  H      13 GLU  HG3     3.59            #peak   599
 14 LEU  H      14 LEU  HG      4.02            #peak   604
 15 GLU  H      15 GLU  HG2     4.13            #peak   610
 22 GLU  H      22 GLU  HG3     3.77            #peak   650
 23 GLU  H      23 GLU  HG3     3.55            #peak   655
 24 ARG  H      24 ARG  HG3     5.86            #peak   660
 27 ILE  H      27 ILE  HG12    4.60            #peak   676
 27 ILE  H      27 ILE  HG13    4.60            #peak   677
 29 GLU  H      29 GLU  QG      5.37            #peak   687
 32 GLU  H      32 GLU  HG3     3.70            #peak   704
 38 LEU  H      38 LEU  HG      4.06            #peak   734
 45 LEU  H      45 LEU  HG      5.71            #peak   763
 49 ARG  H      49 ARG  HG2     4.16            #peak   785
 49 ARG  H      49 ARG  HG3     4.16            #peak   786
 52 ARG  H      52 ARG  HG2     4.20            #peak   802
 52 ARG  H      52 ARG  HG3     4.20            #peak   803
 56 GLU  H      56 GLU  QG      5.91            #peak   819
 63 GLU  H      63 GLU  HG2     3.98            #peak   855
 63 GLU  H      63 GLU  HG3     3.44            #peak   856
 66 GLU  H      66 GLU  QG      5.95            #peak   867
 82 LEU  H      82 LEU  HG      3.37            #peak   934
 89 ARG  H      89 ARG  HG2     3.88            #peak   961
 90 MET  H      90 MET  QG      4.54            #peak   968
 94 GLN  H      94 GLN  HG2     5.17            #peak   988
 94 GLN  H      94 GLN  HG3     5.17            #peak   989
 97 GLU  H      97 GLU  QG      5.15            #peak  1009
 98 ARG  H      98 ARG  HG2     5.68            #peak  1014
 98 ARG  H      98 ARG  HG3     5.68            #peak  1015
 99 GLN  H      99 GLN  QG      4.61            #peak  1021
108 GLU  H     108 GLU  QG      8.29            #peak  1059
110 ILE  H     110 ILE  HG13    7.80            #peak  1072
112 LEU  H     112 LEU  HG      7.42            #peak  1084
 94 GLN  QB     94 GLN  HE21    5.69            #peak  5055
 94 GLN  HG2    94 GLN  HE21    3.62            #peak  5056
 94 GLN  HG3    94 GLN  HE21    3.62            #peak  5057
 94 GLN  QB     94 GLN  HE22    5.69            #peak  5062
 94 GLN  HG2    94 GLN  HE22    3.62            #peak  5063
 94 GLN  HG3    94 GLN  HE22    3.62            #peak  5064
  8 ASN  HD21   39 GLU  HG3     6.00            #peak  6007
  8 ASN  HD21   39 GLU  HB3     5.03            #peak  6008
  8 ASN  HD22   39 GLU  HG3     6.00            #peak  6010
  8 ASN  HD22   39 GLU  HB3     5.03            #peak  6012
 24 ARG  H      24 ARG  HG2     5.86            #peak  6092
 29 GLU  H      94 GLN  QB      4.76            #peak  6134
 35 GLN  H      87 GLU  QB      6.23            #peak  6176
 34 VAL  HB     87 GLU  H       4.60            #peak  6532
 31 THR  HB     92 ARG  H       5.89            #peak  6566
 25 TYR  QD     98 ARG  H       7.44            #peak  6618
 98 ARG  HG2   100 THR  H       7.62            #peak  6635
 98 ARG  HG3   100 THR  H       7.62            #peak  6636
 52 ARG  H      53 PRO  HD3     5.64            #peak  6666
 52 ARG  H      53 PRO  HD2     5.64            #peak  6667
 54 SER  H      55 TYR  QD      6.33            #peak  6668
 24 ARG  HG3    24 ARG  HE      4.13            #peak  6705
 24 ARG  HG2    24 ARG  HE      4.13            #peak  6712
 98 ARG  HB2    98 ARG  HE      4.06            #peak  6719
 98 ARG  HB3    98 ARG  HE      4.06            #peak  6723
 24 ARG  HE     25 TYR  QE      7.95            #peak  7001
  3 THR  QG2     4 PHE  H       5.00            #peak     9
  9 LEU  QD2    10 SER  H       4.82            #peak    40
  9 LEU  QD1    10 SER  H       3.89            #peak    41
 16 LEU  QD1    17 THR  H       4.36            #peak    79
 19 LEU  QD2    20 TYR  H       3.92            #peak    95
 27 ILE  QG2    28 VAL  H       3.89            #peak   136
 28 VAL  QG1    29 GLU  H       4.54            #peak   143
 28 VAL  QG2    29 GLU  H       4.53            #peak   144
 33 THR  QG2    34 VAL  H       4.43            #peak   169
 36 VAL  QG1    37 ASP  H       4.79            #peak   186
 38 LEU  QD2    39 GLU  H       4.93            #peak   196
 45 LEU  QD2    46 THR  H       6.95            #peak   228
 46 THR  QG2    47 VAL  H       4.61            #peak   233
 47 VAL  QG2    48 PHE  H       5.11            #peak   237
 51 ALA  QB     52 ARG  H       3.85            #peak   261
 59 VAL  QG1    60 ASP  H       5.51            #peak   297
 60 ASP  H      71 VAL  QG2     5.58            #peak   298
 64 ALA  QB     65 GLY  H       3.78            #peak   322
 71 VAL  QG1    72 ASP  H       4.90            #peak   350
 82 LEU  QD2    83 ALA  H       4.75            #peak   396
 82 LEU  QD1    83 ALA  H       7.02            #peak   397
 84 VAL  QG1    85 THR  H       4.18            #peak   405
 91 ALA  QB     92 ARG  H       3.81            #peak   435
 93 VAL  QG2    94 GLN  H       5.58            #peak   446
 93 VAL  QG1    94 GLN  H       4.75            #peak   447
101 VAL  QG1   102 SER  H       6.03            #peak   494
101 VAL  QG2   102 SER  H       6.03            #peak   495
105 VAL  QG1   106 THR  H       7.67            #peak   509
106 THR  QG2   107 VAL  H       6.70            #peak   514
107 VAL  QG1   108 GLU  H       6.73            #peak   518
107 VAL  QG2   108 GLU  H       6.73            #peak   519
  9 LEU  H       9 LEU  QD2     5.72            #peak   579
 11 LEU  H      11 LEU  QD1     7.02            #peak   590
 16 LEU  H      16 LEU  QD2     6.26            #peak   617
 16 LEU  H      16 LEU  QD1     5.40            #peak   618
 18 VAL  H      18 VAL  QG2     4.25            #peak   626
 18 VAL  H      18 VAL  QG1     4.57            #peak   627
 19 LEU  H      19 LEU  QD2     5.18            #peak   634
 27 ILE  H      27 ILE  QG2     4.53            #peak   675
 27 ILE  H      27 ILE  QD1     4.86            #peak   678
 28 VAL  H      28 VAL  QG2     4.10            #peak   683
 33 THR  H      33 THR  QG2     4.57            #peak   708
 34 VAL  H      34 VAL  QG1     4.86            #peak   712
 36 VAL  H      36 VAL  QG2     4.46            #peak   724
 44 VAL  H      44 VAL  QG2     3.78            #peak   757
 44 VAL  H      44 VAL  QG1     4.68            #peak   758
 45 LEU  H      45 LEU  QD2     4.75            #peak   764
 45 LEU  H      45 LEU  QD1     5.29            #peak   765
 47 VAL  H      47 VAL  QG2     3.53            #peak   773
 47 VAL  H      47 VAL  QG1     4.46            #peak   774
 59 VAL  H      59 VAL  QG2     4.28            #peak   835
 61 LEU  H      61 LEU  QD1     7.02            #peak   845
 64 ALA  H      64 ALA  QB      3.42            #peak   859
 73 VAL  H      73 VAL  QG2     3.71            #peak   896
 73 VAL  H      73 VAL  QG1     4.50            #peak   897
 82 LEU  H      82 LEU  QD2     4.75            #peak   935
 82 LEU  H      82 LEU  QD1     4.75            #peak   936
100 THR  H     100 THR  QG2     5.71            #peak  1027
101 VAL  H     101 VAL  QG1     4.86            #peak  1031
103 VAL  H     103 VAL  QG1     5.56            #peak  1039
103 VAL  H     103 VAL  QG2     5.56            #peak  1040
105 VAL  H     105 VAL  QG1     6.08            #peak  1044
105 VAL  H     105 VAL  QG2     6.08            #peak  1045
  7 GLY  H      45 LEU  QD1     4.43            #peak  6001
  8 ASN  H      45 LEU  QD1     4.79            #peak  6005
 27 ILE  QG2    29 GLU  H       3.92            #peak  6131
 27 ILE  QG2    30 GLN  H       5.47            #peak  6140
 31 THR  H      91 ALA  QB      5.72            #peak  6141
 31 THR  QG2    33 THR  H       4.57            #peak  6150
 44 VAL  H      82 LEU  QD2     6.55            #peak  6243
 58 PHE  H      59 VAL  QG2     5.43            #peak  6344
 16 LEU  QD1    59 VAL  H       4.97            #peak  6346
 18 VAL  QG1    59 VAL  H       6.05            #peak  6347
 70 THR  H      71 VAL  QG1     5.18            #peak  6391
 59 VAL  QG1    74 GLU  H       4.72            #peak  6419
 11 LEU  QD2    78 PHE  H       6.05            #peak  6430
 36 VAL  QG1    85 THR  H       6.70            #peak  6497
 85 THR  H      86 VAL  QG2     6.23            #peak  6498
 34 VAL  QG1    87 GLU  H       4.72            #peak  6531
 59 VAL  QG2    91 ALA  H       7.02            #peak  6554
 73 VAL  QG2    91 ALA  H       4.32            #peak  6555
 28 VAL  QG1    94 GLN  HE21    5.36            #peak  6573
 28 VAL  QG2    94 GLN  HE22    5.54            #peak  6574
 40 GLY  H      45 LEU  QD1     4.93            #peak  6645
 31 THR  QG2    92 ARG  H       5.61            #peak  6728
 28 VAL  QG2    94 GLN  HE21    5.54            #peak  6741
 58 PHE  H      73 VAL  QG2     6.41            #peak  6744
 40 GLY  H      45 LEU  QD2     5.47            #peak  6811
 16 LEU  QD1    31 THR  H       5.22            #peak  6829
 16 LEU  QD2    31 THR  H       6.01            #peak  6830
 28 VAL  QG1    94 GLN  HE22    5.36            #peak  6832
 83 ALA  H      84 VAL  QG2     6.30            #peak  6870
 14 LEU  H      34 VAL  QG2     6.30            #peak  6888
  7 GLY  H      45 LEU  QD2     6.59            #peak  6890
 28 VAL  QG1    96 GLU  H       6.26            #peak  6897
 71 VAL  H      91 ALA  QB      5.04            #peak  6903
 59 VAL  QG2    60 ASP  H       5.61            #peak  6930
 59 VAL  QG1    71 VAL  H       5.18            #peak  7020
 59 VAL  QG1    91 ALA  H       7.02            #peak  7023
 58 PHE  H      73 VAL  QG1     6.44            #peak  7052
  3 THR  HA      3 THR  HB      2.83            #peak  1227
  4 PHE  HA      4 PHE  HB2     2.80            #peak  1236
  4 PHE  HA      4 PHE  HB3     2.80            #peak  1237
  5 ASP  HA      5 ASP  HB2     2.94            #peak  1257
  5 ASP  H       5 ASP  HB2     3.37            #peak  1259
 17 THR  H      17 THR  HB      3.55            #peak  1529
 22 GLU  H      22 GLU  HB3     3.70            #peak  1641
 26 ASP  H      26 ASP  HB2     3.84            #peak  1731
 26 ASP  H      26 ASP  HB3     3.84            #peak  1735
 28 VAL  H      28 VAL  HB      4.06            #peak  1786
 32 GLU  H      32 GLU  HB2     3.84            #peak  1859
 37 ASP  H      37 ASP  HB2     4.13            #peak  1967
 46 THR  H      46 THR  HB      3.08            #peak  2187
 47 VAL  H      47 VAL  HB      2.90            #peak  2200
 49 ARG  H      49 ARG  HB3     3.23            #peak  2234
 49 ARG  H      49 ARG  HB2     3.05            #peak  2241
 50 PHE  HA     50 PHE  HB3     2.90            #peak  2272
 50 PHE  H      50 PHE  HB2     3.08            #peak  2276
 50 PHE  H      50 PHE  HB3     3.41            #peak  2283
 52 ARG  HA     52 ARG  HB2     2.94            #peak  2304
 54 SER  H      54 SER  HB2     3.26            #peak  2378
 54 SER  HA     54 SER  HB2     2.90            #peak  2379
 54 SER  H      54 SER  HB3     3.26            #peak  2382
 54 SER  HA     54 SER  HB3     2.90            #peak  2383
 56 GLU  H      56 GLU  HB3     3.98            #peak  2414
 68 SER  H      68 SER  HB2     3.01            #peak  2614
 68 SER  H      68 SER  HB3     3.01            #peak  2618
 70 THR  H      70 THR  HB      2.87            #peak  2636
 71 VAL  HA     71 VAL  HB      2.80            #peak  2650
 81 ASP  H      81 ASP  HA      2.94            #peak  2800
 81 ASP  HA     81 ASP  HB2     2.94            #peak  2805
 81 ASP  H      81 ASP  HB3     3.34            #peak  2808
 81 ASP  HA     81 ASP  HB3     2.94            #peak  2809
 85 THR  H      85 THR  HB      3.37            #peak  2884
 86 VAL  H      86 VAL  HB      3.19            #peak  2897
 86 VAL  HA     86 VAL  HB      2.94            #peak  2898
 92 ARG  H      92 ARG  HB2     3.70            #peak  3035
 92 ARG  H      92 ARG  HB3     3.37            #peak  3042
 97 GLU  H      97 GLU  HB2     3.44            #peak  3195
 97 GLU  H      97 GLU  HB3     3.44            #peak  3200
 98 ARG  H      98 ARG  HB2     3.30            #peak  3217
 98 ARG  H      98 ARG  HB3     3.34            #peak  3224
 99 GLN  H      99 GLN  HB2     3.16            #peak  3259
 99 GLN  HA     99 GLN  HB2     3.01            #peak  3260
 99 GLN  H      99 GLN  HB3     3.16            #peak  3266
 99 GLN  HA     99 GLN  HB3     3.01            #peak  3267
100 THR  HA    100 THR  HB      3.41            #peak  3285
101 VAL  HA    101 VAL  HB      3.91            #peak  3294
101 VAL  H     101 VAL  HB      4.71            #peak  3297
103 VAL  HA    103 VAL  HB      3.44            #peak  3324
106 THR  H     106 THR  HB      4.76            #peak  3411
107 VAL  H     107 VAL  HB      4.34            #peak  3424
107 VAL  HA    107 VAL  HB      3.91            #peak  3425
108 GLU  H     108 GLU  HB3     4.62            #peak  3449
109 MET  H     109 MET  HB3     5.46            #peak  3473
  4 PHE  HA      5 ASP  H       2.90            #peak  3610
  5 ASP  HA      6 HIS  H       2.69            #peak  3613
  8 ASN  HA      9 LEU  H       2.87            #peak  3620
  8 ASN  HB2     9 LEU  H       3.62            #peak  3621
  8 ASN  HB3     9 LEU  H       3.62            #peak  3622
 10 SER  HA     11 LEU  H       3.12            #peak  3629
 10 SER  HB2    11 LEU  H       4.56            #peak  3630
 10 SER  HB3    11 LEU  H       4.56            #peak  3631
 24 ARG  HB2    25 TYR  H       4.16            #peak  3689
 24 ARG  HB3    25 TYR  H       4.16            #peak  3690
 26 ASP  HA     27 ILE  H       3.01            #peak  3696
 26 ASP  HB3    27 ILE  H       3.80            #peak  3698
 27 ILE  HA     28 VAL  H       3.48            #peak  3699
 31 THR  HA     32 GLU  H       3.08            #peak  3716
 38 LEU  HB3    39 GLU  H       5.06            #peak  3744
 39 GLU  HB3    40 GLY  H       4.20            #peak  3749
 39 GLU  HB2    40 GLY  H       4.63            #peak  3750
 44 VAL  HB     45 LEU  H       3.34            #peak  3766
 45 LEU  HB2    46 THR  H       4.06            #peak  3770
 46 THR  HB     47 VAL  H       3.23            #peak  3776
 47 VAL  HB     48 PHE  H       3.37            #peak  3779
 49 ARG  HB3    50 PHE  H       4.02            #peak  3785
 49 ARG  HB2    50 PHE  H       4.70            #peak  3786
 50 PHE  HB2    51 ALA  H       3.41            #peak  3791
 50 PHE  HB3    51 ALA  H       3.70            #peak  3792
 54 SER  HB3    55 TYR  H       4.24            #peak  3803
 56 GLU  HB3    57 VAL  H       4.13            #peak  3809
 62 THR  HB     63 GLU  H       4.24            #peak  3831
 66 GLU  HB2    67 GLY  H       3.77            #peak  3843
 66 GLU  HB3    67 GLY  H       3.77            #peak  3844
 67 GLY  HA2    68 SER  H       3.01            #peak  3846
 68 SER  HB2    69 HIS  H       3.91            #peak  3849
 68 SER  HB3    69 HIS  H       3.91            #peak  3850
 71 VAL  HB     72 ASP  H       3.26            #peak  3857
 79 PRO  HA     80 GLY  H       2.90            #peak  3881
 81 ASP  HB2    82 LEU  H       3.98            #peak  3887
 85 THR  HA     86 VAL  H       2.69            #peak  3901
 85 THR  HB     86 VAL  H       3.77            #peak  3902
 86 VAL  HB     87 GLU  H       4.67            #peak  3905
 89 ARG  QB     90 MET  H       4.18            #peak  3915
 92 ARG  HA     93 VAL  H       2.80            #peak  3926
 92 ARG  HB2    93 VAL  H       4.20            #peak  3927
 96 GLU  HB2    97 GLU  H       4.20            #peak  3947
 97 GLU  HB2    98 ARG  H       4.67            #peak  3952
 98 ARG  HA     99 GLN  H       2.65            #peak  3955
 99 GLN  HB3   100 THR  H       4.81            #peak  3963
100 THR  HA    101 VAL  H       3.21            #peak  3965
100 THR  HB    101 VAL  H       4.58            #peak  3966
101 VAL  HA    102 SER  H       3.26            #peak  3968
102 SER  HA    103 VAL  H       3.12            #peak  3972
104 PRO  HA    105 VAL  H       3.12            #peak  3976
104 PRO  HB2   105 VAL  H       4.52            #peak  3977
104 PRO  HB3   105 VAL  H       4.52            #peak  3978
105 VAL  HA    106 THR  H       3.50            #peak  3981
106 THR  HA    107 VAL  H       3.26            #peak  3985
106 THR  HB    107 VAL  H       4.24            #peak  3986
107 VAL  HA    108 GLU  H       3.73            #peak  3988
108 GLU  HA    109 MET  H       3.91            #peak  3992
 42 ARG  HA     45 LEU  HB2     4.49            #peak  4014
 44 VAL  HA     47 VAL  H       4.38            #peak  4023
 44 VAL  HA     47 VAL  HB      3.55            #peak  4024
 45 LEU  HA     48 PHE  QB      5.48            #peak  4030
 46 THR  HA     49 ARG  HB3     3.66            #peak  4035
 46 THR  HA     49 ARG  HB2     3.62            #peak  4037
 22 GLU  HA     25 TYR  H       4.45            #peak  6089
 10 SER  HA     37 ASP  HA      3.59            #peak  6198
  8 ASN  HA     39 GLU  HA      3.80            #peak  6229
 46 THR  HA     49 ARG  H       3.80            #peak  6280
 49 ARG  HA     51 ALA  H       4.34            #peak  6292
 57 VAL  HA     75 HIS  HA      4.02            #peak  6340
 20 TYR  HA     62 THR  HA      3.55            #peak  6371
 70 THR  HA     92 ARG  HA      3.41            #peak  6400
 74 GLU  HA     75 HIS  H       3.52            #peak  6422
 83 ALA  HA     84 VAL  HB      5.24            #peak  6486
 38 LEU  HA     84 VAL  HA      4.96            #peak  6495
 23 GLU  H      23 GLU  HB3     3.52            #peak  6625
 43 GLY  QA     47 VAL  H       5.48            #peak  6663
 87 GLU  HA     88 PRO  HA      3.41            #peak  6821
 13 GLU  HA     36 VAL  H       4.31            #peak  6915
 11 LEU  H      37 ASP  HA      3.73            #peak  6916
  6 HIS  HA     41 PRO  HA      3.98            #peak  6944
 15 GLU  HA     33 THR  HA      4.31            #peak  6959
 23 GLU  HB3    24 ARG  H       4.74            #peak  6993
 30 GLN  HA     93 VAL  HA      3.77            #peak  7014
 86 VAL  HB     89 ARG  HA      4.34            #peak  7046
 11 LEU  H      11 LEU  HG      4.67            #peak  1367
 15 GLU  H      15 GLU  HG3     4.13            #peak  1478
 22 GLU  H      22 GLU  HG2     3.77            #peak  1647
 23 GLU  H      23 GLU  HG2     3.55            #peak  1669
 23 GLU  HA     23 GLU  HG2     3.77            #peak  1670
 23 GLU  HA     23 GLU  HG3     3.77            #peak  1675
 32 GLU  H      32 GLU  HG2     3.70            #peak  1871
 32 GLU  HA     32 GLU  HG2     3.73            #peak  1872
 32 GLU  HA     32 GLU  HG3     3.73            #peak  1878
 35 GLN  H      35 GLN  HG2     5.46            #peak  1929
 35 GLN  H      35 GLN  HG3     5.46            #peak  1936
 39 GLU  HA     39 GLU  HG2     4.16            #peak  2036
 39 GLU  HA     39 GLU  HG3     4.16            #peak  2042
 42 ARG  HA     42 ARG  QD      6.88            #peak  2114
 45 LEU  HB2    45 LEU  HG      2.83            #peak  2164
 49 ARG  HA     49 ARG  HG2     3.88            #peak  2249
 49 ARG  HA     49 ARG  HG3     3.88            #peak  2256
 52 ARG  HA     53 PRO  HD3     3.88            #peak  2301
 52 ARG  HA     53 PRO  HD2     3.88            #peak  2302
 52 ARG  HA     52 ARG  HG2     4.09            #peak  2318
 52 ARG  HA     52 ARG  HG3     4.09            #peak  2325
 52 ARG  H      52 ARG  QD      6.88            #peak  2331
 52 ARG  HA     52 ARG  QD      6.52            #peak  2332
 63 GLU  HA     63 GLU  HG2     3.41            #peak  2561
 63 GLU  HB2    63 GLU  HG2     2.76            #peak  2562
 63 GLU  HA     63 GLU  HG3     3.66            #peak  2567
 63 GLU  HB2    63 GLU  HG3     2.40            #peak  2568
 63 GLU  HB3    63 GLU  HG3     2.83            #peak  2569
 89 ARG  HA     89 ARG  HG2     3.80            #peak  2963
 89 ARG  HA     89 ARG  HG3     3.80            #peak  2964
 89 ARG  H      89 ARG  HG3     3.88            #peak  2981
 89 ARG  H      89 ARG  HD2     6.00            #peak  2988
 89 ARG  HA     89 ARG  HD2     4.42            #peak  2989
 89 ARG  H      89 ARG  HD3     6.00            #peak  2995
 89 ARG  HA     89 ARG  HD3     4.42            #peak  2996
 92 ARG  HA     92 ARG  QD      6.20            #peak  3064
 94 GLN  HA     94 GLN  HG2     4.02            #peak  3105
 94 GLN  HA     94 GLN  HG3     4.02            #peak  3112
 95 LEU  H      95 LEU  HG      6.00            #peak  3139
 98 ARG  HA     98 ARG  HG2     4.16            #peak  3214
 98 ARG  HA     98 ARG  HG3     4.16            #peak  3239
 98 ARG  H      98 ARG  QD      5.98            #peak  3245
 98 ARG  HA     98 ARG  QD      5.98            #peak  3246
110 ILE  H     110 ILE  HG12    7.80            #peak  3522
112 LEU  HB2   112 LEU  HG      3.73            #peak  3572
112 LEU  HB3   112 LEU  HG      3.73            #peak  3579
 29 GLU  QG     30 GLN  H       5.48            #peak  3711
 32 GLU  HG3    33 THR  H       4.88            #peak  3723
 35 GLN  HG3    36 VAL  H       4.85            #peak  3734
 39 GLU  HG2    40 GLY  H       4.52            #peak  3751
 39 GLU  HG3    40 GLY  H       4.52            #peak  3752
 90 MET  QG     91 ALA  H       6.88            #peak  3922
 97 GLU  QG     98 ARG  H       6.05            #peak  3954
 98 ARG  QD     99 GLN  H       6.88            #peak  3960
 17 THR  HB     58 PHE  QB      5.84            #peak  6051
 20 TYR  QE     22 GLU  HG3     8.13            #peak  6085
 21 ASP  HA     22 GLU  HG3     5.96            #peak  6086
 20 TYR  QE     22 GLU  HG2     8.13            #peak  6087
 21 ASP  HA     22 GLU  HG2     5.96            #peak  6088
 37 ASP  HB3    85 THR  HB      4.96            #peak  6197
  8 ASN  HD22   39 GLU  HG2     6.00            #peak  6230
 48 PHE  QD     49 ARG  HA      8.13            #peak  6293
 46 THR  HA     49 ARG  HG2     4.99            #peak  6295
 46 THR  HA     49 ARG  HG3     4.99            #peak  6296
 53 PRO  HA     55 TYR  QD      7.52            #peak  6317
 37 ASP  HB2    85 THR  HB      4.34            #peak  6503
 89 ARG  QB     90 MET  QG      7.54            #peak  6541
 72 ASP  HA     90 MET  QG      4.79            #peak  6547
 73 VAL  H      90 MET  QG      6.67            #peak  6553
 25 TYR  QD     97 GLU  QG      9.01            #peak  6612
 98 ARG  HA     99 GLN  QG      5.98            #peak  6629
 98 ARG  HB2    99 GLN  QG      6.88            #peak  6631
 24 ARG  H      24 ARG  QD      5.84            #peak  6659
103 VAL  HA    104 PRO  HD3     3.41            #peak  6732
103 VAL  HA    104 PRO  HD2     3.41            #peak  6733
 29 GLU  QB     94 GLN  H       6.88            #peak  6833
 28 VAL  HA     94 GLN  QB      6.88            #peak  6895
 14 LEU  H      33 THR  HB      6.00            #peak  6952
 18 VAL  HA     59 VAL  HB      5.78            #peak  6972
 28 VAL  HB     94 GLN  QB      6.88            #peak  7007
  9 LEU  HA      9 LEU  QD2     7.02            #peak  1330
  9 LEU  H       9 LEU  QD1     5.40            #peak  1336
  9 LEU  HA      9 LEU  QD1     3.74            #peak  1337
 11 LEU  HA     11 LEU  QD1     5.47            #peak  1360
 11 LEU  H      11 LEU  QD2     5.54            #peak  1373
 11 LEU  HA     11 LEU  QD2     3.60            #peak  1374
 14 LEU  H      14 LEU  QD1     4.86            #peak  1449
 14 LEU  HA     14 LEU  QD1     5.15            #peak  1450
 14 LEU  HB3    14 LEU  QD1     3.42            #peak  1451
 14 LEU  HB2    14 LEU  QD1     3.67            #peak  1452
 14 LEU  H      14 LEU  QD2     5.29            #peak  1456
 14 LEU  HA     14 LEU  QD2     3.81            #peak  1457
 16 LEU  HA     16 LEU  QD1     3.92            #peak  1519
 19 LEU  H      19 LEU  QD1     4.93            #peak  1585
 19 LEU  HA     19 LEU  QD2     3.71            #peak  1593
 28 VAL  H      28 VAL  QG1     4.64            #peak  1791
 34 VAL  H      34 VAL  QG2     4.21            #peak  1910
 38 LEU  H      38 LEU  QD2     5.47            #peak  2003
 38 LEU  HA     38 LEU  QD2     3.92            #peak  2004
 38 LEU  H      38 LEU  QD1     5.15            #peak  2010
 38 LEU  HA     38 LEU  QD1     7.02            #peak  2011
 45 LEU  HA     45 LEU  QD2     4.25            #peak  2170
 45 LEU  HA     45 LEU  QD1     5.76            #peak  2177
 45 LEU  HB2    45 LEU  QD1     3.64            #peak  2178
 46 THR  HA     46 THR  QG2     3.42            #peak  2192
 47 VAL  HA     47 VAL  QG2     3.53            #peak  2206
 51 ALA  H      51 ALA  QB      3.42            #peak  2293
 61 LEU  HA     61 LEU  QD1     4.97            #peak  2517
 61 LEU  H      61 LEU  QD2     7.02            #peak  2523
 61 LEU  HA     61 LEU  QD2     3.78            #peak  2524
 62 THR  H      62 THR  QG2     4.28            #peak  2538
 71 VAL  H      71 VAL  QG1     4.07            #peak  2654
 71 VAL  H      71 VAL  QG2     4.03            #peak  2659
 82 LEU  HA     82 LEU  QD1     6.16            #peak  2818
 82 LEU  HA     82 LEU  QD2     4.17            #peak  2841
 83 ALA  H      83 ALA  QB      3.67            #peak  2857
 84 VAL  H      84 VAL  QG2     4.28            #peak  2870
 86 VAL  H      86 VAL  QG1     4.82            #peak  2902
 86 VAL  H      86 VAL  QG2     3.85            #peak  2907
 90 MET  H      90 MET  QE      7.02            #peak  3017
 90 MET  HA     90 MET  QE      5.51            #peak  3018
 95 LEU  H      95 LEU  QD2     4.79            #peak  3146
 95 LEU  HA     95 LEU  QD2     3.92            #peak  3147
 95 LEU  H      95 LEU  QD1     5.18            #peak  3153
 95 LEU  HA     95 LEU  QD1     6.55            #peak  3154
101 VAL  H     101 VAL  QG2     4.86            #peak  3307
110 ILE  QG2   110 ILE  QD1     5.77            #peak  3521
110 ILE  H     110 ILE  QD1     9.13            #peak  3536
 14 LEU  QD1    15 GLU  H       5.76            #peak  3648
 14 LEU  QD2    15 GLU  H       3.42            #peak  3649
 17 THR  QG2    18 VAL  H       3.92            #peak  3662
 18 VAL  QG2    19 LEU  H       5.65            #peak  3665
 18 VAL  QG1    19 LEU  H       4.54            #peak  3666
 31 THR  QG2    32 GLU  H       4.75            #peak  3718
 34 VAL  QG1    35 GLN  H       4.64            #peak  3729
 34 VAL  QG2    35 GLN  H       5.58            #peak  3730
 36 VAL  QG2    37 ASP  H       5.00            #peak  3737
 44 VAL  QG2    45 LEU  H       6.01            #peak  3767
 44 VAL  QG1    45 LEU  H       6.98            #peak  3768
 47 VAL  QG1    48 PHE  H       5.33            #peak  3781
 62 THR  QG2    63 GLU  H       4.57            #peak  3832
 70 THR  QG2    71 VAL  H       4.32            #peak  3855
 71 VAL  QG2    72 ASP  H       4.43            #peak  3859
 73 VAL  QG2    74 GLU  H       4.71            #peak  3865
 73 VAL  QG1    74 GLU  H       4.03            #peak  3866
 83 ALA  QB     84 VAL  H       4.07            #peak  3896
 84 VAL  QG2    85 THR  H       5.36            #peak  3899
 85 THR  QG2    86 VAL  H       4.03            #peak  3903
 86 VAL  QG1    87 GLU  H       4.28            #peak  3906
 86 VAL  QG2    87 GLU  H       5.29            #peak  3907
 90 MET  QE     91 ALA  H       6.80            #peak  3923
 95 LEU  QD2    96 GLU  H       4.64            #peak  3944
 95 LEU  QD1    96 GLU  H       6.41            #peak  3945
100 THR  QG2   101 VAL  H       5.89            #peak  3967
105 VAL  QG2   106 THR  H       7.67            #peak  3984
  8 ASN  HA     45 LEU  QD1     5.87            #peak  6006
 11 LEU  QD2    55 TYR  QE      8.79            #peak  6015
 11 LEU  QD1    38 LEU  H       5.98            #peak  6016
 11 LEU  QD1    36 VAL  HB      4.68            #peak  6017
 11 LEU  QD1    78 PHE  HZ      5.58            #peak  6020
 11 LEU  QD1    78 PHE  QE      7.14            #peak  6021
 11 LEU  QD1    78 PHE  QD      8.72            #peak  6023
 11 LEU  QD1    48 PHE  QE      8.25            #peak  6025
 14 LEU  QD1    78 PHE  HZ      4.82            #peak  6032
 14 LEU  QD1    78 PHE  QE      8.25            #peak  6033
 14 LEU  QD1    78 PHE  QD      8.72            #peak  6035
 14 LEU  QD2    78 PHE  QD      9.15            #peak  6037
 15 GLU  HG3    33 THR  QG2     4.79            #peak  6041
 16 LEU  QD1    58 PHE  H       5.36            #peak  6046
 16 LEU  QD1    58 PHE  HA      4.57            #peak  6047
 16 LEU  QD1    57 VAL  HB      4.64            #peak  6049
 19 LEU  QD1    60 ASP  HA      5.62            #peak  6067
 19 LEU  QD1    61 LEU  H       6.08            #peak  6069
 27 ILE  QG2    30 GLN  HB3     4.46            #peak  6121
 18 VAL  HB     27 ILE  QD1     4.00            #peak  6122
 27 ILE  QG2    29 GLU  HA      5.40            #peak  6123
 18 VAL  HA     27 ILE  QD1     6.23            #peak  6124
 27 ILE  QG2    30 GLN  HA      5.54            #peak  6125
 26 ASP  HA     27 ILE  QD1     7.02            #peak  6128
 28 VAL  QG2    96 GLU  H       5.33            #peak  6130
 28 VAL  QG1    29 GLU  QB      5.38            #peak  6132
 28 VAL  QG1    29 GLU  QG      5.27            #peak  6133
 16 LEU  QD2    31 THR  HB      4.79            #peak  6143
 31 THR  QG2    91 ALA  HA      4.93            #peak  6146
 15 GLU  HG2    33 THR  QG2     4.79            #peak  6151
 15 GLU  HA     33 THR  QG2     4.57            #peak  6153
 16 LEU  H      33 THR  QG2     5.07            #peak  6157
 34 VAL  QG2    57 VAL  HB      5.07            #peak  6158
 34 VAL  QG1    35 GLN  QB      5.96            #peak  6159
 31 THR  QG2    34 VAL  QG1     6.45            #peak  6161
 31 THR  QG2    34 VAL  QG2     7.61            #peak  6164
 14 LEU  HB2    34 VAL  QG2     5.51            #peak  6166
 34 VAL  QG1    35 GLN  HA      5.51            #peak  6169
 34 VAL  QG1    86 VAL  HA      6.05            #peak  6170
 33 THR  HB     34 VAL  QG2     6.01            #peak  6171
 33 THR  HA     34 VAL  QG2     5.69            #peak  6172
 36 VAL  QG1    38 LEU  QD1     7.07            #peak  6179
 36 VAL  QG1    38 LEU  QD2     6.38            #peak  6180
 36 VAL  QG1    84 VAL  QG2     7.32            #peak  6181
 14 LEU  QD1    36 VAL  QG1     6.67            #peak  6183
 11 LEU  QD1    36 VAL  QG1     6.38            #peak  6184
 36 VAL  QG1    38 LEU  HA      6.62            #peak  6186
 36 VAL  QG1    78 PHE  QE      8.72            #peak  6188
 36 VAL  QG1    78 PHE  HZ      5.94            #peak  6189
 36 VAL  QG1    38 LEU  H       6.70            #peak  6195
 38 LEU  QD2    85 THR  H       5.72            #peak  6200
 38 LEU  QD2    78 PHE  QD      9.11            #peak  6202
 38 LEU  QD2    78 PHE  QE      8.11            #peak  6203
 38 LEU  QD1    48 PHE  QE      8.04            #peak  6204
 38 LEU  QD1    48 PHE  QD      9.00            #peak  6205
 38 LEU  QD1    78 PHE  QD      7.35            #peak  6206
 38 LEU  QD1    78 PHE  QE      9.15            #peak  6207
 38 LEU  QD2    78 PHE  HZ      7.02            #peak  6208
 38 LEU  QD2    84 VAL  HA      4.89            #peak  6209
 11 LEU  QD1    38 LEU  QD2     6.27            #peak  6211
 11 LEU  QD1    38 LEU  QD1     6.89            #peak  6213
 38 LEU  QD2    84 VAL  QG2     5.81            #peak  6219
 38 LEU  QD2    84 VAL  QG1     5.88            #peak  6220
 39 GLU  HB3    83 ALA  QB      4.39            #peak  6223
 39 GLU  HG2    83 ALA  QB      6.23            #peak  6225
 39 GLU  HG3    83 ALA  QB      6.23            #peak  6226
 44 VAL  QG2    81 ASP  HB3     5.94            #peak  6252
 44 VAL  QG1    81 ASP  HB3     6.34            #peak  6253
 44 VAL  QG2    47 VAL  H       6.91            #peak  6256
  9 LEU  H      45 LEU  QD2     5.47            #peak  6259
  9 LEU  H      45 LEU  QD1     5.22            #peak  6263
 42 ARG  H      45 LEU  QD1     7.02            #peak  6264
 39 GLU  HA     45 LEU  QD2     6.33            #peak  6267
 42 ARG  HA     45 LEU  QD2     5.58            #peak  6268
 42 ARG  HA     45 LEU  QD1     4.68            #peak  6269
  7 GLY  HA3    45 LEU  QD1     5.94            #peak  6270
  7 GLY  HA2    45 LEU  QD1     5.94            #peak  6271
 39 GLU  HA     45 LEU  QD1     5.90            #peak  6273
  9 LEU  HB3    45 LEU  QD2     5.97            #peak  6276
 38 LEU  QD1    45 LEU  QD2     6.24            #peak  6278
 46 THR  QG2    49 ARG  H       6.05            #peak  6282
 46 THR  QG2    47 VAL  HA      4.57            #peak  6283
 46 THR  HB     47 VAL  QG2     5.72            #peak  6285
  9 LEU  QD2    49 ARG  HB3     5.65            #peak  6297
  9 LEU  QD2    49 ARG  HB2     4.79            #peak  6298
  9 LEU  QD1    49 ARG  QD      5.78            #peak  6299
 50 PHE  HA     51 ALA  QB      6.59            #peak  6301
 48 PHE  HA     51 ALA  QB      4.14            #peak  6307
 48 PHE  QB     51 ALA  QB      6.93            #peak  6308
 49 ARG  H      51 ALA  QB      6.48            #peak  6312
 36 VAL  QG1    57 VAL  QG1     8.04            #peak  6326
 57 VAL  QG2    78 PHE  QE      8.47            #peak  6338
 59 VAL  HA     61 LEU  QD1     5.33            #peak  6348
 59 VAL  HB     73 VAL  QG2     4.86            #peak  6350
 59 VAL  QG1    73 VAL  HA      4.21            #peak  6351
 18 VAL  HA     59 VAL  QG2     4.75            #peak  6352
 61 LEU  QD2    71 VAL  H       4.97            #peak  6358
 61 LEU  QD2    64 ALA  H       6.41            #peak  6362
 61 LEU  QD1    93 VAL  HB      4.14            #peak  6363
 59 VAL  HB     61 LEU  QD1     4.93            #peak  6364
 61 LEU  QD2    71 VAL  QG1     5.95            #peak  6369
 61 LEU  HA     64 ALA  QB      4.50            #peak  6378
 63 GLU  H      64 ALA  QB      5.15            #peak  6379
 70 THR  HA     71 VAL  QG1     6.12            #peak  6392
 70 THR  QG2    90 MET  QB      5.45            #peak  6393
 70 THR  QG2    90 MET  QG      5.74            #peak  6395
 70 THR  QG2    91 ALA  H       5.72            #peak  6402
 61 LEU  QD2    71 VAL  HB      4.61            #peak  6403
 61 LEU  QD2    71 VAL  QG2     5.45            #peak  6405
 70 THR  HA     71 VAL  QG2     5.00            #peak  6408
 44 VAL  QG2    81 ASP  HB2     5.94            #peak  6443
 44 VAL  QG1    81 ASP  HB2     6.34            #peak  6444
 38 LEU  QD1    82 LEU  QD1     6.67            #peak  6450
 44 VAL  HB     82 LEU  QD2     4.79            #peak  6452
 79 PRO  QD     82 LEU  QD2     7.51            #peak  6453
 40 GLY  HA3    82 LEU  QD2     6.08            #peak  6455
 40 GLY  HA2    82 LEU  QD2     6.08            #peak  6456
 79 PRO  QG     82 LEU  QD1     7.91            #peak  6457
 44 VAL  HB     82 LEU  QD1     5.80            #peak  6458
 38 LEU  QD1    84 VAL  QG2     8.04            #peak  6470
 38 LEU  HB2    84 VAL  QG2     7.02            #peak  6473
 83 ALA  QB     84 VAL  QG2     8.04            #peak  6474
 38 LEU  HB3    84 VAL  QG2     7.02            #peak  6475
 36 VAL  QG1    84 VAL  QG1     5.81            #peak  6480
 36 VAL  QG2    84 VAL  QG1     7.82            #peak  6482
 78 PHE  QB     84 VAL  QG2     6.89            #peak  6484
 83 ALA  HA     84 VAL  QG2     5.18            #peak  6485
 38 LEU  HA     84 VAL  QG2     7.02            #peak  6491
 38 LEU  HA     84 VAL  QG1     7.02            #peak  6492
 78 PHE  QD     84 VAL  QG1     9.15            #peak  6493
 78 PHE  QE     84 VAL  QG1     9.15            #peak  6494
 84 VAL  QG1    85 THR  HA      6.62            #peak  6500
 34 VAL  QG1    87 GLU  QB      5.34            #peak  6513
 34 VAL  HB     86 VAL  QG1     3.89            #peak  6514
 86 VAL  QG2    89 ARG  HA      4.61            #peak  6516
 85 THR  HA     86 VAL  QG2     4.93            #peak  6517
 86 VAL  QG1    87 GLU  HA      5.58            #peak  6521
 70 THR  QG2    90 MET  QE      5.63            #peak  6542
 71 VAL  QG1    90 MET  QE      6.71            #peak  6543
 71 VAL  HA     90 MET  QE      3.99            #peak  6548
 70 THR  HB     90 MET  QE      5.58            #peak  6549
 72 ASP  H      90 MET  QE      4.71            #peak  6551
 59 VAL  QG1    91 ALA  QB      5.84            #peak  6556
 73 VAL  QG2    91 ALA  QB      5.77            #peak  6557
 16 LEU  QD2    91 ALA  QB      5.55            #peak  6558
 31 THR  QG2    91 ALA  QB      5.84            #peak  6559
 31 THR  HB     91 ALA  QB      4.21            #peak  6561
 93 VAL  QG1    94 GLN  HA      5.08            #peak  6568
 30 GLN  HA     93 VAL  QG2     5.22            #peak  6570
 28 VAL  QG2    94 GLN  HG3     4.93            #peak  6575
 28 VAL  QG1    94 GLN  QB      5.92            #peak  6577
 27 ILE  HA     95 LEU  QD2     4.64            #peak  6582
 20 TYR  QD     95 LEU  QD2     9.15            #peak  6583
 20 TYR  QE     95 LEU  QD2     9.15            #peak  6584
 27 ILE  H      95 LEU  QD2     6.87            #peak  6585
 26 ASP  H      95 LEU  QD2     7.02            #peak  6586
 25 TYR  QD     95 LEU  QD1     9.15            #peak  6587
 20 TYR  QD     95 LEU  QD1     8.46            #peak  6588
 25 TYR  HB3    95 LEU  QD2     6.87            #peak  6595
 25 TYR  HB2    95 LEU  QD2     6.87            #peak  6596
 27 ILE  QG2    95 LEU  QD2     7.17            #peak  6598
 93 VAL  QG1    95 LEU  QD2     6.09            #peak  6599
 27 ILE  QG2    95 LEU  QD1     7.46            #peak  6602
 93 VAL  QG1    95 LEU  QD1     6.85            #peak  6603
 16 LEU  QD2    31 THR  QG2     6.45            #peak  6652
 18 VAL  H      27 ILE  QD1     7.02            #peak  6661
 47 VAL  QG1    51 ALA  QB      6.13            #peak  6665
 36 VAL  QG1    57 VAL  QG2     8.04            #peak  6671
 61 LEU  HG     64 ALA  QB      5.87            #peak  6676
 38 LEU  QD1    82 LEU  QD2     8.04            #peak  6746
 38 LEU  QD2    82 LEU  QD1     6.74            #peak  6747
 82 LEU  QD1    84 VAL  QG2     8.04            #peak  6750
 28 VAL  QG2    94 GLN  QB      7.29            #peak  6752
 19 LEU  QD2    20 TYR  QE      9.15            #peak  6762
 14 LEU  QD1    55 TYR  QD      8.54            #peak  6767
 73 VAL  QG2    89 ARG  HA      6.37            #peak  6775
 86 VAL  QG1    89 ARG  HA      5.94            #peak  6776
 84 VAL  QG1    86 VAL  QG1     6.31            #peak  6777
 84 VAL  QG1    86 VAL  QG2     6.78            #peak  6779
 14 LEU  QD1    36 VAL  H       7.02            #peak  6791
 18 VAL  QG1    19 LEU  HA      5.18            #peak  6794
 18 VAL  QG2    59 VAL  H       7.02            #peak  6801
 61 LEU  QD1    71 VAL  QG2     6.17            #peak  6817
 44 VAL  QG1    82 LEU  QD2     7.35            #peak  6825
 44 VAL  QG2    82 LEU  QD2     8.04            #peak  6826
 39 GLU  H      83 ALA  QB      4.82            #peak  6835
 18 VAL  QG1    59 VAL  HB      5.29            #peak  6844
 16 LEU  QD1    91 ALA  QB      5.91            #peak  6851
 18 VAL  QG1    93 VAL  HB      4.50            #peak  6854
 27 ILE  QG2    93 VAL  HB      6.59            #peak  6856
 18 VAL  QG1    95 LEU  QD1     6.78            #peak  6860
 11 LEU  QD2    38 LEU  QD1     7.17            #peak  6863
 45 LEU  HA     82 LEU  QD1     6.88            #peak  6868
 45 LEU  HA     82 LEU  QD2     6.77            #peak  6869
 82 LEU  HA     83 ALA  QB      5.33            #peak  6874
 39 GLU  HB2    83 ALA  QB      4.21            #peak  6879
 38 LEU  QD1    84 VAL  QG1     8.04            #peak  6883
 27 ILE  QG2    28 VAL  HA      6.59            #peak  6893
 28 VAL  QG2    95 LEU  HA      6.95            #peak  6901
 36 VAL  QG2    38 LEU  QD1     7.17            #peak  6909
 11 LEU  QD2    36 VAL  QG1     6.53            #peak  6911
 14 LEU  QD1    36 VAL  QG2     6.06            #peak  6914
 11 LEU  QD1    14 LEU  QD1     6.06            #peak  6918
 11 LEU  QD2    38 LEU  QD2     8.04            #peak  6920
 11 LEU  QB     14 LEU  QD2     6.93            #peak  6923
 11 LEU  QB     14 LEU  QD1     7.18            #peak  6924
 18 VAL  QG1    95 LEU  QD2     6.67            #peak  6927
 11 LEU  QD1    36 VAL  HA      6.19            #peak  6946
 14 LEU  HG     36 VAL  QG2     6.55            #peak  6956
 11 LEU  QD2    14 LEU  HG      7.02            #peak  6957
 17 THR  QG2    58 PHE  QB      6.85            #peak  6971
 18 VAL  QG2    61 LEU  HG      7.02            #peak  6977
 19 LEU  HA     62 THR  QG2     5.72            #peak  6978
 32 GLU  HB2    33 THR  QG2     6.55            #peak  7010
 32 GLU  HB3    33 THR  QG2     6.55            #peak  7011
 28 VAL  QG2    94 GLN  HG2     4.93            #peak  7035
 59 VAL  HA     71 VAL  QG2     5.00            #peak  7038
 27 ILE  QG2    30 GLN  HB2     4.46            #peak  7056
  9 LEU  HB2    45 LEU  QD2     5.97            #peak  7057
 48 PHE  QD     49 ARG  H       7.44            #peak  5252
 20 TYR  QD     22 GLU  HA      7.62            #peak  6078
 20 TYR  QE     22 GLU  HA      6.01            #peak  6079
 20 TYR  QE     26 ASP  HA      6.77            #peak  6080
 25 TYR  QE     97 GLU  QG      6.50            #peak  6107
 24 ARG  QD     25 TYR  QE      8.30            #peak  6109
 24 ARG  HA     25 TYR  QE      6.30            #peak  6110
 25 TYR  QE     97 GLU  HA      7.67            #peak  6111
 25 TYR  QD     97 GLU  HA      6.15            #peak  6113
 18 VAL  QG1    20 TYR  QD      7.13            #peak  6073
 20 TYR  QD     27 ILE  QD1     9.15            #peak  6074
 18 VAL  QG1    20 TYR  QE      8.18            #peak  6075
 20 TYR  QE     27 ILE  QD1     7.14            #peak  6076
  9 LEU  QD2    48 PHE  QD      6.70            #peak  6289
  9 LEU  QD2    48 PHE  QE      7.24            #peak  6290
 46 THR  QG2    50 PHE  QD      6.66            #peak  6302
 46 THR  QG2    50 PHE  QE      6.88            #peak  6303
 14 LEU  QD2    55 TYR  QD      7.42            #peak  6319
 14 LEU  QD1    55 TYR  QE      6.52            #peak  6320
 11 LEU  QD1    55 TYR  QE      7.10            #peak  6321
 78 PHE  QD     84 VAL  QG2     7.46            #peak  6431
 57 VAL  QG1    78 PHE  QE      8.47            #peak  6434
 11 LEU  QD2    48 PHE  QE      7.03            #peak  6764
 14 LEU  QD2    55 TYR  QE      6.49            #peak  6768
 11 LEU  QD2    78 PHE  HZ      6.55            #peak  6816
  4 PHE  H       4 PHE  QB      3.18            #peak   551
  4 PHE  QB      5 ASP  H       3.85            #peak    13
  7 GLY  QA      8 ASN  H       2.71            #peak    27
  7 GLY  QA     45 LEU  QD1     5.47            #peak  6270
  8 ASN  H       8 ASN  QB      3.61            #peak   570
  8 ASN  QD2     9 LEU  H       6.21            #peak  6004
  8 ASN  QD2    39 GLU  HA      6.57            #peak  6647
  8 ASN  QD2    39 GLU  HB2     6.86            #peak  6009
  8 ASN  QD2    39 GLU  HB3     4.76            #peak  6008
  8 ASN  QD2    39 GLU  QG      4.78            #peak  6010
  8 ASN  HD21   39 GLU  HG2     6.00            #peak  6010
  9 LEU  H       9 LEU  QB      3.87            #peak   577
  9 LEU  QB     11 LEU  QD2     5.59            #peak  6018
  9 LEU  QB     38 LEU  QD1     5.67            #peak  6212
  9 LEU  QB     45 LEU  QD1     6.68            #peak  6277
  9 LEU  QB     45 LEU  QD2     5.42            #peak  6276
 10 SER  H      10 SER  QB      3.52            #peak   584
 10 SER  QB     11 LEU  H       4.24            #peak  3630
 13 GLU  H      13 GLU  QB      3.25            #peak   596
 13 GLU  H      13 GLU  QG      3.33            #peak   599
 13 GLU  QB     33 THR  QG2     5.77            #peak  6950
 13 GLU  QG     14 LEU  H       6.81            #peak    60
 14 LEU  H      57 VAL  QQG     8.35            #peak  6343
 14 LEU  HA     57 VAL  QQG     7.96            #peak  6332
 14 LEU  HB2    57 VAL  QQG     5.72            #peak  6327
 14 LEU  HB3    57 VAL  QQG     5.98            #peak  6328
 14 LEU  HG     57 VAL  QQG     6.41            #peak  6329
 15 GLU  H      15 GLU  QG      3.78            #peak   610
 15 GLU  H      57 VAL  QQG     8.17            #peak  7032
 15 GLU  HA     15 GLU  QG      3.89            #peak  1467
 15 GLU  HA     57 VAL  QQG     8.57            #peak  6963
 15 GLU  QG     16 LEU  H       6.88            #peak    72
 16 LEU  H      16 LEU  QB      3.55            #peak   614
 16 LEU  HA     57 VAL  QQG     5.26            #peak  6333
 16 LEU  QD1    57 VAL  QQG     8.18            #peak  6325
 17 THR  H      57 VAL  QQG     6.26            #peak  6341
 18 VAL  QG1    20 TYR  QB      6.17            #peak  6933
 19 LEU  H      19 LEU  QB      3.77            #peak   631
 21 ASP  H      21 ASP  QB      3.69            #peak   644
 21 ASP  HA     22 GLU  QG      5.23            #peak  6086
 22 GLU  H      22 GLU  QG      3.54            #peak   650
 22 GLU  QG     23 GLU  H       4.97            #peak   111
 23 GLU  H      23 GLU  QB      3.19            #peak   653
 23 GLU  H      23 GLU  QG      3.24            #peak   655
 23 GLU  QB     24 ARG  H       4.17            #peak   114
 23 GLU  QG     24 ARG  H       6.88            #peak  3687
 24 ARG  H      24 ARG  QB      3.42            #peak   659
 24 ARG  H      24 ARG  QG      5.11            #peak   660
 24 ARG  HA     24 ARG  QG      3.92            #peak  6710
 24 ARG  QB     24 ARG  HE      6.30            #peak  6711
 24 ARG  QG     24 ARG  HE      3.82            #peak  6712
 24 ARG  QG     25 TYR  H       5.80            #peak   121
 25 TYR  H      25 TYR  QB      3.63            #peak   664
 25 TYR  QB     95 LEU  QD1     7.25            #peak  6594
 25 TYR  QB     95 LEU  QD2     6.26            #peak  6595
 25 TYR  QE     97 GLU  QB      7.25            #peak  6108
 26 ASP  H      26 ASP  QB      3.67            #peak  1735
 26 ASP  QB     27 ILE  H       3.61            #peak   131
 27 ILE  H      27 ILE  QG1     4.00            #peak   677
 27 ILE  QG2    30 GLN  QB      4.28            #peak  6121
 27 ILE  QG1    95 LEU  QD1     5.52            #peak  6605
 27 ILE  QG1    95 LEU  QD2     5.59            #peak  6600
 28 VAL  H      94 GLN  QG      5.55            #peak  6894
 28 VAL  QG1    94 GLN  QG      5.78            #peak  6576
 28 VAL  QG1    94 GLN  QE2     5.18            #peak  6832
 28 VAL  QG2    94 GLN  QG      4.76            #peak  6575
 28 VAL  QG2    94 GLN  QE2     5.15            #peak  6574
 29 GLU  H      94 GLN  QG      6.20            #peak  6892
 29 GLU  HA     94 GLN  QG      6.05            #peak  6578
 32 GLU  H      32 GLU  QB      3.65            #peak   702
 32 GLU  H      32 GLU  QG      3.50            #peak  1871
 32 GLU  QB     33 THR  H       3.56            #peak   163
 32 GLU  QB     33 THR  QG2     5.92            #peak  7011
 32 GLU  QG     33 THR  H       4.71            #peak   164
 34 VAL  HB     57 VAL  QQG     6.37            #peak  6160
 34 VAL  QG2    57 VAL  QQG     7.46            #peak  6324
 34 VAL  QG2    88 PRO  QG      5.75            #peak  6165
 35 GLN  H      35 GLN  QG      5.24            #peak  1936
 35 GLN  QG     36 VAL  H       4.56            #peak  3734
 36 VAL  QG1    57 VAL  QQG     7.37            #peak  6326
 38 LEU  H      38 LEU  QB      3.85            #peak   732
 38 LEU  QB     84 VAL  QG2     6.64            #peak  6475
 39 GLU  H      82 LEU  QB      5.12            #peak  6221
 39 GLU  HA     39 GLU  QG      3.99            #peak  2036
 39 GLU  QG     40 GLY  H       4.29            #peak  3751
 39 GLU  QG     83 ALA  QB      5.65            #peak  6225
 40 GLY  QA     82 LEU  QD2     5.46            #peak  6456
 41 PRO  QB     44 VAL  H       4.58            #peak  6244
 41 PRO  QB     44 VAL  QG2     5.13            #peak  6248
 42 ARG  H      42 ARG  QG      4.61            #peak   750
 44 VAL  QG1    81 ASP  QB      5.60            #peak  6253
 44 VAL  QG2    81 ASP  QB      5.62            #peak  6443
 46 THR  HA     49 ARG  QG      4.79            #peak  6296
 49 ARG  H      49 ARG  QG      3.87            #peak   786
 49 ARG  QG     50 PHE  H       6.77            #peak  6294
 52 ARG  H      52 ARG  QG      3.65            #peak   803
 52 ARG  H      53 PRO  QD      5.41            #peak  6666
 52 ARG  HA     52 ARG  QG      3.94            #peak  2325
 52 ARG  HA     53 PRO  QD      3.52            #peak  2301
 53 PRO  QB     55 TYR  QD      6.49            #peak  6756
 53 PRO  QB     55 TYR  QE      6.78            #peak  6757
 54 SER  QB     55 TYR  H       4.06            #peak   270
 55 TYR  HA     77 GLY  QA      4.90            #peak  6902
 56 GLU  H      56 GLU  QB      3.65            #peak  2414
 56 GLU  H      77 GLY  QA      5.01            #peak  6429
 57 VAL  H      57 VAL  QQG     4.16            #peak   823
 57 VAL  QQG    58 PHE  H       6.41            #peak   287
 57 VAL  QQG    73 VAL  QG2     8.11            #peak  6839
 57 VAL  QQG    75 HIS  HA      7.17            #peak  6334
 57 VAL  QQG    78 PHE  HZ      8.46            #peak  6337
 57 VAL  QQG    86 VAL  QG1     8.54            #peak  6842
 57 VAL  QQG    86 VAL  QG2     9.08            #peak  7045
 60 ASP  H      60 ASP  QB      3.72            #peak   838
 64 ALA  QB     65 GLY  QA      6.21            #peak  6673
 66 GLU  H      66 GLU  QB      3.31            #peak   866
 66 GLU  QB     67 GLY  H       3.54            #peak  3844
 72 ASP  H      72 ASP  QB      3.52            #peak   892
 72 ASP  QB     73 VAL  H       3.99            #peak   355
 76 ARG  H      76 ARG  QG      5.30            #peak   912
 81 ASP  H      81 ASP  QB      3.14            #peak  2808
 81 ASP  QB     82 LEU  H       3.79            #peak   390
 81 ASP  QB     82 LEU  QD1     6.93            #peak  6460
 82 LEU  H      82 LEU  QB      3.42            #peak   932
 88 PRO  QB     90 MET  H       4.50            #peak  6537
 89 ARG  H      89 ARG  QG      3.67            #peak   961
 89 ARG  HA     89 ARG  QG      3.52            #peak  2963
 89 ARG  QG     90 MET  H       4.28            #peak   425
 92 ARG  QG     93 VAL  H       6.77            #peak   441
 94 GLN  H      94 GLN  QG      4.85            #peak   988
 94 GLN  QG     94 GLN  QE2     3.15            #peak  5056
 94 GLN  QG     95 LEU  H       6.30            #peak  3939
 95 LEU  H      95 LEU  QB      3.87            #peak   995
 96 GLU  H      96 GLU  QB      3.81            #peak  1002
 96 GLU  H      96 GLU  QG      5.15            #peak  1003
 97 GLU  QB     98 ARG  H       4.42            #peak   471
 98 ARG  H      98 ARG  QG      4.95            #peak  1014
 98 ARG  HA     98 ARG  QG      3.90            #peak  3239
 98 ARG  HB3    98 ARG  QG      2.58            #peak  3234
 98 ARG  QG     99 GLN  H       4.29            #peak   478
 98 ARG  QG    100 THR  H       7.07            #peak  6636
 99 GLN  H      99 GLN  QB      2.92            #peak  3266
 99 GLN  QB    100 THR  H       4.43            #peak   482
 99 GLN  QB    100 THR  HB      8.33            #peak  6638
100 THR  HA    101 VAL  QQG     9.13            #peak  6637
101 VAL  QQG   102 SER  H       5.56            #peak   494
103 VAL  HA    104 PRO  QD      3.13            #peak  6733
104 PRO  QB    105 VAL  H       4.28            #peak  3978
105 VAL  H     105 VAL  QQG     5.36            #peak  1045
105 VAL  QQG   106 THR  H       6.92            #peak   509
108 GLU  H     108 GLU  QB      4.28            #peak  1057
110 ILE  H     110 ILE  QG1     7.28            #peak  1072
112 LEU  H     112 LEU  QB      4.99            #peak  1083
112 LEU  QB    112 LEU  HG      3.24            #peak  3572
  7 GLY  O      40 GLY  N       3.00 # hbond
  7 GLY  O      40 GLY  H      2.00 # hbond
 26 ASP  O      96 GLU  N       3.00 # hbond
 26 ASP  O      96 GLU  H      2.00 # hbond
 34 VAL  O      14 LEU  N       3.00 # hbond
 34 VAL  O      14 LEU  H      2.00 # hbond
 35 GLN  O      87 GLU  N       3.00 # hbond
 35 GLN  O      87 GLU  H      2.00 # hbond
 38 LEU  O       9 LEU  N       3.00 # hbond
 38 LEU  O       9 LEU  H      2.00 # hbond
 57 VAL  O      17 THR  N       3.00 # hbond
 57 VAL  O      17 THR  H      2.00 # hbond
 69 HIS  O      93 VAL  N       3.00 # hbond
 69 HIS  O      93 VAL  H      2.00 # hbond
 76 ARG  O      56 GLU  N       3.00 # hbond
 76 ARG  O      56 GLU  H      2.00 # hbond
 83 ALA  O      39 GLU  N       3.00 # hbond
 83 ALA  O      39 GLU  H      2.00 # hbond
 91 ALA  O      71 VAL  N       3.00 # hbond
 91 ALA  O      71 VAL  H      2.00 # hbond
 94 GLN  O      28 VAL  N       3.00 # hbond
 94 GLN  O      28 VAL  H      2.00 # hbond
assign ( resid    7 and name C    )   ( resid    8 and name N    ) 
        (resid    8 and name CA   )   ( resid    8 and name C    )  1 -140.00   21.00 2
assign ( resid    8 and name N    )   ( resid    8 and name CA   ) 
        (resid    8 and name C    )   ( resid    9 and name N    )  1  152.00   15.00 2
assign ( resid    8 and name C    )   ( resid    9 and name N    ) 
        (resid    9 and name CA   )   ( resid    9 and name C    )  1 -144.00   11.00 2
assign ( resid    9 and name N    )   ( resid    9 and name CA   ) 
        (resid    9 and name C    )   ( resid   10 and name N    )  1  138.00   13.00 2
assign ( resid    9 and name C    )   ( resid   10 and name N    ) 
        (resid   10 and name CA   )   ( resid   10 and name C    )  1 -103.00   22.00 2
assign ( resid   10 and name N    )   ( resid   10 and name CA   ) 
        (resid   10 and name C    )   ( resid   11 and name N    )  1  123.00   16.00 2
assign ( resid   12 and name C    )   ( resid   13 and name N    ) 
        (resid   13 and name CA   )   ( resid   13 and name C    )  1  -91.00   26.00 2
assign ( resid   13 and name N    )   ( resid   13 and name CA   ) 
        (resid   13 and name C    )   ( resid   14 and name N    )  1  124.00   19.00 2
assign ( resid   13 and name C    )   ( resid   14 and name N    ) 
        (resid   14 and name CA   )   ( resid   14 and name C    )  1 -116.00   19.00 2
assign ( resid   14 and name N    )   ( resid   14 and name CA   ) 
        (resid   14 and name C    )   ( resid   15 and name N    )  1  151.00   20.00 2
assign ( resid   14 and name C    )   ( resid   15 and name N    ) 
        (resid   15 and name CA   )   ( resid   15 and name C    )  1  -90.00   17.00 2
assign ( resid   15 and name N    )   ( resid   15 and name CA   ) 
        (resid   15 and name C    )   ( resid   16 and name N    )  1  133.00   12.00 2
assign ( resid   15 and name C    )   ( resid   16 and name N    ) 
        (resid   16 and name CA   )   ( resid   16 and name C    )  1 -112.00   27.00 2
assign ( resid   16 and name N    )   ( resid   16 and name CA   ) 
        (resid   16 and name C    )   ( resid   17 and name N    )  1  126.00   19.00 2
assign ( resid   16 and name C    )   ( resid   17 and name N    ) 
        (resid   17 and name CA   )   ( resid   17 and name C    )  1 -113.00   24.00 2
assign ( resid   17 and name N    )   ( resid   17 and name CA   ) 
        (resid   17 and name C    )   ( resid   18 and name N    )  1  125.00   12.00 2
assign ( resid   17 and name C    )   ( resid   18 and name N    ) 
        (resid   18 and name CA   )   ( resid   18 and name C    )  1 -114.00    7.00 2
assign ( resid   18 and name N    )   ( resid   18 and name CA   ) 
        (resid   18 and name C    )   ( resid   19 and name N    )  1  127.00   12.00 2
assign ( resid   18 and name C    )   ( resid   19 and name N    ) 
        (resid   19 and name CA   )   ( resid   19 and name C    )  1  -99.00   10.00 2
assign ( resid   19 and name N    )   ( resid   19 and name CA   ) 
        (resid   19 and name C    )   ( resid   20 and name N    )  1  133.00   14.00 2
assign ( resid   25 and name C    )   ( resid   26 and name N    ) 
        (resid   26 and name CA   )   ( resid   26 and name C    )  1 -127.00   16.00 2
assign ( resid   26 and name N    )   ( resid   26 and name CA   ) 
        (resid   26 and name C    )   ( resid   27 and name N    )  1  148.00   13.00 2
assign ( resid   26 and name C    )   ( resid   27 and name N    ) 
        (resid   27 and name CA   )   ( resid   27 and name C    )  1  -78.00   13.00 2
assign ( resid   27 and name N    )   ( resid   27 and name CA   ) 
        (resid   27 and name C    )   ( resid   28 and name N    )  1  123.00   18.00 2
assign ( resid   27 and name C    )   ( resid   28 and name N    ) 
        (resid   28 and name CA   )   ( resid   28 and name C    )  1  -91.00   18.00 2
assign ( resid   28 and name N    )   ( resid   28 and name CA   ) 
        (resid   28 and name C    )   ( resid   29 and name N    )  1  -38.00   11.00 2
assign ( resid   28 and name C    )   ( resid   29 and name N    ) 
        (resid   29 and name CA   )   ( resid   29 and name C    )  1 -160.00   25.00 2
assign ( resid   29 and name N    )   ( resid   29 and name CA   ) 
        (resid   29 and name C    )   ( resid   30 and name N    )  1  164.00    9.00 2
assign ( resid   32 and name C    )   ( resid   33 and name N    ) 
        (resid   33 and name CA   )   ( resid   33 and name C    )  1 -144.00   15.00 2
assign ( resid   33 and name N    )   ( resid   33 and name CA   ) 
        (resid   33 and name C    )   ( resid   34 and name N    )  1  160.00   13.00 2
assign ( resid   33 and name C    )   ( resid   34 and name N    ) 
        (resid   34 and name CA   )   ( resid   34 and name C    )  1 -133.00    8.00 2
assign ( resid   34 and name N    )   ( resid   34 and name CA   ) 
        (resid   34 and name C    )   ( resid   35 and name N    )  1  157.00    8.00 2
assign ( resid   34 and name C    )   ( resid   35 and name N    ) 
        (resid   35 and name CA   )   ( resid   35 and name C    )  1 -103.00   12.00 2
assign ( resid   35 and name N    )   ( resid   35 and name CA   ) 
        (resid   35 and name C    )   ( resid   36 and name N    )  1  127.00   14.00 2
assign ( resid   35 and name C    )   ( resid   36 and name N    ) 
        (resid   36 and name CA   )   ( resid   36 and name C    )  1 -118.00    9.00 2
assign ( resid   36 and name N    )   ( resid   36 and name CA   ) 
        (resid   36 and name C    )   ( resid   37 and name N    )  1  131.00   10.00 2
assign ( resid   36 and name C    )   ( resid   37 and name N    ) 
        (resid   37 and name CA   )   ( resid   37 and name C    )  1 -126.00    9.00 2
assign ( resid   37 and name N    )   ( resid   37 and name CA   ) 
        (resid   37 and name C    )   ( resid   38 and name N    )  1  147.00   16.00 2
assign ( resid   37 and name C    )   ( resid   38 and name N    ) 
        (resid   38 and name CA   )   ( resid   38 and name C    )  1 -127.00   12.00 2
assign ( resid   38 and name N    )   ( resid   38 and name CA   ) 
        (resid   38 and name C    )   ( resid   39 and name N    )  1  139.00   14.00 2
assign ( resid   38 and name C    )   ( resid   39 and name N    ) 
        (resid   39 and name CA   )   ( resid   39 and name C    )  1 -132.00   15.00 2
assign ( resid   39 and name N    )   ( resid   39 and name CA   ) 
        (resid   39 and name C    )   ( resid   40 and name N    )  1  152.00   15.00 2
assign ( resid   41 and name C    )   ( resid   42 and name N    ) 
        (resid   42 and name CA   )   ( resid   42 and name C    )  1  -55.00    6.00 2
assign ( resid   42 and name N    )   ( resid   42 and name CA   ) 
        (resid   42 and name C    )   ( resid   43 and name N    )  1  -39.00    8.00 2
assign ( resid   42 and name C    )   ( resid   43 and name N    ) 
        (resid   43 and name CA   )   ( resid   43 and name C    )  1  -61.00    6.00 2
assign ( resid   43 and name N    )   ( resid   43 and name CA   ) 
        (resid   43 and name C    )   ( resid   44 and name N    )  1  -41.00    8.00 2
assign ( resid   43 and name C    )   ( resid   44 and name N    ) 
        (resid   44 and name CA   )   ( resid   44 and name C    )  1  -63.00    6.00 2
assign ( resid   44 and name N    )   ( resid   44 and name CA   ) 
        (resid   44 and name C    )   ( resid   45 and name N    )  1  -46.00    7.00 2
assign ( resid   44 and name C    )   ( resid   45 and name N    ) 
        (resid   45 and name CA   )   ( resid   45 and name C    )  1  -61.00    6.00 2
assign ( resid   45 and name N    )   ( resid   45 and name CA   ) 
        (resid   45 and name C    )   ( resid   46 and name N    )  1  -42.00    9.00 2
assign ( resid   45 and name C    )   ( resid   46 and name N    ) 
        (resid   46 and name CA   )   ( resid   46 and name C    )  1  -63.00    6.00 2
assign ( resid   46 and name N    )   ( resid   46 and name CA   ) 
        (resid   46 and name C    )   ( resid   47 and name N    )  1  -45.00    6.00 2
assign ( resid   46 and name C    )   ( resid   47 and name N    ) 
        (resid   47 and name CA   )   ( resid   47 and name C    )  1  -60.00   11.00 2
assign ( resid   47 and name N    )   ( resid   47 and name CA   ) 
        (resid   47 and name C    )   ( resid   48 and name N    )  1  -42.00   13.00 2
assign ( resid   47 and name C    )   ( resid   48 and name N    ) 
        (resid   48 and name CA   )   ( resid   48 and name C    )  1  -63.00    6.00 2
assign ( resid   48 and name N    )   ( resid   48 and name CA   ) 
        (resid   48 and name C    )   ( resid   49 and name N    )  1  -40.00   11.00 2
assign ( resid   48 and name C    )   ( resid   49 and name N    ) 
        (resid   49 and name CA   )   ( resid   49 and name C    )  1  -67.00    8.00 2
assign ( resid   49 and name N    )   ( resid   49 and name CA   ) 
        (resid   49 and name C    )   ( resid   50 and name N    )  1  -30.00   15.00 2
assign ( resid   55 and name C    )   ( resid   56 and name N    ) 
        (resid   56 and name CA   )   ( resid   56 and name C    )  1 -129.00   14.00 2
assign ( resid   56 and name N    )   ( resid   56 and name CA   ) 
        (resid   56 and name C    )   ( resid   57 and name N    )  1  158.00   13.00 2
assign ( resid   56 and name C    )   ( resid   57 and name N    ) 
        (resid   57 and name CA   )   ( resid   57 and name C    )  1 -127.00   24.00 2
assign ( resid   57 and name N    )   ( resid   57 and name CA   ) 
        (resid   57 and name C    )   ( resid   58 and name N    )  1  147.00   22.00 2
assign ( resid   57 and name C    )   ( resid   58 and name N    ) 
        (resid   58 and name CA   )   ( resid   58 and name C    )  1 -139.00   18.00 2
assign ( resid   58 and name N    )   ( resid   58 and name CA   ) 
        (resid   58 and name C    )   ( resid   59 and name N    )  1  164.00   13.00 2
assign ( resid   58 and name C    )   ( resid   59 and name N    ) 
        (resid   59 and name CA   )   ( resid   59 and name C    )  1 -136.00   11.00 2
assign ( resid   59 and name N    )   ( resid   59 and name CA   ) 
        (resid   59 and name C    )   ( resid   60 and name N    )  1  150.00   15.00 2
assign ( resid   59 and name C    )   ( resid   60 and name N    ) 
        (resid   60 and name CA   )   ( resid   60 and name C    )  1 -101.00   26.00 2
assign ( resid   60 and name N    )   ( resid   60 and name CA   ) 
        (resid   60 and name C    )   ( resid   61 and name N    )  1  123.00   20.00 2
assign ( resid   68 and name C    )   ( resid   69 and name N    ) 
        (resid   69 and name CA   )   ( resid   69 and name C    )  1 -119.00   12.00 2
assign ( resid   69 and name N    )   ( resid   69 and name CA   ) 
        (resid   69 and name C    )   ( resid   70 and name N    )  1  132.00    9.00 2
assign ( resid   69 and name C    )   ( resid   70 and name N    ) 
        (resid   70 and name CA   )   ( resid   70 and name C    )  1  -99.00   18.00 2
assign ( resid   70 and name N    )   ( resid   70 and name CA   ) 
        (resid   70 and name C    )   ( resid   71 and name N    )  1  129.00   12.00 2
assign ( resid   70 and name C    )   ( resid   71 and name N    ) 
        (resid   71 and name CA   )   ( resid   71 and name C    )  1 -139.00   14.00 2
assign ( resid   71 and name N    )   ( resid   71 and name CA   ) 
        (resid   71 and name C    )   ( resid   72 and name N    )  1  161.00    6.00 2
assign ( resid   71 and name C    )   ( resid   72 and name N    ) 
        (resid   72 and name CA   )   ( resid   72 and name C    )  1  -72.00   13.00 2
assign ( resid   72 and name N    )   ( resid   72 and name CA   ) 
        (resid   72 and name C    )   ( resid   73 and name N    )  1  142.00    9.00 2
assign ( resid   72 and name C    )   ( resid   73 and name N    ) 
        (resid   73 and name CA   )   ( resid   73 and name C    )  1  -91.00   18.00 2
assign ( resid   73 and name N    )   ( resid   73 and name CA   ) 
        (resid   73 and name C    )   ( resid   74 and name N    )  1  125.00    8.00 2
assign ( resid   73 and name C    )   ( resid   74 and name N    ) 
        (resid   74 and name CA   )   ( resid   74 and name C    )  1 -117.00   28.00 2
assign ( resid   74 and name N    )   ( resid   74 and name CA   ) 
        (resid   74 and name C    )   ( resid   75 and name N    )  1  143.00    8.00 2
assign ( resid   74 and name C    )   ( resid   75 and name N    ) 
        (resid   75 and name CA   )   ( resid   75 and name C    )  1 -138.00   17.00 2
assign ( resid   75 and name N    )   ( resid   75 and name CA   ) 
        (resid   75 and name C    )   ( resid   76 and name N    )  1  162.00   11.00 2
assign ( resid   75 and name C    )   ( resid   76 and name N    ) 
        (resid   76 and name CA   )   ( resid   76 and name C    )  1 -143.00   16.00 2
assign ( resid   76 and name N    )   ( resid   76 and name CA   ) 
        (resid   76 and name C    )   ( resid   77 and name N    )  1  154.00    9.00 2
assign ( resid   82 and name C    )   ( resid   83 and name N    ) 
        (resid   83 and name CA   )   ( resid   83 and name C    )  1  -95.00   14.00 2
assign ( resid   83 and name N    )   ( resid   83 and name CA   ) 
        (resid   83 and name C    )   ( resid   84 and name N    )  1  116.00   13.00 2
assign ( resid   83 and name C    )   ( resid   84 and name N    ) 
        (resid   84 and name CA   )   ( resid   84 and name C    )  1 -105.00   10.00 2
assign ( resid   84 and name N    )   ( resid   84 and name CA   ) 
        (resid   84 and name C    )   ( resid   85 and name N    )  1  131.00   20.00 2
assign ( resid   84 and name C    )   ( resid   85 and name N    ) 
        (resid   85 and name CA   )   ( resid   85 and name C    )  1 -108.00   15.00 2
assign ( resid   85 and name N    )   ( resid   85 and name CA   ) 
        (resid   85 and name C    )   ( resid   86 and name N    )  1  131.00    8.00 2
assign ( resid   85 and name C    )   ( resid   86 and name N    ) 
        (resid   86 and name CA   )   ( resid   86 and name C    )  1 -130.00   17.00 2
assign ( resid   86 and name N    )   ( resid   86 and name CA   ) 
        (resid   86 and name C    )   ( resid   87 and name N    )  1  141.00   24.00 2
assign ( resid   86 and name C    )   ( resid   87 and name N    ) 
        (resid   87 and name CA   )   ( resid   87 and name C    )  1 -125.25   18.65 2
assign ( resid   87 and name N    )   ( resid   87 and name CA   ) 
        (resid   87 and name C    )   ( resid   88 and name N    )  1  132.90   15.60 2
assign ( resid   89 and name C    )   ( resid   90 and name N    ) 
        (resid   90 and name CA   )   ( resid   90 and name C    )  1 -129.65   22.95 2
assign ( resid   90 and name N    )   ( resid   90 and name CA   ) 
        (resid   90 and name C    )   ( resid   91 and name N    )  1  142.05   19.35 2
assign ( resid   90 and name C    )   ( resid   91 and name N    ) 
        (resid   91 and name CA   )   ( resid   91 and name C    )  1 -135.65   14.05 2
assign ( resid   91 and name N    )   ( resid   91 and name CA   ) 
        (resid   91 and name C    )   ( resid   92 and name N    )  1  145.40   15.10 2
assign ( resid   91 and name C    )   ( resid   92 and name N    ) 
        (resid   92 and name CA   )   ( resid   92 and name C    )  1 -121.25   13.75 2
assign ( resid   92 and name N    )   ( resid   92 and name CA   ) 
        (resid   92 and name C    )   ( resid   93 and name N    )  1  135.45    9.65 2
assign ( resid   92 and name C    )   ( resid   93 and name N    ) 
        (resid   93 and name CA   )   ( resid   93 and name C    )  1 -127.20   10.20 2
assign ( resid   93 and name N    )   ( resid   93 and name CA   ) 
        (resid   93 and name C    )   ( resid   94 and name N    )  1  129.85    8.35 2
assign ( resid   93 and name C    )   ( resid   94 and name N    ) 
        (resid   94 and name CA   )   ( resid   94 and name C    )  1 -111.45   12.35 2
assign ( resid   94 and name N    )   ( resid   94 and name CA   ) 
        (resid   94 and name C    )   ( resid   95 and name N    )  1  132.20   10.50 2
assign ( resid   94 and name C    )   ( resid   95 and name N    ) 
        (resid   95 and name CA   )   ( resid   95 and name C    )  1 -112.65   16.35 2
assign ( resid   95 and name N    )   ( resid   95 and name CA   ) 
        (resid   95 and name C    )   ( resid   96 and name N    )  1  132.00    6.70 2
assign ( resid   95 and name C    )   ( resid   96 and name N    ) 
        (resid   96 and name CA   )   ( resid   96 and name C    )  1 -133.60   15.80 2
assign ( resid   96 and name N    )   ( resid   96 and name CA   ) 
        (resid   96 and name C    )   ( resid   97 and name N    )  1  132.35    9.75 2
assign ( resid    3 and name C    )   ( resid    4 and name N    ) 
        (resid    4 and name CA   )   ( resid    4 and name C    )  1 -115.00   70.00 2
assign ( resid    4 and name N    )   ( resid    4 and name CA   ) 
        (resid    4 and name C    )   ( resid    5 and name N    )  1  160.00   35.00 2
assign ( resid    4 and name C    )   ( resid    5 and name N    ) 
        (resid    5 and name CA   )   ( resid    5 and name C    )  1  165.00  120.00 2
assign ( resid    4 and name C    )   ( resid    5 and name N    ) 
        (resid    5 and name CA   )   ( resid    5 and name C    )  1  -60.00  125.00 2
assign ( resid    5 and name N    )   ( resid    5 and name CA   ) 
        (resid    5 and name C    )   ( resid    6 and name N    )  1   75.00   40.00 2
assign ( resid    5 and name C    )   ( resid    6 and name N    ) 
        (resid    6 and name CA   )   ( resid    6 and name C    )  1 -180.00  135.00 2
assign ( resid    5 and name C    )   ( resid    6 and name N    ) 
        (resid    6 and name CA   )   ( resid    6 and name C    )  1  -55.00  130.00 2
assign ( resid    6 and name N    )   ( resid    6 and name CA   ) 
        (resid    6 and name C    )   ( resid    7 and name N    )  1  100.00   95.00 2
assign ( resid    6 and name C    )   ( resid    7 and name N    ) 
        (resid    7 and name CA   )   ( resid    7 and name C    )  1 -180.00  135.00 2
assign ( resid    7 and name N    )   ( resid    7 and name CA   ) 
        (resid    7 and name C    )   ( resid    8 and name N    )  1 -180.00   55.00 2
assign ( resid   10 and name C    )   ( resid   11 and name N    ) 
        (resid   11 and name CA   )   ( resid   11 and name C    )  1 -180.00  135.00 2
assign ( resid   10 and name C    )   ( resid   11 and name N    ) 
        (resid   11 and name CA   )   ( resid   11 and name C    )  1  -55.00  130.00 2
assign ( resid   11 and name N    )   ( resid   11 and name CA   ) 
        (resid   11 and name C    )   ( resid   12 and name N    )  1   15.00  100.00 2
assign ( resid   11 and name C    )   ( resid   12 and name N    ) 
        (resid   12 and name CA   )   ( resid   12 and name C    )  1 -180.00  135.00 2
assign ( resid   12 and name N    )   ( resid   12 and name CA   ) 
        (resid   12 and name C    )   ( resid   13 and name N    )  1 -180.00   55.00 2
assign ( resid   19 and name C    )   ( resid   20 and name N    ) 
        (resid   20 and name CA   )   ( resid   20 and name C    )  1 -180.00  135.00 2
assign ( resid   19 and name C    )   ( resid   20 and name N    ) 
        (resid   20 and name CA   )   ( resid   20 and name C    )  1  -55.00  130.00 2
assign ( resid   20 and name N    )   ( resid   20 and name CA   ) 
        (resid   20 and name C    )   ( resid   21 and name N    )  1   55.00  140.00 2
assign ( resid   20 and name C    )   ( resid   21 and name N    ) 
        (resid   21 and name CA   )   ( resid   21 and name C    )  1 -180.00  135.00 2
assign ( resid   20 and name C    )   ( resid   21 and name N    ) 
        (resid   21 and name CA   )   ( resid   21 and name C    )  1  -55.00  130.00 2
assign ( resid   21 and name N    )   ( resid   21 and name CA   ) 
        (resid   21 and name C    )   ( resid   22 and name N    )  1  110.00   95.00 2
assign ( resid   21 and name C    )   ( resid   22 and name N    ) 
        (resid   22 and name CA   )   ( resid   22 and name C    )  1 -105.00   60.00 2
assign ( resid   22 and name N    )   ( resid   22 and name CA   ) 
        (resid   22 and name C    )   ( resid   23 and name N    )  1    0.00   85.00 2
assign ( resid   22 and name C    )   ( resid   23 and name N    ) 
        (resid   23 and name CA   )   ( resid   23 and name C    )  1  -80.00   35.00 2
assign ( resid   23 and name N    )   ( resid   23 and name CA   ) 
        (resid   23 and name C    )   ( resid   24 and name N    )  1  -35.00   50.00 2
assign ( resid   23 and name C    )   ( resid   24 and name N    ) 
        (resid   24 and name CA   )   ( resid   24 and name C    )  1 -115.00   70.00 2
assign ( resid   24 and name N    )   ( resid   24 and name CA   ) 
        (resid   24 and name C    )   ( resid   25 and name N    )  1  -25.00   60.00 2
assign ( resid   24 and name C    )   ( resid   25 and name N    ) 
        (resid   25 and name CA   )   ( resid   25 and name C    )  1 -180.00  135.00 2
assign ( resid   24 and name C    )   ( resid   25 and name N    ) 
        (resid   25 and name CA   )   ( resid   25 and name C    )  1  -55.00  130.00 2
assign ( resid   25 and name N    )   ( resid   25 and name CA   ) 
        (resid   25 and name C    )   ( resid   26 and name N    )  1   85.00  110.00 2
assign ( resid   29 and name C    )   ( resid   30 and name N    ) 
        (resid   30 and name CA   )   ( resid   30 and name C    )  1 -180.00  135.00 2
assign ( resid   29 and name C    )   ( resid   30 and name N    ) 
        (resid   30 and name CA   )   ( resid   30 and name C    )  1  -55.00  130.00 2
assign ( resid   30 and name N    )   ( resid   30 and name CA   ) 
        (resid   30 and name C    )   ( resid   31 and name N    )  1   95.00  100.00 2
assign ( resid   30 and name C    )   ( resid   31 and name N    ) 
        (resid   31 and name CA   )   ( resid   31 and name C    )  1 -180.00  135.00 2
assign ( resid   30 and name C    )   ( resid   31 and name N    ) 
        (resid   31 and name CA   )   ( resid   31 and name C    )  1  -60.00  125.00 2
assign ( resid   31 and name N    )   ( resid   31 and name CA   ) 
        (resid   31 and name C    )   ( resid   32 and name N    )  1   95.00  100.00 2
assign ( resid   31 and name C    )   ( resid   32 and name N    ) 
        (resid   32 and name CA   )   ( resid   32 and name C    )  1 -100.00   55.00 2
assign ( resid   32 and name N    )   ( resid   32 and name CA   ) 
        (resid   32 and name C    )   ( resid   33 and name N    )  1  -50.00   35.00 2
assign ( resid   39 and name C    )   ( resid   40 and name N    ) 
        (resid   40 and name CA   )   ( resid   40 and name C    )  1 -180.00  135.00 2
assign ( resid   40 and name N    )   ( resid   40 and name CA   ) 
        (resid   40 and name C    )   ( resid   41 and name N    )  1  175.00  120.00 2
assign ( resid   40 and name N    )   ( resid   40 and name CA   ) 
        (resid   40 and name C    )   ( resid   41 and name N    )  1  -60.00  145.00 2
assign ( resid   40 and name N    )   ( resid   40 and name CA   ) 
        (resid   40 and name C    )   ( resid   41 and name N    )  1   55.00  150.00 2
assign ( resid   41 and name N    )   ( resid   41 and name CA   ) 
        (resid   41 and name C    )   ( resid   42 and name N    )  1 -145.00  150.00 2
assign ( resid   41 and name N    )   ( resid   41 and name CA   ) 
        (resid   41 and name C    )   ( resid   42 and name N    )  1   70.00  125.00 2
assign ( resid   49 and name C    )   ( resid   50 and name N    ) 
        (resid   50 and name CA   )   ( resid   50 and name C    )  1 -115.00   70.00 2
assign ( resid   50 and name N    )   ( resid   50 and name CA   ) 
        (resid   50 and name C    )   ( resid   51 and name N    )  1  -45.00   40.00 2
assign ( resid   50 and name C    )   ( resid   51 and name N    ) 
        (resid   51 and name CA   )   ( resid   51 and name C    )  1 -180.00  135.00 2
assign ( resid   50 and name C    )   ( resid   51 and name N    ) 
        (resid   51 and name CA   )   ( resid   51 and name C    )  1  -55.00  130.00 2
assign ( resid   51 and name N    )   ( resid   51 and name CA   ) 
        (resid   51 and name C    )   ( resid   52 and name N    )  1  150.00   45.00 2
assign ( resid   51 and name C    )   ( resid   52 and name N    ) 
        (resid   52 and name CA   )   ( resid   52 and name C    )  1  -65.00   20.00 2
assign ( resid   52 and name N    )   ( resid   52 and name CA   ) 
        (resid   52 and name C    )   ( resid   53 and name N    )  1  160.00    5.00 2
assign ( resid   53 and name N    )   ( resid   53 and name CA   ) 
        (resid   53 and name C    )   ( resid   54 and name N    )  1  160.00   35.00 2
assign ( resid   53 and name C    )   ( resid   54 and name N    ) 
        (resid   54 and name CA   )   ( resid   54 and name C    )  1 -120.00   45.00 2
assign ( resid   54 and name N    )   ( resid   54 and name CA   ) 
        (resid   54 and name C    )   ( resid   55 and name N    )  1   15.00   20.00 2
assign ( resid   54 and name C    )   ( resid   55 and name N    ) 
        (resid   55 and name CA   )   ( resid   55 and name C    )  1 -180.00  135.00 2
assign ( resid   54 and name C    )   ( resid   55 and name N    ) 
        (resid   55 and name CA   )   ( resid   55 and name C    )  1  -55.00  130.00 2
assign ( resid   55 and name N    )   ( resid   55 and name CA   ) 
        (resid   55 and name C    )   ( resid   56 and name N    )  1   90.00  105.00 2
assign ( resid   60 and name C    )   ( resid   61 and name N    ) 
        (resid   61 and name CA   )   ( resid   61 and name C    )  1 -180.00  135.00 2
assign ( resid   60 and name C    )   ( resid   61 and name N    ) 
        (resid   61 and name CA   )   ( resid   61 and name C    )  1  -55.00  130.00 2
assign ( resid   61 and name N    )   ( resid   61 and name CA   ) 
        (resid   61 and name C    )   ( resid   62 and name N    )  1   60.00  145.00 2
assign ( resid   61 and name C    )   ( resid   62 and name N    ) 
        (resid   62 and name CA   )   ( resid   62 and name C    )  1 -180.00  135.00 2
assign ( resid   61 and name C    )   ( resid   62 and name N    ) 
        (resid   62 and name CA   )   ( resid   62 and name C    )  1  -60.00  125.00 2
assign ( resid   62 and name N    )   ( resid   62 and name CA   ) 
        (resid   62 and name C    )   ( resid   63 and name N    )  1 -135.00  150.00 2
assign ( resid   62 and name N    )   ( resid   62 and name CA   ) 
        (resid   62 and name C    )   ( resid   63 and name N    )  1   25.00  110.00 2
assign ( resid   62 and name C    )   ( resid   63 and name N    ) 
        (resid   63 and name CA   )   ( resid   63 and name C    )  1  -85.00   40.00 2
assign ( resid   63 and name N    )   ( resid   63 and name CA   ) 
        (resid   63 and name C    )   ( resid   64 and name N    )  1  -40.00   45.00 2
assign ( resid   63 and name C    )   ( resid   64 and name N    ) 
        (resid   64 and name CA   )   ( resid   64 and name C    )  1 -180.00  135.00 2
assign ( resid   63 and name C    )   ( resid   64 and name N    ) 
        (resid   64 and name CA   )   ( resid   64 and name C    )  1  -55.00  130.00 2
assign ( resid   64 and name N    )   ( resid   64 and name CA   ) 
        (resid   64 and name C    )   ( resid   65 and name N    )  1  160.00   45.00 2
assign ( resid   64 and name C    )   ( resid   65 and name N    ) 
        (resid   65 and name CA   )   ( resid   65 and name C    )  1 -180.00  135.00 2
assign ( resid   65 and name N    )   ( resid   65 and name CA   ) 
        (resid   65 and name C    )   ( resid   66 and name N    )  1 -120.00  175.00 2
assign ( resid   65 and name N    )   ( resid   65 and name CA   ) 
        (resid   65 and name C    )   ( resid   66 and name N    )  1    0.00  145.00 2
assign ( resid   65 and name N    )   ( resid   65 and name CA   ) 
        (resid   65 and name C    )   ( resid   66 and name N    )  1  120.00  175.00 2
assign ( resid   65 and name C    )   ( resid   66 and name N    ) 
        (resid   66 and name CA   )   ( resid   66 and name C    )  1 -115.00   70.00 2
assign ( resid   66 and name N    )   ( resid   66 and name CA   ) 
        (resid   66 and name C    )   ( resid   67 and name N    )  1  170.00   25.00 2
assign ( resid   66 and name C    )   ( resid   67 and name N    ) 
        (resid   67 and name CA   )   ( resid   67 and name C    )  1 -180.00  125.00 2
assign ( resid   67 and name N    )   ( resid   67 and name CA   ) 
        (resid   67 and name C    )   ( resid   68 and name N    )  1 -180.00   55.00 2
assign ( resid   67 and name C    )   ( resid   68 and name N    ) 
        (resid   68 and name CA   )   ( resid   68 and name C    )  1 -100.00   55.00 2
assign ( resid   68 and name N    )   ( resid   68 and name CA   ) 
        (resid   68 and name C    )   ( resid   69 and name N    )  1  170.00   35.00 2
assign ( resid   76 and name C    )   ( resid   77 and name N    ) 
        (resid   77 and name CA   )   ( resid   77 and name C    )  1 -180.00  135.00 2
assign ( resid   77 and name C    )   ( resid   78 and name N    ) 
        (resid   78 and name CA   )   ( resid   78 and name C    )  1 -180.00  135.00 2
assign ( resid   77 and name C    )   ( resid   78 and name N    ) 
        (resid   78 and name CA   )   ( resid   78 and name C    )  1  -55.00  130.00 2
assign ( resid   78 and name N    )   ( resid   78 and name CA   ) 
        (resid   78 and name C    )   ( resid   79 and name N    )  1  110.00   55.00 2
assign ( resid   78 and name N    )   ( resid   78 and name CA   ) 
        (resid   78 and name C    )   ( resid   79 and name N    )  1  -65.00  150.00 2
assign ( resid   79 and name N    )   ( resid   79 and name CA   ) 
        (resid   79 and name C    )   ( resid   80 and name N    )  1  130.00   65.00 2
assign ( resid   79 and name C    )   ( resid   80 and name N    ) 
        (resid   80 and name CA   )   ( resid   80 and name C    )  1 -180.00  135.00 2
assign ( resid   80 and name N    )   ( resid   80 and name CA   ) 
        (resid   80 and name C    )   ( resid   81 and name N    )  1    0.00  115.00 2
assign ( resid   80 and name C    )   ( resid   81 and name N    ) 
        (resid   81 and name CA   )   ( resid   81 and name C    )  1 -110.00   65.00 2
assign ( resid   81 and name N    )   ( resid   81 and name CA   ) 
        (resid   81 and name C    )   ( resid   82 and name N    )  1  -35.00   50.00 2
assign ( resid   81 and name C    )   ( resid   82 and name N    ) 
        (resid   82 and name CA   )   ( resid   82 and name C    )  1  -90.00   45.00 2
assign ( resid   82 and name N    )   ( resid   82 and name CA   ) 
        (resid   82 and name C    )   ( resid   83 and name N    )  1 -145.00  150.00 2
assign ( resid   82 and name N    )   ( resid   82 and name CA   ) 
        (resid   82 and name C    )   ( resid   83 and name N    )  1   90.00  115.00 2
assign ( resid   88 and name N    )   ( resid   88 and name CA   ) 
        (resid   88 and name C    )   ( resid   89 and name N    )  1  165.00   30.00 2
assign ( resid   88 and name C    )   ( resid   89 and name N    ) 
        (resid   89 and name CA   )   ( resid   89 and name C    )  1 -115.00   70.00 2
assign ( resid   89 and name N    )   ( resid   89 and name CA   ) 
        (resid   89 and name C    )   ( resid   90 and name N    )  1  -40.00   45.00 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1  -9.215 -37.668   5.640
    2    H2   MET   1           H2       MET   1  -9.136 -36.994   4.089
    3    H3   MET   1           H3       MET   1 -10.208 -36.354   5.233
    4    HA   MET   1           HA       MET   1  -8.370 -35.628   6.600
    5    HB2  MET   1           2HB      MET   1  -6.669 -36.607   4.293
    6    HB3  MET   1           1HB      MET   1  -6.087 -35.726   5.695
    7    HG2  MET   1           2HG      MET   1  -7.342 -38.458   5.758
    8    HG3  MET   1           1HG      MET   1  -5.614 -38.123   5.818
    9    HE1  MET   1           2HE      MET   1  -6.335 -39.317   9.457
   10    HE2  MET   1           3HE      MET   1  -5.383 -39.562   7.993
   11    HE3  MET   1           1HE      MET   1  -7.110 -39.916   7.989
   12    HA   PRO   2           HA       PRO   2  -9.080 -32.029   4.080
   13    HB2  PRO   2           2HB      PRO   2  -8.182 -30.164   5.783
   14    HB3  PRO   2           1HB      PRO   2  -9.669 -31.064   6.110
   15    HG2  PRO   2           2HG      PRO   2  -6.923 -31.471   7.224
   16    HG3  PRO   2           1HG      PRO   2  -8.489 -31.526   8.054
   17    HD2  PRO   2           2HD      PRO   2  -7.109 -33.750   7.218
   18    HD3  PRO   2           1HD      PRO   2  -8.867 -33.697   7.449
   19    H    THR   3           HN       THR   3  -7.870 -30.436   2.917
   20    HA   THR   3           HA       THR   3  -4.975 -30.480   3.252
   21    HB   THR   3           HB       THR   3  -6.172 -30.812   0.534
   22    HG1  THR   3           1HG      THR   3  -5.834 -32.665   2.459
   23   HG21  THR   3          3HG2      THR   3  -3.967 -29.771   0.585
   24   HG22  THR   3          1HG2      THR   3  -3.881 -31.387  -0.116
   25   HG23  THR   3          2HG2      THR   3  -3.350 -31.116   1.544
   26    H    PHE   4           HN       PHE   4  -3.968 -28.636   2.658
   27    HA   PHE   4           HA       PHE   4  -5.571 -26.470   1.550
   28    HB2  PHE   4           2HB      PHE   4  -4.148 -25.017   3.152
   29    HB3  PHE   4           1HB      PHE   4  -5.553 -25.844   3.800
   30    HD1  PHE   4           1HD      PHE   4  -1.885 -25.727   3.705
   31    HD2  PHE   4           2HD      PHE   4  -5.298 -27.641   5.378
   32    HE1  PHE   4           1HE      PHE   4  -0.458 -26.776   5.412
   33    HE2  PHE   4           2HE      PHE   4  -3.876 -28.693   7.088
   34    HZ   PHE   4           HZ       PHE   4  -1.454 -28.262   7.106
   35    H    ASP   5           HN       ASP   5  -4.483 -25.159   0.125
   36    HA   ASP   5           HA       ASP   5  -1.728 -25.935  -0.481
   37    HB2  ASP   5           2HB      ASP   5  -2.312 -24.689  -2.682
   38    HB3  ASP   5           1HB      ASP   5  -2.925 -26.315  -2.439
   39    H    HIS   6           HN       HIS   6  -1.232 -24.578   1.404
   40    HA   HIS   6           HA       HIS   6  -0.406 -22.709   2.391
   41    HB2  HIS   6           2HB      HIS   6  -0.373 -21.625  -0.441
   42    HB3  HIS   6           1HB      HIS   6   0.381 -20.842   0.941
   43    HD1  HIS   6           1HD      HIS   6   2.560 -21.940   1.887
   44    HD2  HIS   6           2HD      HIS   6   1.033 -23.764  -1.529
   45    HE1  HIS   6           1HE      HIS   6   4.409 -23.400   1.010
   46    HE2  HIS   6           2HE      HIS   6   3.501 -24.424  -1.108
   47    H    GLY   7           HN       GLY   7  -0.840 -20.011   1.987
   48    HA2  GLY   7           2HA      GLY   7  -3.733 -19.672   1.678
   49    HA3  GLY   7           1HA      GLY   7  -2.992 -19.167   3.191
   50    H    ASN   8           HN       ASN   8  -4.376 -17.506   1.298
   51    HA   ASN   8           HA       ASN   8  -2.312 -15.495   1.030
   52    HB2  ASN   8           2HB      ASN   8  -3.243 -14.963  -1.340
   53    HB3  ASN   8           1HB      ASN   8  -2.020 -16.208  -1.142
   54   HD21  ASN   8          1HD2      ASN   8  -2.532 -18.325  -1.520
   55   HD22  ASN   8          2HD2      ASN   8  -4.011 -18.806  -2.272
   56    H    LEU   9           HN       LEU   9  -3.039 -13.436   1.033
   57    HA   LEU   9           HA       LEU   9  -5.900 -12.920   1.110
   58    HB2  LEU   9           2HB      LEU   9  -5.336 -13.518   3.429
   59    HB3  LEU   9           1HB      LEU   9  -4.062 -12.314   3.435
   60    HG   LEU   9           HG       LEU   9  -5.788 -10.546   3.134
   61   HD11  LEU   9          1HD1      LEU   9  -7.516 -11.892   2.083
   62   HD12  LEU   9          2HD1      LEU   9  -8.130 -11.113   3.542
   63   HD13  LEU   9          3HD1      LEU   9  -7.710 -12.826   3.566
   64   HD21  LEU   9          3HD2      LEU   9  -6.187 -12.323   5.538
   65   HD22  LEU   9          1HD2      LEU   9  -6.583 -10.608   5.428
   66   HD23  LEU   9          2HD2      LEU   9  -4.901 -11.132   5.345
   67    H    SER  10           HN       SER  10  -6.282 -11.078   0.080
   68    HA   SER  10           HA       SER  10  -4.115  -9.326  -0.650
   69    HB2  SER  10           2HB      SER  10  -7.095  -9.043  -1.121
   70    HB3  SER  10           1HB      SER  10  -5.827  -8.107  -1.911
   71    HG   SER  10           HG       SER  10  -5.163  -9.889  -3.009
   72    H    LEU  11           HN       LEU  11  -3.514  -7.508   0.389
   73    HA   LEU  11           HA       LEU  11  -4.908  -6.736   2.800
   74    HB2  LEU  11           2HB      LEU  11  -2.498  -5.534   1.434
   75    HB3  LEU  11           1HB      LEU  11  -3.122  -5.015   2.986
   76    HG   LEU  11           HG       LEU  11  -1.999  -7.754   2.386
   77   HD11  LEU  11          1HD1      LEU  11  -0.136  -7.053   3.801
   78   HD12  LEU  11          2HD1      LEU  11  -0.846  -5.446   3.948
   79   HD13  LEU  11          3HD1      LEU  11  -0.284  -6.022   2.378
   80   HD21  LEU  11          3HD2      LEU  11  -2.126  -8.083   4.810
   81   HD22  LEU  11          1HD2      LEU  11  -3.722  -7.829   4.104
   82   HD23  LEU  11          2HD2      LEU  11  -2.925  -6.520   4.978
   83    H    GLY  12           HN       GLY  12  -4.842  -5.819  -0.489
   84    HA2  GLY  12           2HA      GLY  12  -6.746  -4.572  -1.327
   85    HA3  GLY  12           1HA      GLY  12  -6.659  -3.583   0.124
   86    H    GLU  13           HN       GLU  13  -6.776  -1.982  -1.767
   87    HA   GLU  13           HA       GLU  13  -4.136  -1.460  -2.908
   88    HB2  GLU  13           2HB      GLU  13  -6.755  -0.006  -3.356
   89    HB3  GLU  13           1HB      GLU  13  -5.260   0.256  -4.243
   90    HG2  GLU  13           2HG      GLU  13  -5.370  -2.063  -5.060
   91    HG3  GLU  13           1HG      GLU  13  -6.913  -2.257  -4.233
   92    H    LEU  14           HN       LEU  14  -2.772  -0.148  -1.942
   93    HA   LEU  14           HA       LEU  14  -3.722   1.408   0.337
   94    HB2  LEU  14           2HB      LEU  14  -0.982   0.489  -0.502
   95    HB3  LEU  14           1HB      LEU  14  -1.251   1.584   0.840
   96    HG   LEU  14           HG       LEU  14  -2.293  -1.243   0.644
   97   HD11  LEU  14          1HD1      LEU  14  -0.703  -1.710   2.441
   98   HD12  LEU  14          2HD1      LEU  14  -0.112  -0.052   2.353
   99   HD13  LEU  14          3HD1      LEU  14   0.124  -1.143   0.989
  100   HD21  LEU  14          3HD2      LEU  14  -3.808   0.214   1.877
  101   HD22  LEU  14          1HD2      LEU  14  -2.469   0.775   2.878
  102   HD23  LEU  14          2HD2      LEU  14  -2.989  -0.908   2.965
  103    H    GLU  15           HN       GLU  15  -3.055   3.521   0.699
  104    HA   GLU  15           HA       GLU  15  -2.917   5.232  -1.581
  105    HB2  GLU  15           2HB      GLU  15  -2.449   5.836   1.350
  106    HB3  GLU  15           1HB      GLU  15  -2.743   7.024   0.088
  107    HG2  GLU  15           2HG      GLU  15  -4.967   6.594   0.002
  108    HG3  GLU  15           1HG      GLU  15  -4.770   4.902   0.458
  109    H    LEU  16           HN       LEU  16  -1.137   6.112  -2.527
  110    HA   LEU  16           HA       LEU  16   1.453   5.130  -1.691
  111    HB2  LEU  16           2HB      LEU  16   0.471   5.534  -4.117
  112    HB3  LEU  16           1HB      LEU  16   1.090   7.152  -3.860
  113    HG   LEU  16           HG       LEU  16   2.666   5.760  -5.122
  114   HD11  LEU  16          1HD1      LEU  16   3.671   6.429  -2.359
  115   HD12  LEU  16          2HD1      LEU  16   3.575   7.538  -3.726
  116   HD13  LEU  16          3HD1      LEU  16   4.670   6.158  -3.788
  117   HD21  LEU  16          3HD2      LEU  16   2.757   4.052  -2.641
  118   HD22  LEU  16          1HD2      LEU  16   3.788   3.873  -4.061
  119   HD23  LEU  16          2HD2      LEU  16   2.052   3.595  -4.191
  120    H    THR  17           HN       THR  17   2.469   6.128  -0.085
  121    HA   THR  17           HA       THR  17   1.986   8.976   0.363
  122    HB   THR  17           HB       THR  17   3.405   6.978   2.133
  123    HG1  THR  17           1HG      THR  17   1.382   6.346   2.388
  124   HG21  THR  17          3HG2      THR  17   2.348   9.748   2.726
  125   HG22  THR  17          1HG2      THR  17   4.050   9.315   2.557
  126   HG23  THR  17          2HG2      THR  17   3.100   8.655   3.887
  127    H    VAL  18           HN       VAL  18   3.371  10.417  -0.342
  128    HA   VAL  18           HA       VAL  18   6.143   9.615  -0.892
  129    HB   VAL  18           HB       VAL  18   4.620  12.028  -1.907
  130   HG11  VAL  18          1HG1      VAL  18   7.379  11.006  -2.579
  131   HG12  VAL  18          2HG1      VAL  18   6.991  12.505  -1.735
  132   HG13  VAL  18          3HG1      VAL  18   6.547  12.305  -3.431
  133   HG21  VAL  18          3HG2      VAL  18   4.661  10.899  -4.080
  134   HG22  VAL  18          1HG2      VAL  18   3.789   9.943  -2.880
  135   HG23  VAL  18          2HG2      VAL  18   5.433   9.499  -3.338
  136    H    LEU  19           HN       LEU  19   7.639  10.269   0.501
  137    HA   LEU  19           HA       LEU  19   6.951  12.317   2.458
  138    HB2  LEU  19           2HB      LEU  19   9.360  10.509   2.253
  139    HB3  LEU  19           1HB      LEU  19   9.038  11.616   3.574
  140    HG   LEU  19           HG       LEU  19   7.348   9.225   2.831
  141   HD11  LEU  19          1HD1      LEU  19   8.162   8.303   4.943
  142   HD12  LEU  19          2HD1      LEU  19   9.203   9.712   5.154
  143   HD13  LEU  19          3HD1      LEU  19   9.481   8.603   3.811
  144   HD21  LEU  19          3HD2      LEU  19   7.102  11.184   5.113
  145   HD22  LEU  19          1HD2      LEU  19   6.157   9.706   4.921
  146   HD23  LEU  19          2HD2      LEU  19   5.991  11.017   3.753
  147    H    TYR  20           HN       TYR  20   7.470  14.344   2.132
  148    HA   TYR  20           HA       TYR  20  10.039  15.096   1.066
  149    HB2  TYR  20           2HB      TYR  20   9.206  16.446  -0.764
  150    HB3  TYR  20           1HB      TYR  20   8.628  14.799  -0.983
  151    HD1  TYR  20           1HD      TYR  20   6.211  14.292  -0.208
  152    HD2  TYR  20           2HD      TYR  20   7.717  18.235  -0.794
  153    HE1  TYR  20           1HE      TYR  20   3.911  15.138  -0.416
  154    HE2  TYR  20           2HE      TYR  20   5.422  19.088  -1.001
  155    HH   TYR  20           HH       TYR  20   3.181  18.203  -1.622
  156    H    ASP  21           HN       ASP  21   9.950  17.681   0.890
  157    HA   ASP  21           HA       ASP  21   8.348  18.671   3.149
  158    HB2  ASP  21           2HB      ASP  21  10.140  20.013   3.946
  159    HB3  ASP  21           1HB      ASP  21  10.818  18.411   3.685
  160    H    GLU  22           HN       GLU  22   7.787  20.954   3.015
  161    HA   GLU  22           HA       GLU  22   6.962  21.430   0.278
  162    HB2  GLU  22           2HB      GLU  22   6.204  22.811   2.851
  163    HB3  GLU  22           1HB      GLU  22   5.500  23.170   1.279
  164    HG2  GLU  22           2HG      GLU  22   4.826  20.739   1.172
  165    HG3  GLU  22           1HG      GLU  22   5.288  20.631   2.870
  166    H    GLU  23           HN       GLU  23   9.664  22.272   1.862
  167    HA   GLU  23           HA       GLU  23   9.850  24.929   0.667
  168    HB2  GLU  23           2HB      GLU  23  11.824  23.405   2.373
  169    HB3  GLU  23           1HB      GLU  23  12.007  25.059   1.826
  170    HG2  GLU  23           2HG      GLU  23   9.944  25.634   3.090
  171    HG3  GLU  23           1HG      GLU  23   9.960  23.998   3.746
  172    H    ARG  24           HN       ARG  24  10.293  21.772  -0.199
  173    HA   ARG  24           HA       ARG  24  12.705  22.254  -1.783
  174    HB2  ARG  24           2HB      ARG  24  11.893  20.097  -0.279
  175    HB3  ARG  24           1HB      ARG  24  11.508  19.587  -1.915
  176    HG2  ARG  24           2HG      ARG  24  13.738  18.862  -1.200
  177    HG3  ARG  24           1HG      ARG  24  13.796  19.931  -2.604
  178    HD2  ARG  24           2HD      ARG  24  15.509  20.380  -0.805
  179    HD3  ARG  24           1HD      ARG  24  14.529  21.762  -1.293
  180    HE   ARG  24           HE       ARG  24  13.312  20.484   0.908
  181   HH11  ARG  24          1HH1      ARG  24  16.158  22.399   0.164
  182   HH12  ARG  24          2HH1      ARG  24  16.216  23.155   1.727
  183   HH21  ARG  24          1HH2      ARG  24  13.359  21.503   2.928
  184   HH22  ARG  24          2HH2      ARG  24  14.610  22.650   3.305
  185    H    TYR  25           HN       TYR  25   9.873  20.224  -2.476
  186    HA   TYR  25           HA       TYR  25   9.470  21.633  -5.007
  187    HB2  TYR  25           2HB      TYR  25  10.067  18.680  -4.743
  188    HB3  TYR  25           1HB      TYR  25   9.348  19.397  -6.178
  189    HD1  TYR  25           2HD      TYR  25  10.668  20.846  -7.643
  190    HD2  TYR  25           1HD      TYR  25  12.411  19.002  -4.228
  191    HE1  TYR  25           2HE      TYR  25  12.910  21.334  -8.529
  192    HE2  TYR  25           1HE      TYR  25  14.655  19.486  -5.106
  193    HH   TYR  25           HH       TYR  25  15.177  21.591  -7.768
  194    H    ASP  26           HN       ASP  26   7.539  20.550  -6.176
  195    HA   ASP  26           HA       ASP  26   5.539  19.684  -4.196
  196    HB2  ASP  26           2HB      ASP  26   5.144  22.007  -5.022
  197    HB3  ASP  26           1HB      ASP  26   5.021  21.373  -6.657
  198    H    ILE  27           HN       ILE  27   3.758  18.436  -5.200
  199    HA   ILE  27           HA       ILE  27   4.983  16.378  -6.853
  200    HB   ILE  27           HB       ILE  27   2.258  16.418  -5.537
  201   HG12  ILE  27          2HG1      ILE  27   4.825  15.048  -4.690
  202   HG13  ILE  27          1HG1      ILE  27   4.142  16.477  -3.922
  203   HG21  ILE  27          1HG2      ILE  27   3.802  14.163  -6.817
  204   HG22  ILE  27          2HG2      ILE  27   2.343  14.920  -7.455
  205   HG23  ILE  27          3HG2      ILE  27   2.272  13.998  -5.954
  206   HD11  ILE  27          3HD1      ILE  27   3.650  14.503  -2.625
  207   HD12  ILE  27          1HD1      ILE  27   2.897  13.739  -4.025
  208   HD13  ILE  27          2HD1      ILE  27   2.160  15.167  -3.300
  209    H    VAL  28           HN       VAL  28   4.903  16.618  -8.980
  210    HA   VAL  28           HA       VAL  28   2.567  17.860 -10.226
  211    HB   VAL  28           HB       VAL  28   5.100  16.846 -11.538
  212   HG11  VAL  28          1HG1      VAL  28   2.880  18.604 -12.586
  213   HG12  VAL  28          2HG1      VAL  28   3.209  16.940 -13.067
  214   HG13  VAL  28          3HG1      VAL  28   4.371  18.211 -13.447
  215   HG21  VAL  28          3HG2      VAL  28   5.762  19.201 -11.660
  216   HG22  VAL  28          1HG2      VAL  28   5.569  18.671  -9.989
  217   HG23  VAL  28          2HG2      VAL  28   4.319  19.654 -10.751
  218    H    GLU  29           HN       GLU  29   4.408  14.835 -10.336
  219    HA   GLU  29           HA       GLU  29   1.959  13.433 -11.148
  220    HB2  GLU  29           2HB      GLU  29   4.676  13.261 -12.431
  221    HB3  GLU  29           1HB      GLU  29   3.556  11.909 -12.504
  222    HG2  GLU  29           2HG      GLU  29   2.900  14.679 -13.469
  223    HG3  GLU  29           1HG      GLU  29   3.553  13.404 -14.497
  224    H    GLN  30           HN       GLN  30   1.856  11.264 -10.507
  225    HA   GLN  30           HA       GLN  30   3.933   9.916  -9.140
  226    HB2  GLN  30           2HB      GLN  30   3.047   9.892  -6.885
  227    HB3  GLN  30           1HB      GLN  30   3.342  11.558  -7.366
  228    HG2  GLN  30           2HG      GLN  30   1.003  11.919  -7.741
  229    HG3  GLN  30           1HG      GLN  30   0.652  10.216  -7.461
  230   HE21  GLN  30          1HE2      GLN  30  -0.744  10.625  -5.791
  231   HE22  GLN  30          2HE2      GLN  30  -0.220  11.186  -4.245
  232    H    THR  31           HN       THR  31   2.796   7.993  -7.815
  233    HA   THR  31           HA       THR  31   0.762   6.852  -9.558
  234    HB   THR  31           HB       THR  31   1.102   4.902  -7.803
  235    HG1  THR  31           1HG      THR  31   2.445   6.022  -6.387
  236   HG21  THR  31          3HG2      THR  31   3.160   5.627  -9.892
  237   HG22  THR  31          1HG2      THR  31   1.657   4.747 -10.172
  238   HG23  THR  31          2HG2      THR  31   2.933   4.025  -9.190
  239    H    GLU  32           HN       GLU  32  -1.303   6.342  -8.895
  240    HA   GLU  32           HA       GLU  32  -2.336   7.891  -6.712
  241    HB2  GLU  32           2HB      GLU  32  -3.654   5.934  -8.598
  242    HB3  GLU  32           1HB      GLU  32  -4.520   6.915  -7.421
  243    HG2  GLU  32           2HG      GLU  32  -3.923   8.925  -8.532
  244    HG3  GLU  32           1HG      GLU  32  -2.770   8.083  -9.567
  245    H    THR  33           HN       THR  33  -2.584   4.407  -7.464
  246    HA   THR  33           HA       THR  33  -2.393   3.822  -4.602
  247    HB   THR  33           HB       THR  33  -4.322   2.163  -4.932
  248    HG1  THR  33           1HG      THR  33  -5.842   3.120  -6.598
  249   HG21  THR  33          3HG2      THR  33  -6.034   3.854  -4.449
  250   HG22  THR  33          1HG2      THR  33  -4.934   5.121  -4.995
  251   HG23  THR  33          2HG2      THR  33  -4.545   4.174  -3.558
  252    H    VAL  34           HN       VAL  34  -1.635   1.757  -4.116
  253    HA   VAL  34           HA       VAL  34  -1.040  -0.002  -6.407
  254    HB   VAL  34           HB       VAL  34   1.031  -0.746  -5.183
  255   HG11  VAL  34          1HG1      VAL  34   1.188   0.698  -7.112
  256   HG12  VAL  34          2HG1      VAL  34   2.394   1.163  -5.912
  257   HG13  VAL  34          3HG1      VAL  34   0.925   2.122  -6.103
  258   HG21  VAL  34          3HG2      VAL  34   2.004   0.805  -3.547
  259   HG22  VAL  34          1HG2      VAL  34   0.497   0.091  -2.970
  260   HG23  VAL  34          2HG2      VAL  34   0.515   1.749  -3.571
  261    H    GLN  35           HN       GLN  35  -1.112  -2.264  -5.942
  262    HA   GLN  35           HA       GLN  35  -2.743  -2.819  -3.562
  263    HB2  GLN  35           2HB      GLN  35  -3.689  -3.300  -5.867
  264    HB3  GLN  35           1HB      GLN  35  -2.487  -4.580  -5.997
  265    HG2  GLN  35           2HG      GLN  35  -3.428  -5.617  -3.962
  266    HG3  GLN  35           1HG      GLN  35  -4.677  -4.373  -3.940
  267   HE21  GLN  35          1HE2      GLN  35  -3.524  -7.262  -5.425
  268   HE22  GLN  35          2HE2      GLN  35  -4.917  -7.547  -6.420
  269    H    VAL  36           HN       VAL  36  -2.161  -4.358  -2.120
  270    HA   VAL  36           HA       VAL  36   0.342  -5.816  -2.655
  271    HB   VAL  36           HB       VAL  36   0.908  -4.118  -1.069
  272   HG11  VAL  36          1HG1      VAL  36  -0.247  -3.837   1.071
  273   HG12  VAL  36          2HG1      VAL  36  -1.433  -5.049   0.584
  274   HG13  VAL  36          3HG1      VAL  36  -1.317  -3.526  -0.296
  275   HG21  VAL  36          3HG2      VAL  36   1.905  -6.275  -0.633
  276   HG22  VAL  36          1HG2      VAL  36   0.513  -6.755   0.337
  277   HG23  VAL  36          2HG2      VAL  36   1.569  -5.456   0.893
  278    H    ASP  37           HN       ASP  37   0.185  -7.877  -2.576
  279    HA   ASP  37           HA       ASP  37  -2.077  -9.146  -1.172
  280    HB2  ASP  37           2HB      ASP  37  -0.613  -9.995  -3.686
  281    HB3  ASP  37           1HB      ASP  37  -1.798 -10.990  -2.852
  282    H    LEU  38           HN       LEU  38  -1.595 -10.858   0.188
  283    HA   LEU  38           HA       LEU  38   1.265 -11.538   0.414
  284    HB2  LEU  38           2HB      LEU  38  -0.799 -11.367   2.608
  285    HB3  LEU  38           1HB      LEU  38   0.831 -11.973   2.822
  286    HG   LEU  38           HG       LEU  38   0.070  -9.148   2.078
  287   HD11  LEU  38          1HD1      LEU  38   1.259 -10.297   4.598
  288   HD12  LEU  38          2HD1      LEU  38  -0.397  -9.723   4.405
  289   HD13  LEU  38          3HD1      LEU  38   0.949  -8.591   4.280
  290   HD21  LEU  38          3HD2      LEU  38   2.459  -8.661   2.324
  291   HD22  LEU  38          1HD2      LEU  38   2.163  -9.804   1.013
  292   HD23  LEU  38          2HD2      LEU  38   2.783 -10.378   2.561
  293    H    GLU  39           HN       GLU  39   1.710 -13.580  -0.060
  294    HA   GLU  39           HA       GLU  39  -0.293 -15.621   0.654
  295    HB2  GLU  39           2HB      GLU  39   1.901 -15.900  -1.413
  296    HB3  GLU  39           1HB      GLU  39   0.697 -17.116  -0.996
  297    HG2  GLU  39           2HG      GLU  39  -1.062 -15.670  -1.820
  298    HG3  GLU  39           1HG      GLU  39   0.139 -14.456  -2.219
  299    H    GLY  40           HN       GLY  40   0.543 -17.570   1.487
  300    HA2  GLY  40           2HA      GLY  40   3.024 -18.321   2.207
  301    HA3  GLY  40           1HA      GLY  40   2.716 -17.017   3.343
  302    HA   PRO  41           HA       PRO  41   1.355 -20.891   5.378
  303    HB2  PRO  41           2HB      PRO  41   2.103 -19.435   7.812
  304    HB3  PRO  41           1HB      PRO  41   2.683 -20.990   7.212
  305    HG2  PRO  41           2HG      PRO  41   4.239 -18.796   7.210
  306    HG3  PRO  41           1HG      PRO  41   4.347 -20.027   5.937
  307    HD2  PRO  41           2HD      PRO  41   2.962 -17.367   5.888
  308    HD3  PRO  41           1HD      PRO  41   3.964 -18.137   4.638
  309    H    ARG  42           HN       ARG  42  -0.622 -21.300   6.029
  310    HA   ARG  42           HA       ARG  42  -2.697 -19.504   6.311
  311    HB2  ARG  42           2HB      ARG  42  -2.320 -22.256   7.494
  312    HB3  ARG  42           1HB      ARG  42  -3.829 -21.367   7.621
  313    HG2  ARG  42           2HG      ARG  42  -2.553 -21.956   4.972
  314    HG3  ARG  42           1HG      ARG  42  -3.641 -23.093   5.769
  315    HD2  ARG  42           2HD      ARG  42  -5.355 -21.297   5.859
  316    HD3  ARG  42           1HD      ARG  42  -4.270 -20.271   4.923
  317    HE   ARG  42           HE       ARG  42  -4.446 -21.950   3.121
  318   HH11  ARG  42          1HH1      ARG  42  -6.920 -21.855   5.605
  319   HH12  ARG  42          2HH1      ARG  42  -8.133 -22.602   4.603
  320   HH21  ARG  42          1HH2      ARG  42  -6.035 -22.917   1.799
  321   HH22  ARG  42          2HH2      ARG  42  -7.630 -23.197   2.436
  322    H    GLY  43           HN       GLY  43  -0.600 -20.833   8.836
  323    HA2  GLY  43           2HA      GLY  43  -2.001 -19.918  11.075
  324    HA3  GLY  43           1HA      GLY  43  -0.279 -20.255  11.031
  325    H    VAL  44           HN       VAL  44   0.553 -18.288   9.229
  326    HA   VAL  44           HA       VAL  44   0.824 -16.104  11.007
  327    HB   VAL  44           HB       VAL  44   1.449 -16.093   8.048
  328   HG11  VAL  44          1HG1      VAL  44   1.487 -13.889   9.048
  329   HG12  VAL  44          2HG1      VAL  44   3.132 -14.414   8.689
  330   HG13  VAL  44          3HG1      VAL  44   2.531 -14.467  10.346
  331   HG21  VAL  44          3HG2      VAL  44   3.184 -16.974  10.354
  332   HG22  VAL  44          1HG2      VAL  44   3.714 -16.793   8.681
  333   HG23  VAL  44          2HG2      VAL  44   2.512 -18.014   9.098
  334    H    LEU  45           HN       LEU  45  -1.145 -16.639   8.131
  335    HA   LEU  45           HA       LEU  45  -2.181 -14.053   7.839
  336    HB2  LEU  45           2HB      LEU  45  -3.410 -16.732   7.203
  337    HB3  LEU  45           1HB      LEU  45  -4.104 -15.197   6.716
  338    HG   LEU  45           HG       LEU  45  -1.389 -16.205   5.867
  339   HD11  LEU  45          1HD1      LEU  45  -4.010 -16.120   4.382
  340   HD12  LEU  45          2HD1      LEU  45  -3.149 -17.565   4.911
  341   HD13  LEU  45          3HD1      LEU  45  -2.446 -16.523   3.673
  342   HD21  LEU  45          3HD2      LEU  45  -3.011 -13.812   5.008
  343   HD22  LEU  45          1HD2      LEU  45  -1.515 -14.357   4.249
  344   HD23  LEU  45          2HD2      LEU  45  -1.500 -13.788   5.918
  345    H    THR  46           HN       THR  46  -3.105 -16.714   9.931
  346    HA   THR  46           HA       THR  46  -5.560 -15.591  10.828
  347    HB   THR  46           HB       THR  46  -3.791 -17.536  12.335
  348    HG1  THR  46           1HG      THR  46  -4.566 -18.004   9.990
  349   HG21  THR  46          3HG2      THR  46  -5.652 -16.590  13.629
  350   HG22  THR  46          1HG2      THR  46  -5.895 -18.308  13.311
  351   HG23  THR  46          2HG2      THR  46  -6.782 -17.104  12.376
  352    H    VAL  47           HN       VAL  47  -2.238 -15.540  12.057
  353    HA   VAL  47           HA       VAL  47  -2.754 -14.187  14.464
  354    HB   VAL  47           HB       VAL  47  -0.221 -14.179  12.801
  355   HG11  VAL  47          1HG1      VAL  47  -0.231 -12.349  14.399
  356   HG12  VAL  47          2HG1      VAL  47   0.912 -13.593  14.900
  357   HG13  VAL  47          3HG1      VAL  47  -0.654 -13.461  15.700
  358   HG21  VAL  47          3HG2      VAL  47  -1.106 -15.947  15.078
  359   HG22  VAL  47          1HG2      VAL  47   0.513 -15.935  14.379
  360   HG23  VAL  47          2HG2      VAL  47  -0.868 -16.423  13.397
  361    H    PHE  48           HN       PHE  48  -1.751 -12.967  11.280
  362    HA   PHE  48           HA       PHE  48  -1.634 -10.251  12.037
  363    HB2  PHE  48           2HB      PHE  48  -0.540 -11.115  10.014
  364    HB3  PHE  48           1HB      PHE  48  -2.115 -11.443   9.297
  365    HD1  PHE  48           2HD      PHE  48  -0.064  -8.665  10.681
  366    HD2  PHE  48           1HD      PHE  48  -3.146  -9.830   7.992
  367    HE1  PHE  48           2HE      PHE  48  -0.114  -6.385   9.761
  368    HE2  PHE  48           1HE      PHE  48  -3.203  -7.549   7.068
  369    HZ   PHE  48           HZ       PHE  48  -1.686  -5.824   7.952
  370    H    ARG  49           HN       ARG  49  -4.264 -12.304  11.053
  371    HA   ARG  49           HA       ARG  49  -6.108 -10.315  10.313
  372    HB2  ARG  49           2HB      ARG  49  -6.082 -13.187  10.747
  373    HB3  ARG  49           1HB      ARG  49  -7.596 -12.461  11.242
  374    HG2  ARG  49           2HG      ARG  49  -6.299 -12.303   8.534
  375    HG3  ARG  49           1HG      ARG  49  -7.769 -13.176   8.963
  376    HD2  ARG  49           2HD      ARG  49  -7.370 -10.187   8.946
  377    HD3  ARG  49           1HD      ARG  49  -8.350 -11.131   7.827
  378    HE   ARG  49           HE       ARG  49  -9.202 -11.510  10.509
  379   HH11  ARG  49          1HH1      ARG  49  -9.393  -9.282   7.804
  380   HH12  ARG  49          2HH1      ARG  49 -10.838  -8.516   8.391
  381   HH21  ARG  49          1HH2      ARG  49 -11.104 -10.511  11.265
  382   HH22  ARG  49          2HH2      ARG  49 -11.807  -9.199  10.360
  383    H    PHE  50           HN       PHE  50  -4.927 -11.202  13.394
  384    HA   PHE  50           HA       PHE  50  -7.251 -10.434  14.882
  385    HB2  PHE  50           2HB      PHE  50  -4.394 -11.033  15.577
  386    HB3  PHE  50           1HB      PHE  50  -5.477 -10.336  16.766
  387    HD1  PHE  50           1HD      PHE  50  -7.632 -11.583  17.283
  388    HD2  PHE  50           2HD      PHE  50  -4.373 -13.325  15.183
  389    HE1  PHE  50           1HE      PHE  50  -8.500 -13.822  17.811
  390    HE2  PHE  50           2HE      PHE  50  -5.235 -15.570  15.703
  391    HZ   PHE  50           HZ       PHE  50  -7.303 -15.821  17.019
  392    H    ALA  51           HN       ALA  51  -4.589  -8.804  13.440
  393    HA   ALA  51           HA       ALA  51  -5.072  -6.392  15.037
  394    HB1  ALA  51           1HB      ALA  51  -2.971  -5.561  14.125
  395    HB2  ALA  51           2HB      ALA  51  -2.832  -6.993  13.103
  396    HB3  ALA  51           3HB      ALA  51  -2.748  -7.149  14.857
  397    H    ARG  52           HN       ARG  52  -6.080  -4.672  14.210
  398    HA   ARG  52           HA       ARG  52  -7.246  -4.726  11.645
  399    HB2  ARG  52           2HB      ARG  52  -6.984  -2.679  13.806
  400    HB3  ARG  52           1HB      ARG  52  -7.663  -2.246  12.252
  401    HG2  ARG  52           2HG      ARG  52  -9.347  -4.034  12.534
  402    HG3  ARG  52           1HG      ARG  52  -8.700  -4.334  14.147
  403    HD2  ARG  52           2HD      ARG  52  -9.714  -1.649  13.257
  404    HD3  ARG  52           1HD      ARG  52 -10.745  -2.855  14.022
  405    HE   ARG  52           HE       ARG  52  -9.368  -2.662  16.007
  406   HH11  ARG  52          1HH1      ARG  52  -8.886  -0.190  13.577
  407   HH12  ARG  52          2HH1      ARG  52  -8.308   0.997  14.701
  408   HH21  ARG  52          1HH2      ARG  52  -8.629  -1.091  17.510
  409   HH22  ARG  52          2HH2      ARG  52  -8.166   0.489  16.939
  410    HA   PRO  53           HA       PRO  53  -4.292  -3.231   8.822
  411    HB2  PRO  53           2HB      PRO  53  -5.628  -0.984   7.792
  412    HB3  PRO  53           1HB      PRO  53  -5.690  -2.633   7.171
  413    HG2  PRO  53           2HG      PRO  53  -7.603  -1.196   8.937
  414    HG3  PRO  53           1HG      PRO  53  -7.916  -2.428   7.701
  415    HD2  PRO  53           2HD      PRO  53  -8.022  -3.010  10.316
  416    HD3  PRO  53           1HD      PRO  53  -7.390  -4.176   9.132
  417    H    SER  54           HN       SER  54  -2.501  -2.302   9.368
  418    HA   SER  54           HA       SER  54  -2.446   0.522  10.053
  419    HB2  SER  54           2HB      SER  54  -1.509  -1.773  11.662
  420    HB3  SER  54           1HB      SER  54  -0.431  -0.398  11.563
  421    HG   SER  54           HG       SER  54  -2.248   0.912  12.248
  422    H    TYR  55           HN       TYR  55  -1.888  -1.247   7.691
  423    HA   TYR  55           HA       TYR  55   1.018  -1.056   7.443
  424    HB2  TYR  55           2HB      TYR  55   0.514  -2.381   5.264
  425    HB3  TYR  55           1HB      TYR  55   0.396  -3.208   6.810
  426    HD1  TYR  55           1HD      TYR  55  -1.566  -1.715   4.053
  427    HD2  TYR  55           2HD      TYR  55  -1.668  -4.112   7.564
  428    HE1  TYR  55           1HE      TYR  55  -3.854  -2.420   3.499
  429    HE2  TYR  55           2HE      TYR  55  -3.959  -4.817   7.021
  430    HH   TYR  55           HH       TYR  55  -5.414  -4.150   3.960
  431    H    GLU  56           HN       GLU  56   2.026   0.168   5.928
  432    HA   GLU  56           HA       GLU  56   0.399   1.815   4.142
  433    HB2  GLU  56           2HB      GLU  56   0.633   3.010   6.334
  434    HB3  GLU  56           1HB      GLU  56   2.376   2.993   6.109
  435    HG2  GLU  56           2HG      GLU  56   2.139   4.350   4.098
  436    HG3  GLU  56           1HG      GLU  56   0.388   4.347   4.299
  437    H    VAL  57           HN       VAL  57   1.547   2.635   2.372
  438    HA   VAL  57           HA       VAL  57   4.318   1.677   2.102
  439    HB   VAL  57           HB       VAL  57   3.918   1.731  -0.386
  440   HG11  VAL  57          1HG1      VAL  57   2.742  -0.417  -0.440
  441   HG12  VAL  57          2HG1      VAL  57   2.228  -0.173   1.230
  442   HG13  VAL  57          3HG1      VAL  57   3.941  -0.362   0.853
  443   HG21  VAL  57          3HG2      VAL  57   1.029   1.946   0.457
  444   HG22  VAL  57          1HG2      VAL  57   1.603   1.614  -1.176
  445   HG23  VAL  57          2HG2      VAL  57   1.951   3.169  -0.419
  446    H    PHE  58           HN       PHE  58   5.842   3.156   1.735
  447    HA   PHE  58           HA       PHE  58   5.127   5.804   0.785
  448    HB2  PHE  58           2HB      PHE  58   6.076   6.943   2.740
  449    HB3  PHE  58           1HB      PHE  58   4.711   5.936   3.207
  450    HD1  PHE  58           2HD      PHE  58   5.095   3.817   4.423
  451    HD2  PHE  58           1HD      PHE  58   8.272   6.519   3.561
  452    HE1  PHE  58           2HE      PHE  58   6.496   2.707   6.110
  453    HE2  PHE  58           1HE      PHE  58   9.677   5.409   5.248
  454    HZ   PHE  58           HZ       PHE  58   8.789   3.500   6.525
  455    H    VAL  59           HN       VAL  59   6.955   7.088   0.226
  456    HA   VAL  59           HA       VAL  59   9.595   5.815   0.424
  457    HB   VAL  59           HB       VAL  59   8.724   7.206  -2.100
  458   HG11  VAL  59          1HG1      VAL  59  11.122   7.113  -1.661
  459   HG12  VAL  59          2HG1      VAL  59  10.684   6.135  -3.062
  460   HG13  VAL  59          3HG1      VAL  59  11.029   5.357  -1.518
  461   HG21  VAL  59          3HG2      VAL  59   8.763   4.227  -1.633
  462   HG22  VAL  59          1HG2      VAL  59   8.478   5.033  -3.175
  463   HG23  VAL  59          2HG2      VAL  59   7.320   5.217  -1.857
  464    H    ASP  60           HN       ASP  60  11.180   7.218   0.912
  465    HA   ASP  60           HA       ASP  60  10.454  10.002   1.353
  466    HB2  ASP  60           2HB      ASP  60  11.649   8.857   3.161
  467    HB3  ASP  60           1HB      ASP  60  12.977   8.479   2.066
  468    H    LEU  61           HN       LEU  61  10.695  11.369  -0.272
  469    HA   LEU  61           HA       LEU  61  12.808  10.813  -2.253
  470    HB2  LEU  61           2HB      LEU  61  10.023  11.881  -2.668
  471    HB3  LEU  61           1HB      LEU  61  11.255  11.847  -3.916
  472    HG   LEU  61           HG       LEU  61  10.159   9.412  -2.512
  473   HD11  LEU  61          1HD1      LEU  61   9.063   8.937  -4.652
  474   HD12  LEU  61          2HD1      LEU  61   9.598  10.503  -5.263
  475   HD13  LEU  61          3HD1      LEU  61   8.466  10.422  -3.913
  476   HD21  LEU  61          3HD2      LEU  61  12.006   9.681  -4.879
  477   HD22  LEU  61          1HD2      LEU  61  11.359   8.169  -4.241
  478   HD23  LEU  61          2HD2      LEU  61  12.461   9.140  -3.264
  479    H    THR  62           HN       THR  62  12.976  12.500   0.088
  480    HA   THR  62           HA       THR  62  12.755  15.233  -0.660
  481    HB   THR  62           HB       THR  62  14.387  15.506   1.347
  482    HG1  THR  62           1HG      THR  62  13.489  12.931   2.066
  483   HG21  THR  62          3HG2      THR  62  12.025  16.005   1.502
  484   HG22  THR  62          1HG2      THR  62  12.536  15.124   2.940
  485   HG23  THR  62          2HG2      THR  62  11.645  14.290   1.665
  486    H    GLU  63           HN       GLU  63  14.902  12.858  -1.617
  487    HA   GLU  63           HA       GLU  63  17.153  14.649  -2.056
  488    HB2  GLU  63           2HB      GLU  63  16.782  11.747  -2.794
  489    HB3  GLU  63           1HB      GLU  63  18.259  12.657  -2.990
  490    HG2  GLU  63           2HG      GLU  63  18.288  12.987  -0.553
  491    HG3  GLU  63           1HG      GLU  63  16.912  11.905  -0.441
  492    H    ALA  64           HN       ALA  64  14.363  13.546  -3.692
  493    HA   ALA  64           HA       ALA  64  15.478  13.636  -6.343
  494    HB1  ALA  64           1HB      ALA  64  13.676  12.077  -5.808
  495    HB2  ALA  64           2HB      ALA  64  13.205  13.182  -7.100
  496    HB3  ALA  64           3HB      ALA  64  12.600  13.431  -5.462
  497    H    GLY  65           HN       GLY  65  15.252  15.203  -7.869
  498    HA2  GLY  65           2HA      GLY  65  14.058  17.729  -6.946
  499    HA3  GLY  65           1HA      GLY  65  15.460  17.631  -8.004
  500    H    GLU  66           HN       GLU  66  14.713  18.620  -9.776
  501    HA   GLU  66           HA       GLU  66  12.042  18.378 -10.699
  502    HB2  GLU  66           2HB      GLU  66  12.966  19.588 -12.734
  503    HB3  GLU  66           1HB      GLU  66  13.099  20.412 -11.187
  504    HG2  GLU  66           2HG      GLU  66  15.423  19.863 -11.023
  505    HG3  GLU  66           1HG      GLU  66  15.329  18.840 -12.457
  506    H    GLY  67           HN       GLY  67  11.265  17.454 -12.593
  507    HA2  GLY  67           2HA      GLY  67  11.458  16.068 -14.517
  508    HA3  GLY  67           1HA      GLY  67  12.966  15.437 -13.867
  509    H    SER  68           HN       SER  68  11.241  13.608 -14.743
  510    HA   SER  68           HA       SER  68   9.704  12.686 -12.438
  511    HB2  SER  68           2HB      SER  68   8.694  12.594 -14.704
  512    HB3  SER  68           1HB      SER  68   9.924  11.428 -15.176
  513    HG   SER  68           HG       SER  68   7.614  11.021 -13.893
  514    H    HIS  69           HN       HIS  69  10.227  10.994 -11.257
  515    HA   HIS  69           HA       HIS  69  12.669   9.499 -11.932
  516    HB2  HIS  69           2HB      HIS  69  12.009  10.703  -9.230
  517    HB3  HIS  69           1HB      HIS  69  13.339   9.593  -9.535
  518    HD1  HIS  69           1HD      HIS  69  15.372  10.507 -10.880
  519    HD2  HIS  69           2HD      HIS  69  12.460  13.347  -9.994
  520    HE1  HIS  69           1HE      HIS  69  16.432  12.740 -11.348
  521    HE2  HIS  69           2HE      HIS  69  14.720  14.440 -10.625
  522    H    THR  70           HN       THR  70  12.603   7.347 -11.477
  523    HA   THR  70           HA       THR  70  10.120   6.393 -10.234
  524    HB   THR  70           HB       THR  70  10.615   5.604 -12.577
  525    HG1  THR  70           1HG      THR  70   9.443   4.398 -10.740
  526   HG21  THR  70          3HG2      THR  70  13.029   5.316 -12.395
  527   HG22  THR  70          1HG2      THR  70  12.258   3.796 -12.847
  528   HG23  THR  70          2HG2      THR  70  12.801   4.050 -11.187
  529    H    VAL  71           HN       VAL  71  10.154   5.164  -8.466
  530    HA   VAL  71           HA       VAL  71  12.707   4.166  -7.436
  531    HB   VAL  71           HB       VAL  71  12.041   4.909  -5.138
  532   HG11  VAL  71          1HG1      VAL  71  13.749   6.126  -6.357
  533   HG12  VAL  71          2HG1      VAL  71  12.759   7.243  -5.417
  534   HG13  VAL  71          3HG1      VAL  71  12.514   7.099  -7.157
  535   HG21  VAL  71          3HG2      VAL  71  10.026   6.583  -6.636
  536   HG22  VAL  71          1HG2      VAL  71  10.426   6.746  -4.927
  537   HG23  VAL  71          2HG2      VAL  71   9.669   5.267  -5.517
  538    H    ASP  72           HN       ASP  72  12.444   2.477  -5.835
  539    HA   ASP  72           HA       ASP  72  10.043   0.921  -6.266
  540    HB2  ASP  72           2HB      ASP  72  11.179  -0.829  -4.970
  541    HB3  ASP  72           1HB      ASP  72  12.201  -0.236  -6.273
  542    H    VAL  73           HN       VAL  73   8.434   0.636  -4.860
  543    HA   VAL  73           HA       VAL  73   8.199   2.556  -2.751
  544    HB   VAL  73           HB       VAL  73   6.300   0.325  -3.502
  545   HG11  VAL  73          1HG1      VAL  73   4.611   1.663  -2.340
  546   HG12  VAL  73          2HG1      VAL  73   5.850   2.830  -1.879
  547   HG13  VAL  73          3HG1      VAL  73   5.909   1.185  -1.245
  548   HG21  VAL  73          3HG2      VAL  73   6.344   3.219  -4.345
  549   HG22  VAL  73          1HG2      VAL  73   5.080   2.053  -4.734
  550   HG23  VAL  73          2HG2      VAL  73   6.710   1.833  -5.373
  551    H    GLU  74           HN       GLU  74   8.536   2.310  -0.649
  552    HA   GLU  74           HA       GLU  74   9.565  -0.222   0.318
  553    HB2  GLU  74           2HB      GLU  74  10.028   2.507   0.904
  554    HB3  GLU  74           1HB      GLU  74   9.364   1.783   2.362
  555    HG2  GLU  74           2HG      GLU  74  11.757   0.773   0.839
  556    HG3  GLU  74           1HG      GLU  74  11.801   1.716   2.326
  557    H    HIS  75           HN       HIS  75   8.793  -1.180   2.309
  558    HA   HIS  75           HA       HIS  75   5.872  -0.808   2.573
  559    HB2  HIS  75           2HB      HIS  75   7.293  -3.430   3.019
  560    HB3  HIS  75           1HB      HIS  75   5.578  -3.151   2.747
  561    HD1  HIS  75           1HD      HIS  75   8.711  -3.940   1.030
  562    HD2  HIS  75           2HD      HIS  75   4.962  -2.465  -0.026
  563    HE1  HIS  75           1HE      HIS  75   8.551  -4.210  -1.468
  564    HE2  HIS  75           2HE      HIS  75   6.370  -3.121  -2.097
  565    H    ARG  76           HN       ARG  76   4.975  -1.086   4.633
  566    HA   ARG  76           HA       ARG  76   6.645  -1.587   6.926
  567    HB2  ARG  76           2HB      ARG  76   6.984   0.876   6.139
  568    HB3  ARG  76           1HB      ARG  76   5.366   1.133   6.770
  569    HG2  ARG  76           2HG      ARG  76   6.593   1.738   8.581
  570    HG3  ARG  76           1HG      ARG  76   6.393   0.019   8.925
  571    HD2  ARG  76           2HD      ARG  76   8.763   1.069   7.407
  572    HD3  ARG  76           1HD      ARG  76   8.735   1.039   9.167
  573    HE   ARG  76           HE       ARG  76   8.123  -1.504   8.563
  574   HH11  ARG  76          1HH1      ARG  76  10.639   0.620   7.345
  575   HH12  ARG  76          2HH1      ARG  76  11.801  -0.658   7.139
  576   HH21  ARG  76          1HH2      ARG  76   9.659  -3.185   8.312
  577   HH22  ARG  76          2HH2      ARG  76  11.247  -2.822   7.697
  578    H    GLY  77           HN       GLY  77   5.361  -1.714   8.889
  579    HA2  GLY  77           2HA      GLY  77   3.287  -1.412  10.061
  580    HA3  GLY  77           1HA      GLY  77   2.452  -1.428   8.515
  581    H    PHE  78           HN       PHE  78   2.883  -3.580   7.270
  582    HA   PHE  78           HA       PHE  78   2.037  -5.702   9.056
  583    HB2  PHE  78           2HB      PHE  78   1.569  -6.969   7.003
  584    HB3  PHE  78           1HB      PHE  78   0.813  -5.382   6.956
  585    HD1  PHE  78           1HD      PHE  78   1.859  -3.579   5.565
  586    HD2  PHE  78           2HD      PHE  78   3.100  -7.644   5.348
  587    HE1  PHE  78           1HE      PHE  78   2.892  -3.139   3.381
  588    HE2  PHE  78           2HE      PHE  78   4.143  -7.209   3.159
  589    HZ   PHE  78           HZ       PHE  78   4.034  -4.953   2.175
  590    HA   PRO  79           HA       PRO  79   6.023  -7.640   9.254
  591    HB2  PRO  79           2HB      PRO  79   4.642 -10.209   9.555
  592    HB3  PRO  79           1HB      PRO  79   5.655  -9.345  10.714
  593    HG2  PRO  79           2HG      PRO  79   2.985  -9.589  11.026
  594    HG3  PRO  79           1HG      PRO  79   3.880  -8.163  11.584
  595    HD2  PRO  79           2HD      PRO  79   2.205  -8.516   9.127
  596    HD3  PRO  79           1HD      PRO  79   2.326  -7.119  10.217
  597    H    GLY  80           HN       GLY  80   7.012  -7.708   7.336
  598    HA2  GLY  80           2HA      GLY  80   5.884  -9.067   5.062
  599    HA3  GLY  80           1HA      GLY  80   7.425  -8.225   5.120
  600    H    ASP  81           HN       ASP  81   6.144 -10.963   6.960
  601    HA   ASP  81           HA       ASP  81   8.584 -12.465   6.520
  602    HB2  ASP  81           2HB      ASP  81   7.538 -12.563   8.718
  603    HB3  ASP  81           1HB      ASP  81   6.049 -13.163   8.004
  604    H    LEU  82           HN       LEU  82   5.333 -12.342   5.366
  605    HA   LEU  82           HA       LEU  82   5.411 -14.920   4.075
  606    HB2  LEU  82           2HB      LEU  82   3.404 -12.679   3.784
  607    HB3  LEU  82           1HB      LEU  82   3.212 -14.316   3.193
  608    HG   LEU  82           HG       LEU  82   3.512 -14.947   5.727
  609   HD11  LEU  82          1HD1      LEU  82   2.509 -12.108   5.874
  610   HD12  LEU  82          2HD1      LEU  82   4.030 -12.718   6.526
  611   HD13  LEU  82          3HD1      LEU  82   2.498 -13.268   7.202
  612   HD21  LEU  82          3HD2      LEU  82   0.989 -13.755   4.596
  613   HD22  LEU  82          1HD2      LEU  82   1.086 -14.839   5.982
  614   HD23  LEU  82          2HD2      LEU  82   1.548 -15.414   4.380
  615    H    ALA  83           HN       ALA  83   4.450 -14.698   1.636
  616    HA   ALA  83           HA       ALA  83   6.534 -13.350   0.153
  617    HB1  ALA  83           1HB      ALA  83   4.130 -14.909  -0.804
  618    HB2  ALA  83           2HB      ALA  83   5.752 -15.559  -0.569
  619    HB3  ALA  83           3HB      ALA  83   5.460 -14.350  -1.820
  620    H    VAL  84           HN       VAL  84   6.390 -11.262  -0.308
  621    HA   VAL  84           HA       VAL  84   3.784  -9.969  -0.110
  622    HB   VAL  84           HB       VAL  84   6.514  -8.695  -0.386
  623   HG11  VAL  84          1HG1      VAL  84   3.856  -7.519   0.422
  624   HG12  VAL  84          2HG1      VAL  84   4.711  -7.228  -1.094
  625   HG13  VAL  84          3HG1      VAL  84   5.402  -6.669   0.429
  626   HG21  VAL  84          3HG2      VAL  84   4.872  -9.179   2.102
  627   HG22  VAL  84          1HG2      VAL  84   6.385  -8.275   2.026
  628   HG23  VAL  84          2HG2      VAL  84   6.371 -10.003   1.673
  629    H    THR  85           HN       THR  85   2.644  -9.828  -1.901
  630    HA   THR  85           HA       THR  85   4.038  -9.533  -4.473
  631    HB   THR  85           HB       THR  85   1.112 -10.149  -4.176
  632    HG1  THR  85           1HG      THR  85   2.926 -11.666  -3.124
  633   HG21  THR  85          3HG2      THR  85   1.446 -11.260  -6.332
  634   HG22  THR  85          1HG2      THR  85   3.166 -10.866  -6.270
  635   HG23  THR  85          2HG2      THR  85   1.969  -9.578  -6.399
  636    H    VAL  86           HN       VAL  86   3.693  -7.708  -5.654
  637    HA   VAL  86           HA       VAL  86   1.816  -5.745  -4.550
  638    HB   VAL  86           HB       VAL  86   4.639  -5.079  -5.382
  639   HG11  VAL  86          1HG1      VAL  86   4.161  -2.895  -4.359
  640   HG12  VAL  86          2HG1      VAL  86   2.500  -3.413  -4.072
  641   HG13  VAL  86          3HG1      VAL  86   3.099  -3.244  -5.723
  642   HG21  VAL  86          3HG2      VAL  86   5.122  -4.709  -3.019
  643   HG22  VAL  86          1HG2      VAL  86   4.659  -6.385  -3.318
  644   HG23  VAL  86          2HG2      VAL  86   3.503  -5.266  -2.597
  645    H    GLU  87           HN       GLU  87   0.822  -4.478  -6.028
  646    HA   GLU  87           HA       GLU  87   1.602  -4.834  -8.841
  647    HB2  GLU  87           2HB      GLU  87  -0.966  -3.765  -7.622
  648    HB3  GLU  87           1HB      GLU  87  -0.618  -3.782  -9.347
  649    HG2  GLU  87           2HG      GLU  87  -1.040  -6.121  -7.514
  650    HG3  GLU  87           1HG      GLU  87  -1.969  -5.662  -8.941
  651    HA   PRO  88           HA       PRO  88   3.929  -2.343 -10.152
  652    HB2  PRO  88           2HB      PRO  88   2.791   0.338  -9.653
  653    HB3  PRO  88           1HB      PRO  88   3.601  -0.291 -11.087
  654    HG2  PRO  88           2HG      PRO  88   0.766  -0.215 -10.534
  655    HG3  PRO  88           1HG      PRO  88   1.583  -0.780 -12.002
  656    HD2  PRO  88           2HD      PRO  88   0.200  -2.452 -10.335
  657    HD3  PRO  88           1HD      PRO  88   1.607  -2.989 -11.286
  658    H    ARG  89           HN       ARG  89   5.667  -2.234  -9.076
  659    HA   ARG  89           HA       ARG  89   5.624  -1.347  -6.277
  660    HB2  ARG  89           2HB      ARG  89   7.532  -2.771  -5.926
  661    HB3  ARG  89           1HB      ARG  89   6.203  -3.680  -6.634
  662    HG2  ARG  89           2HG      ARG  89   7.309  -3.308  -8.863
  663    HG3  ARG  89           1HG      ARG  89   8.717  -2.738  -7.951
  664    HD2  ARG  89           2HD      ARG  89   8.720  -4.822  -6.703
  665    HD3  ARG  89           1HD      ARG  89   7.362  -5.393  -7.665
  666    HE   ARG  89           HE       ARG  89  10.107  -4.954  -8.638
  667   HH11  ARG  89          1HH1      ARG  89   6.903  -6.294  -9.068
  668   HH12  ARG  89          2HH1      ARG  89   7.314  -7.172 -10.507
  669   HH21  ARG  89          1HH2      ARG  89  10.662  -6.092 -10.537
  670   HH22  ARG  89          2HH2      ARG  89   9.465  -7.074 -11.336
  671    H    MET  90           HN       MET  90   6.764  -0.687  -9.348
  672    HA   MET  90           HA       MET  90   8.749   1.220  -8.344
  673    HB2  MET  90           2HB      MET  90   8.232   0.232 -11.162
  674    HB3  MET  90           1HB      MET  90   9.472   1.390 -10.706
  675    HG2  MET  90           2HG      MET  90   9.345  -1.461  -9.750
  676    HG3  MET  90           1HG      MET  90  10.346  -0.875 -11.077
  677    HE1  MET  90           3HE      MET  90  12.802   1.560  -9.233
  678    HE2  MET  90           1HE      MET  90  11.276   1.962 -10.021
  679    HE3  MET  90           2HE      MET  90  12.383   0.814 -10.775
  680    H    ALA  91           HN       ALA  91   8.190   3.303  -8.329
  681    HA   ALA  91           HA       ALA  91   5.638   3.979  -9.636
  682    HB1  ALA  91           1HB      ALA  91   6.737   5.057  -7.039
  683    HB2  ALA  91           2HB      ALA  91   5.447   3.864  -7.195
  684    HB3  ALA  91           3HB      ALA  91   5.204   5.507  -7.787
  685    H    ARG  92           HN       ARG  92   5.418   6.068 -10.459
  686    HA   ARG  92           HA       ARG  92   7.982   7.355 -11.079
  687    HB2  ARG  92           2HB      ARG  92   6.947   8.240 -13.062
  688    HB3  ARG  92           1HB      ARG  92   6.559   6.528 -12.998
  689    HG2  ARG  92           2HG      ARG  92   4.356   7.145 -12.003
  690    HG3  ARG  92           1HG      ARG  92   4.758   8.833 -12.307
  691    HD2  ARG  92           2HD      ARG  92   5.091   8.142 -14.738
  692    HD3  ARG  92           1HD      ARG  92   4.293   6.633 -14.296
  693    HE   ARG  92           HE       ARG  92   3.054   9.165 -14.740
  694   HH11  ARG  92          1HH1      ARG  92   2.772   6.187 -12.891
  695   HH12  ARG  92          2HH1      ARG  92   1.069   6.393 -12.583
  696   HH21  ARG  92          1HH2      ARG  92   0.809   9.406 -14.377
  697   HH22  ARG  92          2HH2      ARG  92  -0.047   8.216 -13.448
  698    H    VAL  93           HN       VAL  93   8.385   9.237 -10.129
  699    HA   VAL  93           HA       VAL  93   6.107  10.867  -9.236
  700    HB   VAL  93           HB       VAL  93   8.653  10.421  -7.659
  701   HG11  VAL  93          1HG1      VAL  93   7.812  12.677  -7.387
  702   HG12  VAL  93          2HG1      VAL  93   7.529  11.747  -5.916
  703   HG13  VAL  93          3HG1      VAL  93   6.199  12.057  -7.032
  704   HG21  VAL  93          3HG2      VAL  93   7.187   8.478  -7.554
  705   HG22  VAL  93          1HG2      VAL  93   5.833   9.510  -7.095
  706   HG23  VAL  93          2HG2      VAL  93   7.209   9.326  -6.008
  707    H    GLN  94           HN       GLN  94   6.178  12.813 -10.095
  708    HA   GLN  94           HA       GLN  94   8.782  13.846 -10.995
  709    HB2  GLN  94           2HB      GLN  94   7.285  13.740 -12.844
  710    HB3  GLN  94           1HB      GLN  94   5.965  14.423 -11.906
  711    HG2  GLN  94           2HG      GLN  94   7.047  16.574 -11.862
  712    HG3  GLN  94           1HG      GLN  94   8.468  15.914 -12.669
  713   HE21  GLN  94          1HE2      GLN  94   8.161  17.543 -14.264
  714   HE22  GLN  94          2HE2      GLN  94   6.959  17.347 -15.494
  715    H    LEU  95           HN       LEU  95   9.667  15.298  -9.748
  716    HA   LEU  95           HA       LEU  95   7.934  16.972  -8.066
  717    HB2  LEU  95           2HB      LEU  95  10.819  16.165  -7.674
  718    HB3  LEU  95           1HB      LEU  95   9.972  17.326  -6.669
  719    HG   LEU  95           HG       LEU  95   9.300  14.395  -6.945
  720   HD11  LEU  95          1HD1      LEU  95  11.309  14.769  -5.649
  721   HD12  LEU  95          2HD1      LEU  95   9.984  14.290  -4.588
  722   HD13  LEU  95          3HD1      LEU  95  10.481  15.980  -4.671
  723   HD21  LEU  95          3HD2      LEU  95   7.672  14.811  -5.163
  724   HD22  LEU  95          1HD2      LEU  95   7.287  15.724  -6.621
  725   HD23  LEU  95          2HD2      LEU  95   8.029  16.537  -5.242
  726    H    GLU  96           HN       GLU  96   7.930  19.079  -8.404
  727    HA   GLU  96           HA       GLU  96  10.063  20.356  -9.895
  728    HB2  GLU  96           2HB      GLU  96   8.200  19.286 -11.439
  729    HB3  GLU  96           1HB      GLU  96   7.295  20.718 -10.972
  730    HG2  GLU  96           2HG      GLU  96   8.845  22.161 -11.979
  731    HG3  GLU  96           1HG      GLU  96  10.057  20.887 -12.122
  732    H    GLU  97           HN       GLU  97  10.046  22.622  -9.630
  733    HA   GLU  97           HA       GLU  97   9.390  23.631  -7.211
  734    HB2  GLU  97           2HB      GLU  97  10.280  24.724  -9.656
  735    HB3  GLU  97           1HB      GLU  97   8.952  25.740  -9.107
  736    HG2  GLU  97           2HG      GLU  97  11.424  25.028  -7.547
  737    HG3  GLU  97           1HG      GLU  97  11.050  26.590  -8.274
  738    H    ARG  98           HN       ARG  98   7.677  24.448  -6.166
  739    HA   ARG  98           HA       ARG  98   5.355  23.089  -6.664
  740    HB2  ARG  98           2HB      ARG  98   4.566  23.946  -4.696
  741    HB3  ARG  98           1HB      ARG  98   6.289  24.109  -4.501
  742    HG2  ARG  98           2HG      ARG  98   4.566  26.366  -5.453
  743    HG3  ARG  98           1HG      ARG  98   4.861  26.044  -3.747
  744    HD2  ARG  98           2HD      ARG  98   6.878  26.748  -5.865
  745    HD3  ARG  98           1HD      ARG  98   6.417  27.706  -4.458
  746    HE   ARG  98           HE       ARG  98   8.357  25.625  -4.563
  747   HH11  ARG  98          1HH1      ARG  98   5.937  27.047  -2.450
  748   HH12  ARG  98          2HH1      ARG  98   6.788  26.630  -0.991
  749   HH21  ARG  98          1HH2      ARG  98   9.478  25.109  -2.645
  750   HH22  ARG  98          2HH2      ARG  98   8.807  25.545  -1.105
  751    H    GLN  99           HN       GLN  99   3.308  23.592  -7.157
  752    HA   GLN  99           HA       GLN  99   2.837  26.108  -8.592
  753    HB2  GLN  99           2HB      GLN  99   3.286  24.260 -10.193
  754    HB3  GLN  99           1HB      GLN  99   1.942  23.365  -9.503
  755    HG2  GLN  99           2HG      GLN  99   0.392  25.080 -10.256
  756    HG3  GLN  99           1HG      GLN  99   1.737  26.025 -10.897
  757   HE21  GLN  99          1HE2      GLN  99   0.912  25.963 -12.993
  758   HE22  GLN  99          2HE2      GLN  99   0.981  24.525 -13.959
  759    H    THR 100           HN       THR 100   0.777  23.301  -8.144
  760    HA   THR 100           HA       THR 100  -0.576  24.175  -5.822
  761    HB   THR 100           HB       THR 100  -2.843  24.294  -7.278
  762    HG1  THR 100           1HG      THR 100  -1.535  24.316  -9.246
  763   HG21  THR 100          3HG2      THR 100  -2.807  26.724  -6.951
  764   HG22  THR 100          1HG2      THR 100  -1.076  26.652  -6.619
  765   HG23  THR 100          2HG2      THR 100  -2.217  25.867  -5.527
  766    H    VAL 101           HN       VAL 101  -0.352  22.052  -5.183
  767    HA   VAL 101           HA       VAL 101  -1.291  19.920  -6.909
  768    HB   VAL 101           HB       VAL 101   0.766  19.669  -5.520
  769   HG11  VAL 101          1HG1      VAL 101   0.550  19.204  -3.129
  770   HG12  VAL 101          2HG1      VAL 101  -1.169  19.589  -3.211
  771   HG13  VAL 101          3HG1      VAL 101   0.032  20.843  -3.524
  772   HG21  VAL 101          3HG2      VAL 101  -1.440  17.693  -4.959
  773   HG22  VAL 101          1HG2      VAL 101   0.286  17.385  -4.760
  774   HG23  VAL 101          2HG2      VAL 101  -0.373  17.706  -6.364
  775    H    SER 102           HN       SER 102  -3.031  18.591  -6.531
  776    HA   SER 102           HA       SER 102  -4.831  19.361  -4.330
  777    HB2  SER 102           2HB      SER 102  -6.706  18.564  -5.781
  778    HB3  SER 102           1HB      SER 102  -5.863  19.961  -6.444
  779    HG   SER 102           HG       SER 102  -4.564  18.120  -7.536
  780    H    VAL 103           HN       VAL 103  -5.894  17.642  -3.229
  781    HA   VAL 103           HA       VAL 103  -4.318  15.182  -3.346
  782    HB   VAL 103           HB       VAL 103  -5.364  14.669  -1.122
  783   HG11  VAL 103          1HG1      VAL 103  -3.133  15.648  -1.317
  784   HG12  VAL 103          2HG1      VAL 103  -3.971  16.258   0.110
  785   HG13  VAL 103          3HG1      VAL 103  -3.837  17.265  -1.332
  786   HG21  VAL 103          3HG2      VAL 103  -6.375  17.504  -1.357
  787   HG22  VAL 103          1HG2      VAL 103  -6.423  16.513   0.101
  788   HG23  VAL 103          2HG2      VAL 103  -7.367  16.047  -1.314
  789    HA   PRO 104           HA       PRO 104  -7.993  13.140  -4.915
  790    HB2  PRO 104           2HB      PRO 104  -6.592  11.415  -6.493
  791    HB3  PRO 104           1HB      PRO 104  -7.007  13.059  -6.979
  792    HG2  PRO 104           2HG      PRO 104  -4.397  11.954  -6.371
  793    HG3  PRO 104           1HG      PRO 104  -4.799  13.542  -7.039
  794    HD2  PRO 104           2HD      PRO 104  -4.165  12.793  -4.271
  795    HD3  PRO 104           1HD      PRO 104  -4.164  14.397  -5.031
  796    H    VAL 105           HN       VAL 105  -7.686  12.516  -2.463
  797    HA   VAL 105           HA       VAL 105  -6.448   9.917  -2.097
  798    HB   VAL 105           HB       VAL 105  -5.986  11.525  -0.376
  799   HG11  VAL 105          1HG1      VAL 105  -7.926  12.962  -0.612
  800   HG12  VAL 105          2HG1      VAL 105  -7.735  12.458   1.068
  801   HG13  VAL 105          3HG1      VAL 105  -8.962  11.700   0.053
  802   HG21  VAL 105          3HG2      VAL 105  -7.881   9.405   0.621
  803   HG22  VAL 105          1HG2      VAL 105  -6.739  10.302   1.622
  804   HG23  VAL 105          2HG2      VAL 105  -6.147   9.223   0.358
  805    H    THR 106           HN       THR 106  -7.547   8.152  -2.533
  806    HA   THR 106           HA       THR 106 -10.424   8.074  -1.998
  807    HB   THR 106           HB       THR 106 -10.243   5.839  -3.257
  808    HG1  THR 106           1HG      THR 106  -8.236   5.309  -3.675
  809   HG21  THR 106          3HG2      THR 106 -11.234   7.839  -4.249
  810   HG22  THR 106          1HG2      THR 106 -10.296   6.948  -5.448
  811   HG23  THR 106          2HG2      THR 106  -9.634   8.411  -4.719
  812    H    VAL 107           HN       VAL 107 -10.801   7.531   0.042
  813    HA   VAL 107           HA       VAL 107  -8.967   6.033   1.623
  814    HB   VAL 107           HB       VAL 107 -11.857   6.669   2.243
  815   HG11  VAL 107          1HG1      VAL 107  -9.537   5.998   4.046
  816   HG12  VAL 107          2HG1      VAL 107 -10.919   4.961   3.696
  817   HG13  VAL 107          3HG1      VAL 107 -11.149   6.470   4.579
  818   HG21  VAL 107          3HG2      VAL 107  -9.365   8.260   2.841
  819   HG22  VAL 107          1HG2      VAL 107 -10.987   8.637   3.419
  820   HG23  VAL 107          2HG2      VAL 107 -10.629   8.700   1.692
  821    H    GLU 108           HN       GLU 108 -12.310   5.299   0.649
  822    HA   GLU 108           HA       GLU 108 -13.394   3.387   0.138
  823    HB2  GLU 108           2HB      GLU 108 -11.454   3.009  -1.369
  824    HB3  GLU 108           1HB      GLU 108 -10.659   2.125  -0.077
  825    HG2  GLU 108           2HG      GLU 108 -12.232   0.381  -0.162
  826    HG3  GLU 108           1HG      GLU 108 -13.343   1.326  -1.154
  827    H    MET 109           HN       MET 109 -14.267   1.579   1.176
  828    HA   MET 109           HA       MET 109 -13.002   0.778   3.704
  829    HB2  MET 109           2HB      MET 109 -14.683   2.497   4.237
  830    HB3  MET 109           1HB      MET 109 -15.911   1.561   3.396
  831    HG2  MET 109           2HG      MET 109 -15.602  -0.260   5.017
  832    HG3  MET 109           1HG      MET 109 -14.416   0.723   5.871
  833    HE1  MET 109           3HE      MET 109 -16.638   3.713   7.130
  834    HE2  MET 109           1HE      MET 109 -15.716   3.618   5.632
  835    HE3  MET 109           2HE      MET 109 -15.020   3.006   7.131
  836    H    ILE 110           HN       ILE 110 -13.240  -1.344   4.222
  837    HA   ILE 110           HA       ILE 110 -14.496  -3.028   2.186
  838    HB   ILE 110           HB       ILE 110 -13.251  -4.886   3.231
  839   HG12  ILE 110          2HG1      ILE 110 -12.032  -2.730   4.973
  840   HG13  ILE 110          1HG1      ILE 110 -13.167  -3.955   5.527
  841   HG21  ILE 110          1HG2      ILE 110 -11.560  -2.506   2.484
  842   HG22  ILE 110          2HG2      ILE 110 -12.267  -3.676   1.370
  843   HG23  ILE 110          3HG2      ILE 110 -11.015  -4.183   2.505
  844   HD11  ILE 110          3HD1      ILE 110 -10.400  -4.451   4.449
  845   HD12  ILE 110          1HD1      ILE 110 -11.538  -5.696   4.960
  846   HD13  ILE 110          2HD1      ILE 110 -10.905  -4.547   6.137
  847    H    ASN 111           HN       ASN 111 -15.570  -5.049   2.975
  848    HA   ASN 111           HA       ASN 111 -16.897  -4.707   5.577
  849    HB2  ASN 111           2HB      ASN 111 -18.411  -3.963   3.720
  850    HB3  ASN 111           1HB      ASN 111 -18.325  -5.593   3.061
  851   HD21  ASN 111          1HD2      ASN 111 -19.416  -3.639   5.733
  852   HD22  ASN 111          2HD2      ASN 111 -20.593  -4.764   6.323
  853    H    LEU 112           HN       LEU 112 -17.046  -6.542   6.760
  854    HA   LEU 112           HA       LEU 112 -15.617  -8.833   5.678
  855    HB2  LEU 112           2HB      LEU 112 -14.987  -7.931   7.875
  856    HB3  LEU 112           1HB      LEU 112 -16.594  -8.284   8.479
  857    HG   LEU 112           HG       LEU 112 -16.174 -10.700   8.093
  858   HD11  LEU 112          1HD1      LEU 112 -13.889 -11.457   7.677
  859   HD12  LEU 112          2HD1      LEU 112 -13.371  -9.785   7.464
  860   HD13  LEU 112          3HD1      LEU 112 -14.508 -10.507   6.327
  861   HD21  LEU 112          3HD2      LEU 112 -15.815  -9.692  10.291
  862   HD22  LEU 112          1HD2      LEU 112 -14.146  -9.328   9.852
  863   HD23  LEU 112          2HD2      LEU 112 -14.677 -11.005   9.987
  864    H    GLU 113           HN       GLU 113 -17.093  -9.815   4.318
  865    HA   GLU 113           HA       GLU 113 -19.502 -10.916   5.553
  866    HB2  GLU 113           2HB      GLU 113 -18.502 -10.947   2.708
  867    HB3  GLU 113           1HB      GLU 113 -19.901 -11.867   3.240
  868    HG2  GLU 113           2HG      GLU 113 -20.864  -9.659   4.031
  869    HG3  GLU 113           1HG      GLU 113 -19.568  -8.892   3.110
  870    H    HIS 114           HN       HIS 114 -19.822 -13.069   5.891
  871    HA   HIS 114           HA       HIS 114 -18.260 -15.162   4.891
  872    HB2  HIS 114           2HB      HIS 114 -16.531 -14.106   6.424
  873    HB3  HIS 114           1HB      HIS 114 -17.566 -14.563   7.774
  874    HD1  HIS 114           1HD      HIS 114 -17.546 -16.997   8.512
  875    HD2  HIS 114           2HD      HIS 114 -15.314 -16.300   5.068
  876    HE1  HIS 114           1HE      HIS 114 -16.252 -19.118   8.096
  877    HE2  HIS 114           2HE      HIS 114 -15.021 -18.727   5.930
  878    H    HIS 115           HN       HIS 115 -20.269 -13.902   7.456
  879    HA   HIS 115           HA       HIS 115 -21.313 -16.292   8.478
  880    HB2  HIS 115           2HB      HIS 115 -21.679 -14.124   9.563
  881    HB3  HIS 115           1HB      HIS 115 -22.623 -13.572   8.186
  882    HD1  HIS 115           1HD      HIS 115 -25.065 -13.731   8.503
  883    HD2  HIS 115           2HD      HIS 115 -23.013 -16.519  10.822
  884    HE1  HIS 115           1HE      HIS 115 -26.822 -14.912   9.871
  885    HE2  HIS 115           2HE      HIS 115 -25.541 -16.473  11.382
  886    H    HIS 116           HN       HIS 116 -22.228 -17.857   7.296
  887    HA   HIS 116           HA       HIS 116 -23.428 -17.186   4.740
  888    HB2  HIS 116           2HB      HIS 116 -21.854 -19.107   4.974
  889    HB3  HIS 116           1HB      HIS 116 -23.040 -19.913   5.995
  890    HD1  HIS 116           1HD      HIS 116 -24.217 -21.663   4.711
  891    HD2  HIS 116           2HD      HIS 116 -23.329 -18.345   2.358
  892    HE1  HIS 116           1HE      HIS 116 -25.164 -22.167   2.432
  893    HE2  HIS 116           2HE      HIS 116 -24.513 -20.198   0.992
  894    H    HIS 117           HN       HIS 117 -25.184 -16.029   5.744
  895    HA   HIS 117           HA       HIS 117 -27.589 -17.404   5.481
  896    HB2  HIS 117           2HB      HIS 117 -26.766 -18.183   7.851
  897    HB3  HIS 117           1HB      HIS 117 -27.285 -16.578   8.355
  898    HD1  HIS 117           1HD      HIS 117 -29.840 -16.114   8.399
  899    HD2  HIS 117           2HD      HIS 117 -28.811 -19.956   7.175
  900    HE1  HIS 117           1HE      HIS 117 -31.974 -17.442   8.456
  901    HE2  HIS 117           2HE      HIS 117 -31.276 -19.812   7.946
  902    H    HIS 118           HN       HIS 118 -27.362 -15.461   4.134
  903    HA   HIS 118           HA       HIS 118 -27.594 -12.891   5.460
  904    HB2  HIS 118           2HB      HIS 118 -26.231 -13.262   3.370
  905    HB3  HIS 118           1HB      HIS 118 -27.740 -13.514   2.501
  906    HD1  HIS 118           1HD      HIS 118 -28.033 -11.493   1.089
  907    HD2  HIS 118           2HD      HIS 118 -26.770 -10.541   4.940
  908    HE1  HIS 118           1HE      HIS 118 -28.020  -8.976   1.202
  909    HE2  HIS 118           2HE      HIS 118 -27.125  -8.424   3.499
  910    H    HIS 119           HN       HIS 119 -29.594 -15.270   3.969
  911    HA   HIS 119           HA       HIS 119 -31.960 -13.688   4.667
  912    HB2  HIS 119           2HB      HIS 119 -31.566 -13.525   2.195
  913    HB3  HIS 119           1HB      HIS 119 -31.714 -15.277   2.100
  914    HD1  HIS 119           1HD      HIS 119 -34.103 -16.290   2.435
  915    HD2  HIS 119           2HD      HIS 119 -33.953 -12.132   2.474
  916    HE1  HIS 119           1HE      HIS 119 -36.484 -15.520   2.188
  917    HE2  HIS 119           2HE      HIS 119 -36.365 -13.003   2.132
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1   3.493 -30.025  -9.995
    2    H2   MET   1           H2       MET   1   2.900 -29.155 -11.326
    3    H3   MET   1           H3       MET   1   1.853 -29.596 -10.062
    4    HA   MET   1           HA       MET   1   4.176 -27.788  -9.765
    5    HB2  MET   1           2HB      MET   1   2.532 -25.964  -9.596
    6    HB3  MET   1           1HB      MET   1   2.504 -26.724 -11.178
    7    HG2  MET   1           2HG      MET   1   0.499 -27.955 -10.566
    8    HG3  MET   1           1HG      MET   1   0.538 -27.231  -8.959
    9    HE1  MET   1           2HE      MET   1  -2.002 -27.172 -10.893
   10    HE2  MET   1           3HE      MET   1  -2.548 -25.506 -10.693
   11    HE3  MET   1           1HE      MET   1  -2.006 -26.430  -9.291
   12    HA   PRO   2           HA       PRO   2   3.681 -28.586  -5.486
   13    HB2  PRO   2           2HB      PRO   2   4.523 -25.870  -4.838
   14    HB3  PRO   2           1HB      PRO   2   5.387 -27.390  -4.607
   15    HG2  PRO   2           2HG      PRO   2   6.141 -25.532  -6.432
   16    HG3  PRO   2           1HG      PRO   2   6.416 -27.270  -6.652
   17    HD2  PRO   2           2HD      PRO   2   4.303 -25.517  -7.835
   18    HD3  PRO   2           1HD      PRO   2   5.224 -26.836  -8.588
   19    H    THR   3           HN       THR   3   1.379 -28.683  -5.427
   20    HA   THR   3           HA       THR   3  -0.013 -26.226  -4.706
   21    HB   THR   3           HB       THR   3  -2.041 -27.717  -4.681
   22    HG1  THR   3           1HG      THR   3  -0.754 -29.692  -4.455
   23   HG21  THR   3          3HG2      THR   3  -1.504 -26.305  -6.600
   24   HG22  THR   3          1HG2      THR   3  -2.195 -27.840  -7.131
   25   HG23  THR   3          2HG2      THR   3  -0.456 -27.567  -7.247
   26    H    PHE   4           HN       PHE   4   0.336 -25.690  -2.671
   27    HA   PHE   4           HA       PHE   4   0.165 -27.738  -0.595
   28    HB2  PHE   4           2HB      PHE   4   1.425 -25.015  -0.531
   29    HB3  PHE   4           1HB      PHE   4   1.401 -26.147   0.795
   30    HD1  PHE   4           2HD      PHE   4   2.257 -28.616  -0.043
   31    HD2  PHE   4           1HD      PHE   4   3.430 -24.831  -1.600
   32    HE1  PHE   4           2HE      PHE   4   4.349 -29.609  -0.873
   33    HE2  PHE   4           1HE      PHE   4   5.522 -25.818  -2.434
   34    HZ   PHE   4           HZ       PHE   4   5.987 -28.209  -2.071
   35    H    ASP   5           HN       ASP   5  -0.600 -26.614   1.583
   36    HA   ASP   5           HA       ASP   5  -3.181 -25.416   0.985
   37    HB2  ASP   5           2HB      ASP   5  -2.830 -27.290   2.695
   38    HB3  ASP   5           1HB      ASP   5  -2.106 -26.063   3.730
   39    H    HIS   6           HN       HIS   6  -1.367 -23.708   0.204
   40    HA   HIS   6           HA       HIS   6  -0.734 -21.793   2.310
   41    HB2  HIS   6           2HB      HIS   6   0.215 -22.367  -0.394
   42    HB3  HIS   6           1HB      HIS   6  -0.052 -20.649  -0.133
   43    HD1  HIS   6           1HD      HIS   6   1.503 -23.323   2.128
   44    HD2  HIS   6           2HD      HIS   6   2.346 -19.600   0.459
   45    HE1  HIS   6           1HE      HIS   6   3.766 -22.672   3.012
   46    HE2  HIS   6           2HE      HIS   6   4.233 -20.387   2.050
   47    H    GLY   7           HN       GLY   7  -1.560 -19.675   2.351
   48    HA2  GLY   7           2HA      GLY   7  -4.033 -19.371   0.767
   49    HA3  GLY   7           1HA      GLY   7  -3.893 -18.854   2.442
   50    H    ASN   8           HN       ASN   8  -4.759 -17.159   0.507
   51    HA   ASN   8           HA       ASN   8  -2.530 -15.239   0.319
   52    HB2  ASN   8           2HB      ASN   8  -4.966 -15.530  -1.448
   53    HB3  ASN   8           1HB      ASN   8  -3.898 -14.140  -1.487
   54   HD21  ASN   8          1HD2      ASN   8  -1.981 -14.251  -2.526
   55   HD22  ASN   8          2HD2      ASN   8  -1.458 -15.640  -3.424
   56    H    LEU   9           HN       LEU   9  -3.139 -13.031   0.623
   57    HA   LEU   9           HA       LEU   9  -5.766 -12.502   1.768
   58    HB2  LEU   9           2HB      LEU   9  -4.282 -13.079   3.682
   59    HB3  LEU   9           1HB      LEU   9  -3.209 -11.776   3.211
   60    HG   LEU   9           HG       LEU   9  -5.022 -10.148   3.630
   61   HD11  LEU   9          1HD1      LEU   9  -6.920 -11.623   3.218
   62   HD12  LEU   9          2HD1      LEU   9  -7.033 -10.864   4.805
   63   HD13  LEU   9          3HD1      LEU   9  -6.525 -12.546   4.669
   64   HD21  LEU   9          3HD2      LEU   9  -4.381 -11.972   5.948
   65   HD22  LEU   9          1HD2      LEU   9  -4.985 -10.322   6.076
   66   HD23  LEU   9          2HD2      LEU   9  -3.397 -10.626   5.375
   67    H    SER  10           HN       SER  10  -6.516 -10.739   0.838
   68    HA   SER  10           HA       SER  10  -4.609  -9.023  -0.566
   69    HB2  SER  10           2HB      SER  10  -7.603  -9.281  -0.957
   70    HB3  SER  10           1HB      SER  10  -6.485  -8.378  -1.981
   71    HG   SER  10           HG       SER  10  -5.412 -10.680  -1.967
   72    H    LEU  11           HN       LEU  11  -4.059  -7.256   0.494
   73    HA   LEU  11           HA       LEU  11  -5.753  -6.057   2.491
   74    HB2  LEU  11           2HB      LEU  11  -3.221  -4.984   1.237
   75    HB3  LEU  11           1HB      LEU  11  -3.966  -4.413   2.716
   76    HG   LEU  11           HG       LEU  11  -2.799  -7.176   2.362
   77   HD11  LEU  11          1HD1      LEU  11  -0.951  -6.362   3.743
   78   HD12  LEU  11          2HD1      LEU  11  -1.642  -4.741   3.715
   79   HD13  LEU  11          3HD1      LEU  11  -1.057  -5.477   2.222
   80   HD21  LEU  11          3HD2      LEU  11  -3.720  -5.693   4.822
   81   HD22  LEU  11          1HD2      LEU  11  -2.972  -7.289   4.792
   82   HD23  LEU  11          2HD2      LEU  11  -4.559  -7.044   4.057
   83    H    GLY  12           HN       GLY  12  -5.419  -5.901  -0.856
   84    HA2  GLY  12           2HA      GLY  12  -6.889  -4.777  -2.299
   85    HA3  GLY  12           1HA      GLY  12  -7.285  -3.666  -0.992
   86    H    GLU  13           HN       GLU  13  -6.971  -2.032  -2.705
   87    HA   GLU  13           HA       GLU  13  -4.188  -1.452  -3.270
   88    HB2  GLU  13           2HB      GLU  13  -6.729  -0.034  -4.055
   89    HB3  GLU  13           1HB      GLU  13  -5.117   0.505  -4.507
   90    HG2  GLU  13           2HG      GLU  13  -4.756  -1.661  -5.629
   91    HG3  GLU  13           1HG      GLU  13  -6.423  -2.091  -5.266
   92    H    LEU  14           HN       LEU  14  -2.991  -0.364  -1.937
   93    HA   LEU  14           HA       LEU  14  -4.254   1.277   0.132
   94    HB2  LEU  14           2HB      LEU  14  -1.399   0.358  -0.202
   95    HB3  LEU  14           1HB      LEU  14  -1.987   1.320   1.136
   96    HG   LEU  14           HG       LEU  14  -2.861  -1.492   0.488
   97   HD11  LEU  14          1HD1      LEU  14  -1.646  -2.091   2.521
   98   HD12  LEU  14          2HD1      LEU  14  -1.103  -0.421   2.689
   99   HD13  LEU  14          3HD1      LEU  14  -0.572  -1.387   1.313
  100   HD21  LEU  14          3HD2      LEU  14  -4.001  -1.391   2.651
  101   HD22  LEU  14          1HD2      LEU  14  -4.647  -0.205   1.519
  102   HD23  LEU  14          2HD2      LEU  14  -3.555   0.307   2.806
  103    H    GLU  15           HN       GLU  15  -3.616   3.436   0.490
  104    HA   GLU  15           HA       GLU  15  -3.029   4.919  -1.874
  105    HB2  GLU  15           2HB      GLU  15  -3.217   5.740   1.031
  106    HB3  GLU  15           1HB      GLU  15  -2.922   6.877  -0.273
  107    HG2  GLU  15           2HG      GLU  15  -5.225   6.990   0.260
  108    HG3  GLU  15           1HG      GLU  15  -5.091   6.157  -1.285
  109    H    LEU  16           HN       LEU  16  -1.140   5.655  -2.612
  110    HA   LEU  16           HA       LEU  16   1.270   4.655  -1.364
  111    HB2  LEU  16           2HB      LEU  16   0.692   4.697  -3.876
  112    HB3  LEU  16           1HB      LEU  16   1.092   6.398  -3.817
  113    HG   LEU  16           HG       LEU  16   2.913   4.921  -4.686
  114   HD11  LEU  16          1HD1      LEU  16   3.555   6.460  -2.178
  115   HD12  LEU  16          2HD1      LEU  16   3.443   7.121  -3.809
  116   HD13  LEU  16          3HD1      LEU  16   4.716   5.969  -3.410
  117   HD21  LEU  16          3HD2      LEU  16   4.205   3.610  -3.079
  118   HD22  LEU  16          1HD2      LEU  16   2.557   3.007  -3.240
  119   HD23  LEU  16          2HD2      LEU  16   3.010   3.967  -1.832
  120    H    THR  17           HN       THR  17   2.213   5.753   0.195
  121    HA   THR  17           HA       THR  17   1.724   8.606   0.482
  122    HB   THR  17           HB       THR  17   3.315   6.773   2.294
  123    HG1  THR  17           1HG      THR  17   0.889   6.386   1.803
  124   HG21  THR  17          3HG2      THR  17   1.961   9.428   2.812
  125   HG22  THR  17          1HG2      THR  17   3.700   9.185   2.626
  126   HG23  THR  17          2HG2      THR  17   2.849   8.467   3.994
  127    H    VAL  18           HN       VAL  18   3.111  10.099  -0.217
  128    HA   VAL  18           HA       VAL  18   5.799   9.212  -1.004
  129    HB   VAL  18           HB       VAL  18   4.311  11.684  -1.915
  130   HG11  VAL  18          1HG1      VAL  18   6.066  11.829  -3.626
  131   HG12  VAL  18          2HG1      VAL  18   6.887  10.453  -2.889
  132   HG13  VAL  18          3HG1      VAL  18   6.723  11.965  -1.995
  133   HG21  VAL  18          3HG2      VAL  18   4.053  10.503  -4.055
  134   HG22  VAL  18          1HG2      VAL  18   3.215   9.683  -2.739
  135   HG23  VAL  18          2HG2      VAL  18   4.754   9.057  -3.329
  136    H    LEU  19           HN       LEU  19   7.316   9.688   0.401
  137    HA   LEU  19           HA       LEU  19   7.059  12.068   2.093
  138    HB2  LEU  19           2HB      LEU  19   9.026   9.772   2.220
  139    HB3  LEU  19           1HB      LEU  19   8.928  11.094   3.367
  140    HG   LEU  19           HG       LEU  19   6.778   9.022   2.896
  141   HD11  LEU  19          1HD1      LEU  19   7.387   8.204   5.110
  142   HD12  LEU  19          2HD1      LEU  19   8.680   9.399   5.202
  143   HD13  LEU  19          3HD1      LEU  19   8.755   8.110   4.002
  144   HD21  LEU  19          3HD2      LEU  19   5.715  10.007   4.874
  145   HD22  LEU  19          1HD2      LEU  19   5.842  11.173   3.556
  146   HD23  LEU  19          2HD2      LEU  19   6.960  11.256   4.918
  147    H    TYR  20           HN       TYR  20   8.085  13.858   1.497
  148    HA   TYR  20           HA       TYR  20  10.525  13.674  -0.088
  149    HB2  TYR  20           2HB      TYR  20   9.683  15.041  -1.903
  150    HB3  TYR  20           1HB      TYR  20   8.646  13.631  -1.729
  151    HD1  TYR  20           1HD      TYR  20   6.568  14.072  -0.071
  152    HD2  TYR  20           2HD      TYR  20   8.655  17.059  -2.262
  153    HE1  TYR  20           1HE      TYR  20   4.595  15.533   0.052
  154    HE2  TYR  20           2HE      TYR  20   6.693  18.531  -2.141
  155    HH   TYR  20           HH       TYR  20   4.069  17.932  -0.076
  156    H    ASP  21           HN       ASP  21  11.110  16.111  -0.716
  157    HA   ASP  21           HA       ASP  21  11.039  17.606   1.776
  158    HB2  ASP  21           2HB      ASP  21  13.152  17.339   0.409
  159    HB3  ASP  21           1HB      ASP  21  12.408  18.368  -0.813
  160    H    GLU  22           HN       GLU  22   9.296  18.818   2.107
  161    HA   GLU  22           HA       GLU  22   7.755  19.715  -0.199
  162    HB2  GLU  22           2HB      GLU  22   6.011  20.251   1.593
  163    HB3  GLU  22           1HB      GLU  22   6.381  18.561   1.289
  164    HG2  GLU  22           2HG      GLU  22   6.249  18.719   3.601
  165    HG3  GLU  22           1HG      GLU  22   7.974  18.727   3.276
  166    H    GLU  23           HN       GLU  23  10.219  20.987   1.281
  167    HA   GLU  23           HA       GLU  23   9.392  23.576   2.040
  168    HB2  GLU  23           2HB      GLU  23  12.012  22.340   1.275
  169    HB3  GLU  23           1HB      GLU  23  11.889  24.079   1.503
  170    HG2  GLU  23           2HG      GLU  23  10.877  22.242   3.619
  171    HG3  GLU  23           1HG      GLU  23  12.608  22.549   3.470
  172    H    ARG  24           HN       ARG  24  10.823  22.383  -1.022
  173    HA   ARG  24           HA       ARG  24  10.102  24.972  -2.241
  174    HB2  ARG  24           2HB      ARG  24  12.466  23.289  -2.428
  175    HB3  ARG  24           1HB      ARG  24  11.804  23.662  -4.011
  176    HG2  ARG  24           2HG      ARG  24  13.320  25.364  -3.669
  177    HG3  ARG  24           1HG      ARG  24  11.792  26.101  -3.195
  178    HD2  ARG  24           2HD      ARG  24  13.736  24.851  -1.263
  179    HD3  ARG  24           1HD      ARG  24  13.710  26.566  -1.662
  180    HE   ARG  24           HE       ARG  24  11.189  25.526  -0.722
  181   HH11  ARG  24          1HH1      ARG  24  14.238  26.995   0.140
  182   HH12  ARG  24          2HH1      ARG  24  13.691  27.559   1.691
  183   HH21  ARG  24          1HH2      ARG  24  10.435  26.279   1.308
  184   HH22  ARG  24          2HH2      ARG  24  11.514  27.140   2.364
  185    H    TYR  25           HN       TYR  25  10.303  21.499  -3.005
  186    HA   TYR  25           HA       TYR  25   8.797  21.927  -5.441
  187    HB2  TYR  25           2HB      TYR  25   9.821  19.344  -4.248
  188    HB3  TYR  25           1HB      TYR  25   9.190  19.555  -5.876
  189    HD1  TYR  25           1HD      TYR  25  10.449  21.528  -7.218
  190    HD2  TYR  25           2HD      TYR  25  12.106  19.262  -4.022
  191    HE1  TYR  25           1HE      TYR  25  12.712  22.061  -8.021
  192    HE2  TYR  25           2HE      TYR  25  14.371  19.791  -4.811
  193    HH   TYR  25           HH       TYR  25  15.057  22.204  -6.997
  194    H    ASP  26           HN       ASP  26   6.940  20.643  -5.995
  195    HA   ASP  26           HA       ASP  26   5.334  19.676  -3.736
  196    HB2  ASP  26           2HB      ASP  26   4.473  21.886  -4.216
  197    HB3  ASP  26           1HB      ASP  26   4.420  21.542  -5.940
  198    H    ILE  27           HN       ILE  27   3.703  18.134  -4.376
  199    HA   ILE  27           HA       ILE  27   4.751  16.341  -6.371
  200    HB   ILE  27           HB       ILE  27   2.260  16.075  -4.677
  201   HG12  ILE  27          2HG1      ILE  27   5.017  14.884  -4.301
  202   HG13  ILE  27          1HG1      ILE  27   4.331  16.197  -3.347
  203   HG21  ILE  27          1HG2      ILE  27   2.151  14.704  -6.680
  204   HG22  ILE  27          2HG2      ILE  27   2.378  13.695  -5.251
  205   HG23  ILE  27          3HG2      ILE  27   3.740  14.026  -6.322
  206   HD11  ILE  27          3HD1      ILE  27   2.598  14.694  -2.528
  207   HD12  ILE  27          1HD1      ILE  27   4.211  14.078  -2.169
  208   HD13  ILE  27          2HD1      ILE  27   3.275  13.382  -3.493
  209    H    VAL  28           HN       VAL  28   4.317  16.665  -8.449
  210    HA   VAL  28           HA       VAL  28   1.773  17.862  -9.244
  211    HB   VAL  28           HB       VAL  28   4.140  17.040 -10.946
  212   HG11  VAL  28          1HG1      VAL  28   2.057  17.063 -12.212
  213   HG12  VAL  28          2HG1      VAL  28   3.100  18.403 -12.693
  214   HG13  VAL  28          3HG1      VAL  28   1.715  18.695 -11.640
  215   HG21  VAL  28          3HG2      VAL  28   4.690  18.841  -9.394
  216   HG22  VAL  28          1HG2      VAL  28   3.297  19.762  -9.956
  217   HG23  VAL  28          2HG2      VAL  28   4.637  19.432 -11.054
  218    H    GLU  29           HN       GLU  29   3.660  14.919  -9.787
  219    HA   GLU  29           HA       GLU  29   1.177  13.493 -10.450
  220    HB2  GLU  29           2HB      GLU  29   3.814  13.096 -11.878
  221    HB3  GLU  29           1HB      GLU  29   2.302  12.275 -12.226
  222    HG2  GLU  29           2HG      GLU  29   2.678  15.240 -12.519
  223    HG3  GLU  29           1HG      GLU  29   2.960  14.089 -13.823
  224    H    GLN  30           HN       GLN  30   1.236  11.238  -9.917
  225    HA   GLN  30           HA       GLN  30   3.537   9.962  -8.873
  226    HB2  GLN  30           2HB      GLN  30   2.976   9.800  -6.533
  227    HB3  GLN  30           1HB      GLN  30   3.069  11.504  -6.963
  228    HG2  GLN  30           2HG      GLN  30   0.731  11.753  -6.906
  229    HG3  GLN  30           1HG      GLN  30   0.468  10.008  -6.900
  230   HE21  GLN  30          1HE2      GLN  30   0.765   8.851  -4.987
  231   HE22  GLN  30          2HE2      GLN  30   0.853   9.635  -3.447
  232    H    THR  31           HN       THR  31   2.990   7.823  -7.924
  233    HA   THR  31           HA       THR  31   0.732   6.559  -9.141
  234    HB   THR  31           HB       THR  31   2.439   5.466  -6.897
  235    HG1  THR  31           1HG      THR  31   2.944   5.564  -9.714
  236   HG21  THR  31          3HG2      THR  31   1.898   3.301  -7.906
  237   HG22  THR  31          1HG2      THR  31   0.950   4.110  -9.152
  238   HG23  THR  31          2HG2      THR  31   0.427   4.175  -7.467
  239    H    GLU  32           HN       GLU  32  -1.272   6.288  -8.293
  240    HA   GLU  32           HA       GLU  32  -1.890   7.680  -5.849
  241    HB2  GLU  32           2HB      GLU  32  -3.647   6.121  -7.744
  242    HB3  GLU  32           1HB      GLU  32  -4.238   7.022  -6.354
  243    HG2  GLU  32           2HG      GLU  32  -3.227   9.070  -7.359
  244    HG3  GLU  32           1HG      GLU  32  -2.881   8.113  -8.802
  245    H    THR  33           HN       THR  33  -2.703   4.377  -6.921
  246    HA   THR  33           HA       THR  33  -2.392   3.509  -4.128
  247    HB   THR  33           HB       THR  33  -4.322   1.944  -4.534
  248    HG1  THR  33           1HG      THR  33  -4.895   1.878  -6.588
  249   HG21  THR  33          3HG2      THR  33  -6.052   3.632  -4.136
  250   HG22  THR  33          1HG2      THR  33  -4.947   4.898  -4.675
  251   HG23  THR  33          2HG2      THR  33  -4.595   3.984  -3.208
  252    H    VAL  34           HN       VAL  34  -1.836   1.296  -3.839
  253    HA   VAL  34           HA       VAL  34  -0.969  -0.102  -6.293
  254    HB   VAL  34           HB       VAL  34   0.325  -0.367  -3.583
  255   HG11  VAL  34          1HG1      VAL  34   1.134  -1.416  -6.268
  256   HG12  VAL  34          2HG1      VAL  34   0.510  -2.351  -4.909
  257   HG13  VAL  34          3HG1      VAL  34   2.079  -1.555  -4.787
  258   HG21  VAL  34          3HG2      VAL  34   2.245   0.853  -4.533
  259   HG22  VAL  34          1HG2      VAL  34   0.797   1.854  -4.430
  260   HG23  VAL  34          2HG2      VAL  34   1.292   1.179  -5.982
  261    H    GLN  35           HN       GLN  35  -1.424  -2.275  -6.397
  262    HA   GLN  35           HA       GLN  35  -3.317  -3.282  -4.435
  263    HB2  GLN  35           2HB      GLN  35  -3.722  -3.565  -6.884
  264    HB3  GLN  35           1HB      GLN  35  -2.296  -4.588  -6.968
  265    HG2  GLN  35           2HG      GLN  35  -3.340  -6.190  -5.466
  266    HG3  GLN  35           1HG      GLN  35  -4.767  -5.162  -5.343
  267   HE21  GLN  35          1HE2      GLN  35  -6.139  -6.713  -6.179
  268   HE22  GLN  35          2HE2      GLN  35  -6.111  -7.177  -7.853
  269    H    VAL  36           HN       VAL  36  -2.706  -4.459  -2.782
  270    HA   VAL  36           HA       VAL  36  -0.141  -5.899  -2.927
  271    HB   VAL  36           HB       VAL  36   0.203  -3.991  -1.508
  272   HG11  VAL  36          1HG1      VAL  36  -2.227  -4.879   0.034
  273   HG12  VAL  36          2HG1      VAL  36  -2.091  -3.438  -0.972
  274   HG13  VAL  36          3HG1      VAL  36  -1.138  -3.575   0.505
  275   HG21  VAL  36          3HG2      VAL  36  -0.196  -6.440   0.209
  276   HG22  VAL  36          1HG2      VAL  36   0.831  -5.058   0.591
  277   HG23  VAL  36          2HG2      VAL  36   1.223  -6.097  -0.779
  278    H    ASP  37           HN       ASP  37  -0.223  -7.951  -2.542
  279    HA   ASP  37           HA       ASP  37  -2.417  -9.096  -0.958
  280    HB2  ASP  37           2HB      ASP  37  -2.929  -9.443  -3.348
  281    HB3  ASP  37           1HB      ASP  37  -1.356 -10.198  -3.575
  282    H    LEU  38           HN       LEU  38  -1.795 -10.791   0.356
  283    HA   LEU  38           HA       LEU  38   1.118 -11.249   0.449
  284    HB2  LEU  38           2HB      LEU  38  -0.878 -11.330   2.718
  285    HB3  LEU  38           1HB      LEU  38   0.846 -11.611   2.856
  286    HG   LEU  38           HG       LEU  38  -0.421  -8.996   2.036
  287   HD11  LEU  38          1HD1      LEU  38  -0.848  -9.517   4.374
  288   HD12  LEU  38          2HD1      LEU  38   0.327  -8.209   4.235
  289   HD13  LEU  38          3HD1      LEU  38   0.865  -9.841   4.629
  290   HD21  LEU  38          3HD2      LEU  38   1.767  -9.299   1.035
  291   HD22  LEU  38          1HD2      LEU  38   2.447  -9.735   2.601
  292   HD23  LEU  38          2HD2      LEU  38   1.849  -8.098   2.326
  293    H    GLU  39           HN       GLU  39   1.869 -13.318   0.537
  294    HA   GLU  39           HA       GLU  39  -0.157 -15.457   0.671
  295    HB2  GLU  39           2HB      GLU  39   2.554 -15.631  -0.649
  296    HB3  GLU  39           1HB      GLU  39   1.308 -16.867  -0.647
  297    HG2  GLU  39           2HG      GLU  39  -0.127 -15.463  -1.974
  298    HG3  GLU  39           1HG      GLU  39   1.063 -14.173  -1.904
  299    H    GLY  40           HN       GLY  40   0.587 -17.445   1.590
  300    HA2  GLY  40           2HA      GLY  40   2.846 -18.180   2.793
  301    HA3  GLY  40           1HA      GLY  40   2.267 -16.972   3.931
  302    HA   PRO  41           HA       PRO  41   0.366 -20.956   5.196
  303    HB2  PRO  41           2HB      PRO  41   1.071 -20.845   7.790
  304    HB3  PRO  41           1HB      PRO  41   2.168 -21.451   6.543
  305    HG2  PRO  41           2HG      PRO  41   2.113 -18.790   7.891
  306    HG3  PRO  41           1HG      PRO  41   3.505 -19.779   7.420
  307    HD2  PRO  41           2HD      PRO  41   2.568 -17.619   5.992
  308    HD3  PRO  41           1HD      PRO  41   3.525 -18.943   5.301
  309    H    ARG  42           HN       ARG  42  -1.598 -21.183   6.050
  310    HA   ARG  42           HA       ARG  42  -3.274 -18.971   6.337
  311    HB2  ARG  42           2HB      ARG  42  -3.671 -21.817   7.278
  312    HB3  ARG  42           1HB      ARG  42  -4.945 -20.611   7.162
  313    HG2  ARG  42           2HG      ARG  42  -4.785 -20.524   4.808
  314    HG3  ARG  42           1HG      ARG  42  -3.280 -21.443   4.805
  315    HD2  ARG  42           2HD      ARG  42  -5.154 -22.832   4.112
  316    HD3  ARG  42           1HD      ARG  42  -4.477 -23.402   5.636
  317    HE   ARG  42           HE       ARG  42  -6.656 -21.611   6.067
  318   HH11  ARG  42          1HH1      ARG  42  -5.835 -24.913   5.221
  319   HH12  ARG  42          2HH1      ARG  42  -7.360 -25.565   5.758
  320   HH21  ARG  42          1HH2      ARG  42  -8.669 -22.466   6.780
  321   HH22  ARG  42          2HH2      ARG  42  -8.983 -24.172   6.601
  322    H    GLY  43           HN       GLY  43  -1.463 -20.758   8.748
  323    HA2  GLY  43           2HA      GLY  43  -2.838 -19.893  11.046
  324    HA3  GLY  43           1HA      GLY  43  -1.164 -20.432  10.998
  325    H    VAL  44           HN       VAL  44   0.075 -18.555   9.485
  326    HA   VAL  44           HA       VAL  44   0.354 -16.412  11.319
  327    HB   VAL  44           HB       VAL  44   1.429 -16.613   8.496
  328   HG11  VAL  44          1HG1      VAL  44   3.102 -14.995   9.243
  329   HG12  VAL  44          2HG1      VAL  44   2.285 -14.871  10.803
  330   HG13  VAL  44          3HG1      VAL  44   1.470 -14.336   9.333
  331   HG21  VAL  44          3HG2      VAL  44   2.688 -17.382  11.128
  332   HG22  VAL  44          1HG2      VAL  44   3.493 -17.401   9.559
  333   HG23  VAL  44          2HG2      VAL  44   2.141 -18.488   9.869
  334    H    LEU  45           HN       LEU  45  -1.238 -16.721   8.186
  335    HA   LEU  45           HA       LEU  45  -1.921 -14.038   7.790
  336    HB2  LEU  45           2HB      LEU  45  -3.424 -16.530   6.995
  337    HB3  LEU  45           1HB      LEU  45  -3.769 -14.923   6.385
  338    HG   LEU  45           HG       LEU  45  -1.202 -16.454   5.962
  339   HD11  LEU  45          1HD1      LEU  45  -3.076 -17.381   4.717
  340   HD12  LEU  45          2HD1      LEU  45  -1.927 -16.587   3.640
  341   HD13  LEU  45          3HD1      LEU  45  -3.441 -15.784   4.060
  342   HD21  LEU  45          3HD2      LEU  45  -0.636 -14.638   4.414
  343   HD22  LEU  45          1HD2      LEU  45  -0.798 -14.062   6.074
  344   HD23  LEU  45          2HD2      LEU  45  -2.090 -13.771   4.909
  345    H    THR  46           HN       THR  46  -3.448 -16.548   9.717
  346    HA   THR  46           HA       THR  46  -5.804 -15.115  10.365
  347    HB   THR  46           HB       THR  46  -4.425 -17.271  11.980
  348    HG1  THR  46           1HG      THR  46  -4.880 -18.037   9.894
  349   HG21  THR  46          3HG2      THR  46  -6.680 -17.711  12.862
  350   HG22  THR  46          1HG2      THR  46  -7.295 -16.332  11.950
  351   HG23  THR  46          2HG2      THR  46  -6.131 -16.080  13.251
  352    H    VAL  47           HN       VAL  47  -2.613 -15.351  11.880
  353    HA   VAL  47           HA       VAL  47  -3.186 -13.848  14.190
  354    HB   VAL  47           HB       VAL  47  -0.544 -14.068  12.732
  355   HG11  VAL  47          1HG1      VAL  47   0.479 -13.514  14.874
  356   HG12  VAL  47          2HG1      VAL  47  -1.119 -13.340  15.604
  357   HG13  VAL  47          3HG1      VAL  47  -0.598 -12.222  14.342
  358   HG21  VAL  47          3HG2      VAL  47  -1.685 -15.747  14.966
  359   HG22  VAL  47          1HG2      VAL  47  -0.046 -15.872  14.325
  360   HG23  VAL  47          2HG2      VAL  47  -1.427 -16.262  13.299
  361    H    PHE  48           HN       PHE  48  -2.004 -12.910  10.992
  362    HA   PHE  48           HA       PHE  48  -1.693 -10.153  11.534
  363    HB2  PHE  48           2HB      PHE  48  -0.710 -11.410   9.584
  364    HB3  PHE  48           1HB      PHE  48  -2.313 -11.429   8.861
  365    HD1  PHE  48           1HD      PHE  48   0.390  -9.185  10.029
  366    HD2  PHE  48           2HD      PHE  48  -3.092  -9.600   7.617
  367    HE1  PHE  48           1HE      PHE  48   0.837  -6.991   9.012
  368    HE2  PHE  48           2HE      PHE  48  -2.649  -7.406   6.597
  369    HZ   PHE  48           HZ       PHE  48  -0.683  -6.097   7.293
  370    H    ARG  49           HN       ARG  49  -4.439 -12.120  10.743
  371    HA   ARG  49           HA       ARG  49  -6.200 -10.134   9.819
  372    HB2  ARG  49           2HB      ARG  49  -6.307 -12.928  10.640
  373    HB3  ARG  49           1HB      ARG  49  -7.780 -12.055  11.008
  374    HG2  ARG  49           2HG      ARG  49  -6.510 -12.048   8.288
  375    HG3  ARG  49           1HG      ARG  49  -7.709 -13.238   8.791
  376    HD2  ARG  49           2HD      ARG  49  -8.847 -11.522   7.591
  377    HD3  ARG  49           1HD      ARG  49  -9.261 -11.347   9.294
  378    HE   ARG  49           HE       ARG  49  -7.050  -9.706   8.422
  379   HH11  ARG  49          1HH1      ARG  49 -10.508  -9.917   8.903
  380   HH12  ARG  49          2HH1      ARG  49 -10.746  -8.191   8.895
  381   HH21  ARG  49          1HH2      ARG  49  -7.343  -7.447   8.435
  382   HH22  ARG  49          2HH2      ARG  49  -8.942  -6.791   8.611
  383    H    PHE  50           HN       PHE  50  -5.161 -10.990  13.028
  384    HA   PHE  50           HA       PHE  50  -7.385  -9.852  14.402
  385    HB2  PHE  50           2HB      PHE  50  -4.601 -10.559  15.333
  386    HB3  PHE  50           1HB      PHE  50  -5.904 -10.055  16.389
  387    HD1  PHE  50           2HD      PHE  50  -8.202 -11.472  15.698
  388    HD2  PHE  50           1HD      PHE  50  -4.164 -12.794  15.472
  389    HE1  PHE  50           2HE      PHE  50  -8.963 -13.805  15.861
  390    HE2  PHE  50           1HE      PHE  50  -4.917 -15.132  15.632
  391    HZ   PHE  50           HZ       PHE  50  -7.320 -15.638  15.828
  392    H    ALA  51           HN       ALA  51  -4.280  -8.695  13.306
  393    HA   ALA  51           HA       ALA  51  -4.347  -6.286  14.856
  394    HB1  ALA  51           1HB      ALA  51  -2.228  -7.345  14.285
  395    HB2  ALA  51           2HB      ALA  51  -2.307  -5.708  13.636
  396    HB3  ALA  51           3HB      ALA  51  -2.551  -7.091  12.571
  397    H    ARG  52           HN       ARG  52  -5.065  -4.339  14.282
  398    HA   ARG  52           HA       ARG  52  -6.613  -3.979  11.928
  399    HB2  ARG  52           2HB      ARG  52  -5.690  -2.131  14.107
  400    HB3  ARG  52           1HB      ARG  52  -6.650  -1.583  12.752
  401    HG2  ARG  52           2HG      ARG  52  -8.314  -3.396  13.417
  402    HG3  ARG  52           1HG      ARG  52  -7.411  -3.471  14.934
  403    HD2  ARG  52           2HD      ARG  52  -8.745  -1.031  13.773
  404    HD3  ARG  52           1HD      ARG  52  -9.338  -1.990  15.125
  405    HE   ARG  52           HE       ARG  52  -6.685  -0.875  15.465
  406   HH11  ARG  52          1HH1      ARG  52 -10.123  -0.517  15.999
  407   HH12  ARG  52          2HH1      ARG  52  -9.934   0.652  17.277
  408   HH21  ARG  52          1HH2      ARG  52  -6.422   0.669  17.140
  409   HH22  ARG  52          2HH2      ARG  52  -7.832   1.332  17.927
  410    HA   PRO  53           HA       PRO  53  -3.860  -2.488   8.903
  411    HB2  PRO  53           2HB      PRO  53  -4.667   0.167   8.512
  412    HB3  PRO  53           1HB      PRO  53  -5.255  -1.257   7.655
  413    HG2  PRO  53           2HG      PRO  53  -6.462   0.218   9.936
  414    HG3  PRO  53           1HG      PRO  53  -7.259  -0.630   8.600
  415    HD2  PRO  53           2HD      PRO  53  -7.154  -1.662  11.083
  416    HD3  PRO  53           1HD      PRO  53  -7.070  -2.692   9.634
  417    H    SER  54           HN       SER  54  -1.862  -2.200   9.370
  418    HA   SER  54           HA       SER  54  -0.945   0.383  10.337
  419    HB2  SER  54           2HB      SER  54  -0.296  -2.350  11.357
  420    HB3  SER  54           1HB      SER  54   0.915  -1.092  11.422
  421    HG   SER  54           HG       SER  54  -0.518   0.159  12.675
  422    H    TYR  55           HN       TYR  55  -1.265  -1.334   7.814
  423    HA   TYR  55           HA       TYR  55   1.509  -1.610   6.965
  424    HB2  TYR  55           2HB      TYR  55   0.255  -2.675   4.907
  425    HB3  TYR  55           1HB      TYR  55   0.472  -3.587   6.394
  426    HD1  TYR  55           1HD      TYR  55  -1.982  -1.631   4.415
  427    HD2  TYR  55           2HD      TYR  55  -1.401  -4.311   7.671
  428    HE1  TYR  55           1HE      TYR  55  -4.412  -1.991   4.544
  429    HE2  TYR  55           2HE      TYR  55  -3.828  -4.676   7.807
  430    HH   TYR  55           HH       TYR  55  -6.009  -3.567   5.365
  431    H    GLU  56           HN       GLU  56   2.418  -0.106   5.809
  432    HA   GLU  56           HA       GLU  56   0.733   1.627   4.133
  433    HB2  GLU  56           2HB      GLU  56   3.060   2.442   5.877
  434    HB3  GLU  56           1HB      GLU  56   2.342   3.479   4.658
  435    HG2  GLU  56           2HG      GLU  56   0.215   3.422   5.847
  436    HG3  GLU  56           1HG      GLU  56   0.927   2.372   7.071
  437    H    VAL  57           HN       VAL  57   1.572   2.252   2.191
  438    HA   VAL  57           HA       VAL  57   4.216   1.184   1.472
  439    HB   VAL  57           HB       VAL  57   3.392   1.348  -0.928
  440   HG11  VAL  57          1HG1      VAL  57   2.015  -0.598   0.926
  441   HG12  VAL  57          2HG1      VAL  57   3.606  -0.796   0.191
  442   HG13  VAL  57          3HG1      VAL  57   2.162  -0.785  -0.820
  443   HG21  VAL  57          3HG2      VAL  57   0.718   1.599   0.451
  444   HG22  VAL  57          1HG2      VAL  57   0.952   1.267  -1.264
  445   HG23  VAL  57          2HG2      VAL  57   1.481   2.805  -0.584
  446    H    PHE  58           HN       PHE  58   5.743   2.658   0.970
  447    HA   PHE  58           HA       PHE  58   4.897   5.380   0.348
  448    HB2  PHE  58           2HB      PHE  58   6.327   6.319   2.137
  449    HB3  PHE  58           1HB      PHE  58   4.975   5.385   2.760
  450    HD1  PHE  58           2HD      PHE  58   5.372   3.150   3.756
  451    HD2  PHE  58           1HD      PHE  58   8.578   5.682   2.550
  452    HE1  PHE  58           2HE      PHE  58   6.933   1.824   5.119
  453    HE2  PHE  58           1HE      PHE  58  10.137   4.360   3.916
  454    HZ   PHE  58           HZ       PHE  58   9.315   2.428   5.203
  455    H    VAL  59           HN       VAL  59   6.555   6.745  -0.402
  456    HA   VAL  59           HA       VAL  59   9.059   5.418  -1.197
  457    HB   VAL  59           HB       VAL  59   7.529   7.369  -2.914
  458   HG11  VAL  59          1HG1      VAL  59   9.913   7.504  -3.258
  459   HG12  VAL  59          2HG1      VAL  59   9.151   6.741  -4.653
  460   HG13  VAL  59          3HG1      VAL  59  10.008   5.756  -3.470
  461   HG21  VAL  59          3HG2      VAL  59   7.812   4.385  -3.246
  462   HG22  VAL  59          1HG2      VAL  59   7.072   5.482  -4.412
  463   HG23  VAL  59          2HG2      VAL  59   6.333   5.252  -2.825
  464    H    ASP  60           HN       ASP  60  10.858   6.640  -0.937
  465    HA   ASP  60           HA       ASP  60  10.498   9.278   0.290
  466    HB2  ASP  60           2HB      ASP  60  12.634   7.194   0.579
  467    HB3  ASP  60           1HB      ASP  60  12.992   8.878   0.935
  468    H    LEU  61           HN       LEU  61  10.816  10.913  -0.979
  469    HA   LEU  61           HA       LEU  61  13.043  10.819  -2.888
  470    HB2  LEU  61           2HB      LEU  61  10.242  11.784  -3.470
  471    HB3  LEU  61           1HB      LEU  61  11.621  12.098  -4.509
  472    HG   LEU  61           HG       LEU  61  10.713   9.318  -3.787
  473   HD11  LEU  61          1HD1      LEU  61   8.909  10.422  -4.954
  474   HD12  LEU  61          2HD1      LEU  61   9.686   9.239  -6.004
  475   HD13  LEU  61          3HD1      LEU  61  10.019  10.958  -6.212
  476   HD21  LEU  61          3HD2      LEU  61  12.036   8.689  -5.747
  477   HD22  LEU  61          1HD2      LEU  61  13.024   9.491  -4.525
  478   HD23  LEU  61          2HD2      LEU  61  12.511  10.373  -5.964
  479    H    THR  62           HN       THR  62  13.837  11.890  -0.848
  480    HA   THR  62           HA       THR  62  12.949  14.548  -0.262
  481    HB   THR  62           HB       THR  62  15.087  14.554   1.152
  482    HG1  THR  62           1HG      THR  62  15.734  12.206   1.485
  483   HG21  THR  62          3HG2      THR  62  12.995  12.418   1.603
  484   HG22  THR  62          1HG2      THR  62  12.896  14.103   2.112
  485   HG23  THR  62          2HG2      THR  62  14.100  13.033   2.831
  486    H    GLU  63           HN       GLU  63  15.599  13.127  -2.080
  487    HA   GLU  63           HA       GLU  63  16.793  15.700  -2.645
  488    HB2  GLU  63           2HB      GLU  63  17.428  12.949  -3.702
  489    HB3  GLU  63           1HB      GLU  63  18.375  14.383  -4.013
  490    HG2  GLU  63           2HG      GLU  63  18.939  14.557  -1.714
  491    HG3  GLU  63           1HG      GLU  63  17.868  13.226  -1.317
  492    H    ALA  64           HN       ALA  64  15.137  13.146  -4.404
  493    HA   ALA  64           HA       ALA  64  14.023  13.053  -6.376
  494    HB1  ALA  64           1HB      ALA  64  13.739  16.035  -6.009
  495    HB2  ALA  64           2HB      ALA  64  12.650  14.808  -5.359
  496    HB3  ALA  64           3HB      ALA  64  12.795  15.026  -7.104
  497    H    GLY  65           HN       GLY  65  13.914  14.690  -8.576
  498    HA2  GLY  65           2HA      GLY  65  16.527  15.612  -9.312
  499    HA3  GLY  65           1HA      GLY  65  16.085  14.086 -10.069
  500    H    GLU  66           HN       GLU  66  15.669  14.603 -12.113
  501    HA   GLU  66           HA       GLU  66  14.190  17.026 -12.754
  502    HB2  GLU  66           2HB      GLU  66  15.133  14.943 -14.707
  503    HB3  GLU  66           1HB      GLU  66  14.853  16.652 -14.983
  504    HG2  GLU  66           2HG      GLU  66  16.798  17.246 -13.721
  505    HG3  GLU  66           1HG      GLU  66  17.043  15.568 -13.236
  506    H    GLY  67           HN       GLY  67  12.153  17.067 -13.603
  507    HA2  GLY  67           2HA      GLY  67  10.036  16.379 -14.120
  508    HA3  GLY  67           1HA      GLY  67  10.835  15.049 -14.935
  509    H    SER  68           HN       SER  68   9.910  13.286 -14.415
  510    HA   SER  68           HA       SER  68   9.250  12.738 -11.603
  511    HB2  SER  68           2HB      SER  68   7.359  12.530 -13.171
  512    HB3  SER  68           1HB      SER  68   8.260  11.340 -14.103
  513    HG   SER  68           HG       SER  68   6.658  10.645 -12.388
  514    H    HIS  69           HN       HIS  69  10.055  10.899 -10.647
  515    HA   HIS  69           HA       HIS  69  12.020   9.373 -12.201
  516    HB2  HIS  69           2HB      HIS  69  12.555  11.066  -9.858
  517    HB3  HIS  69           1HB      HIS  69  13.234   9.444  -9.761
  518    HD1  HIS  69           1HD      HIS  69  13.238  12.410 -12.153
  519    HD2  HIS  69           2HD      HIS  69  15.562   9.126 -11.099
  520    HE1  HIS  69           1HE      HIS  69  15.374  12.649 -13.450
  521    HE2  HIS  69           2HE      HIS  69  16.708  10.582 -12.903
  522    H    THR  70           HN       THR  70  12.250   7.244 -11.670
  523    HA   THR  70           HA       THR  70  10.146   6.260  -9.879
  524    HB   THR  70           HB       THR  70   9.865   5.675 -12.259
  525    HG1  THR  70           1HG      THR  70   9.584   4.136 -10.225
  526   HG21  THR  70          3HG2      THR  70  12.219   5.532 -12.911
  527   HG22  THR  70          1HG2      THR  70  11.348   4.055 -13.323
  528   HG23  THR  70          2HG2      THR  70  12.410   4.089 -11.915
  529    H    VAL  71           HN       VAL  71  10.613   5.028  -8.197
  530    HA   VAL  71           HA       VAL  71  13.122   3.525  -8.083
  531    HB   VAL  71           HB       VAL  71  13.416   4.186  -5.661
  532   HG11  VAL  71          1HG1      VAL  71  14.904   5.086  -7.340
  533   HG12  VAL  71          2HG1      VAL  71  14.528   6.336  -6.152
  534   HG13  VAL  71          3HG1      VAL  71  13.744   6.354  -7.730
  535   HG21  VAL  71          3HG2      VAL  71  11.205   5.095  -5.252
  536   HG22  VAL  71          1HG2      VAL  71  11.495   6.379  -6.425
  537   HG23  VAL  71          2HG2      VAL  71  12.438   6.318  -4.937
  538    H    ASP  72           HN       ASP  72  13.027   1.958  -6.166
  539    HA   ASP  72           HA       ASP  72  10.635   0.456  -6.345
  540    HB2  ASP  72           2HB      ASP  72  12.973   0.238  -4.440
  541    HB3  ASP  72           1HB      ASP  72  11.644  -0.914  -4.481
  542    H    VAL  73           HN       VAL  73   9.120  -0.063  -4.703
  543    HA   VAL  73           HA       VAL  73   8.497   2.241  -3.027
  544    HB   VAL  73           HB       VAL  73   6.801  -0.176  -3.684
  545   HG11  VAL  73          1HG1      VAL  73   6.150   0.838  -1.567
  546   HG12  VAL  73          2HG1      VAL  73   4.934   1.153  -2.806
  547   HG13  VAL  73          3HG1      VAL  73   6.065   2.422  -2.340
  548   HG21  VAL  73          3HG2      VAL  73   6.760   2.619  -4.808
  549   HG22  VAL  73          1HG2      VAL  73   5.565   1.368  -5.144
  550   HG23  VAL  73          2HG2      VAL  73   7.239   1.149  -5.663
  551    H    GLU  74           HN       GLU  74   8.746   2.252  -0.904
  552    HA   GLU  74           HA       GLU  74   9.633  -0.168   0.437
  553    HB2  GLU  74           2HB      GLU  74  10.122   2.624   0.746
  554    HB3  GLU  74           1HB      GLU  74   9.410   2.026   2.239
  555    HG2  GLU  74           2HG      GLU  74  11.788   0.779   0.884
  556    HG3  GLU  74           1HG      GLU  74  11.895   1.969   2.178
  557    H    HIS  75           HN       HIS  75   8.670  -0.879   2.441
  558    HA   HIS  75           HA       HIS  75   5.848  -0.134   2.712
  559    HB2  HIS  75           2HB      HIS  75   5.324  -2.645   2.831
  560    HB3  HIS  75           1HB      HIS  75   5.592  -1.934   1.246
  561    HD1  HIS  75           1HD      HIS  75   7.791  -2.600   0.003
  562    HD2  HIS  75           2HD      HIS  75   7.177  -4.579   3.607
  563    HE1  HIS  75           1HE      HIS  75   9.384  -4.544  -0.014
  564    HE2  HIS  75           2HE      HIS  75   8.858  -5.834   2.090
  565    H    ARG  76           HN       ARG  76   4.875  -0.657   4.671
  566    HA   ARG  76           HA       ARG  76   6.695  -1.505   6.825
  567    HB2  ARG  76           2HB      ARG  76   6.473   1.013   6.652
  568    HB3  ARG  76           1HB      ARG  76   4.766   0.820   7.014
  569    HG2  ARG  76           2HG      ARG  76   5.814   1.424   9.029
  570    HG3  ARG  76           1HG      ARG  76   5.459  -0.301   9.158
  571    HD2  ARG  76           2HD      ARG  76   7.763  -0.831   8.585
  572    HD3  ARG  76           1HD      ARG  76   8.123   0.884   8.377
  573    HE   ARG  76           HE       ARG  76   7.217  -0.144  10.987
  574   HH11  ARG  76          1HH1      ARG  76   9.646   1.407   9.002
  575   HH12  ARG  76          2HH1      ARG  76  10.614   1.934  10.345
  576   HH21  ARG  76          1HH2      ARG  76   8.492   0.530  12.777
  577   HH22  ARG  76          2HH2      ARG  76   9.950   1.438  12.501
  578    H    GLY  77           HN       GLY  77   5.672  -2.583   8.558
  579    HA2  GLY  77           2HA      GLY  77   3.549  -3.009   9.743
  580    HA3  GLY  77           1HA      GLY  77   2.790  -3.129   8.162
  581    H    PHE  78           HN       PHE  78   3.167  -4.966   6.887
  582    HA   PHE  78           HA       PHE  78   3.454  -7.391   8.309
  583    HB2  PHE  78           2HB      PHE  78   3.582  -8.300   5.847
  584    HB3  PHE  78           1HB      PHE  78   2.082  -7.615   6.463
  585    HD1  PHE  78           2HD      PHE  78   5.111  -6.768   4.485
  586    HD2  PHE  78           1HD      PHE  78   1.060  -5.832   5.382
  587    HE1  PHE  78           2HE      PHE  78   5.084  -5.142   2.643
  588    HE2  PHE  78           1HE      PHE  78   1.027  -4.203   3.537
  589    HZ   PHE  78           HZ       PHE  78   3.040  -3.853   2.169
  590    HA   PRO  79           HA       PRO  79   7.845  -7.926   8.027
  591    HB2  PRO  79           2HB      PRO  79   8.027 -10.467   8.852
  592    HB3  PRO  79           1HB      PRO  79   7.491  -9.182   9.944
  593    HG2  PRO  79           2HG      PRO  79   5.887 -11.239   8.493
  594    HG3  PRO  79           1HG      PRO  79   5.674 -10.603  10.132
  595    HD2  PRO  79           2HD      PRO  79   4.235  -9.793   7.900
  596    HD3  PRO  79           1HD      PRO  79   4.396  -8.866   9.404
  597    H    GLY  80           HN       GLY  80   9.451  -9.622   7.175
  598    HA2  GLY  80           2HA      GLY  80   8.767 -10.078   4.384
  599    HA3  GLY  80           1HA      GLY  80  10.365 -10.199   5.104
  600    H    ASP  81           HN       ASP  81   8.384 -11.833   7.115
  601    HA   ASP  81           HA       ASP  81   9.233 -14.412   6.264
  602    HB2  ASP  81           2HB      ASP  81   8.868 -13.991   8.616
  603    HB3  ASP  81           1HB      ASP  81   7.191 -13.558   8.311
  604    H    LEU  82           HN       LEU  82   6.346 -12.508   5.901
  605    HA   LEU  82           HA       LEU  82   4.932 -14.614   4.498
  606    HB2  LEU  82           2HB      LEU  82   4.260 -11.708   4.991
  607    HB3  LEU  82           1HB      LEU  82   3.215 -12.828   4.138
  608    HG   LEU  82           HG       LEU  82   4.073 -13.114   7.017
  609   HD11  LEU  82          1HD1      LEU  82   1.453 -12.220   5.826
  610   HD12  LEU  82          2HD1      LEU  82   2.596 -11.209   6.712
  611   HD13  LEU  82          3HD1      LEU  82   1.756 -12.521   7.538
  612   HD21  LEU  82          3HD2      LEU  82   2.346 -14.858   7.091
  613   HD22  LEU  82          1HD2      LEU  82   3.640 -15.260   5.963
  614   HD23  LEU  82          2HD2      LEU  82   2.091 -14.672   5.355
  615    H    ALA  83           HN       ALA  83   4.131 -14.202   2.274
  616    HA   ALA  83           HA       ALA  83   6.254 -13.071   0.640
  617    HB1  ALA  83           1HB      ALA  83   5.108 -14.049  -1.232
  618    HB2  ALA  83           2HB      ALA  83   3.703 -14.407  -0.232
  619    HB3  ALA  83           3HB      ALA  83   5.228 -15.242   0.058
  620    H    VAL  84           HN       VAL  84   6.220 -10.969   0.229
  621    HA   VAL  84           HA       VAL  84   3.702  -9.515   0.464
  622    HB   VAL  84           HB       VAL  84   6.524  -8.474   0.201
  623   HG11  VAL  84          1HG1      VAL  84   3.961  -7.033   0.879
  624   HG12  VAL  84          2HG1      VAL  84   4.906  -6.857  -0.601
  625   HG13  VAL  84          3HG1      VAL  84   5.576  -6.327   0.942
  626   HG21  VAL  84          3HG2      VAL  84   4.779  -8.721   2.652
  627   HG22  VAL  84          1HG2      VAL  84   6.385  -7.996   2.592
  628   HG23  VAL  84          2HG2      VAL  84   6.185  -9.721   2.278
  629    H    THR  85           HN       THR  85   2.547  -9.337  -1.378
  630    HA   THR  85           HA       THR  85   4.049  -8.821  -3.858
  631    HB   THR  85           HB       THR  85   1.152  -9.504  -3.885
  632    HG1  THR  85           1HG      THR  85   1.791 -11.237  -2.726
  633   HG21  THR  85          3HG2      THR  85   2.245  -8.860  -5.959
  634   HG22  THR  85          1HG2      THR  85   1.787 -10.563  -6.018
  635   HG23  THR  85          2HG2      THR  85   3.465 -10.110  -5.718
  636    H    VAL  86           HN       VAL  86   4.041  -6.866  -4.492
  637    HA   VAL  86           HA       VAL  86   1.705  -5.117  -4.270
  638    HB   VAL  86           HB       VAL  86   4.036  -3.507  -4.218
  639   HG11  VAL  86          1HG1      VAL  86   1.877  -2.850  -3.307
  640   HG12  VAL  86          2HG1      VAL  86   3.130  -2.678  -2.076
  641   HG13  VAL  86          3HG1      VAL  86   2.027  -4.053  -2.025
  642   HG21  VAL  86          3HG2      VAL  86   5.348  -5.308  -3.323
  643   HG22  VAL  86          1HG2      VAL  86   4.153  -5.616  -2.059
  644   HG23  VAL  86          2HG2      VAL  86   5.079  -4.116  -2.055
  645    H    GLU  87           HN       GLU  87   1.410  -4.096  -6.412
  646    HA   GLU  87           HA       GLU  87   3.990  -4.048  -7.803
  647    HB2  GLU  87           2HB      GLU  87   3.181  -6.145  -8.485
  648    HB3  GLU  87           1HB      GLU  87   1.586  -5.507  -8.838
  649    HG2  GLU  87           2HG      GLU  87   2.625  -5.921 -10.908
  650    HG3  GLU  87           1HG      GLU  87   2.629  -4.174 -10.687
  651    HA   PRO  88           HA       PRO  88   4.365  -1.863 -10.278
  652    HB2  PRO  88           2HB      PRO  88   5.022   0.675  -9.447
  653    HB3  PRO  88           1HB      PRO  88   3.582   0.303 -10.388
  654    HG2  PRO  88           2HG      PRO  88   3.683   1.275  -7.706
  655    HG3  PRO  88           1HG      PRO  88   2.241   0.777  -8.605
  656    HD2  PRO  88           2HD      PRO  88   3.910  -0.803  -6.683
  657    HD3  PRO  88           1HD      PRO  88   2.154  -0.867  -6.975
  658    H    ARG  89           HN       ARG  89   6.555  -2.480 -10.066
  659    HA   ARG  89           HA       ARG  89   7.383  -2.833  -7.302
  660    HB2  ARG  89           2HB      ARG  89   8.840  -4.423  -7.962
  661    HB3  ARG  89           1HB      ARG  89   7.801  -4.449  -9.379
  662    HG2  ARG  89           2HG      ARG  89   9.419  -3.758 -10.700
  663    HG3  ARG  89           1HG      ARG  89   9.948  -2.507  -9.582
  664    HD2  ARG  89           2HD      ARG  89  11.259  -4.038  -8.342
  665    HD3  ARG  89           1HD      ARG  89  10.541  -5.422  -9.162
  666    HE   ARG  89           HE       ARG  89  11.788  -4.836 -11.125
  667   HH11  ARG  89          1HH1      ARG  89  12.664  -3.010  -8.237
  668   HH12  ARG  89          2HH1      ARG  89  14.264  -2.646  -8.812
  669   HH21  ARG  89          1HH2      ARG  89  13.896  -4.354 -11.861
  670   HH22  ARG  89          2HH2      ARG  89  14.959  -3.395 -10.874
  671    H    MET  90           HN       MET  90   8.030  -0.821  -9.974
  672    HA   MET  90           HA       MET  90   9.720   0.873  -8.280
  673    HB2  MET  90           2HB      MET  90  10.764  -0.414 -10.373
  674    HB3  MET  90           1HB      MET  90  10.025   0.910 -11.258
  675    HG2  MET  90           2HG      MET  90  11.319   2.519 -10.024
  676    HG3  MET  90           1HG      MET  90  11.983   1.245  -9.000
  677    HE1  MET  90           3HE      MET  90  15.154   2.181 -11.026
  678    HE2  MET  90           1HE      MET  90  14.511   1.779  -9.434
  679    HE3  MET  90           2HE      MET  90  13.943   3.220 -10.275
  680    H    ALA  91           HN       ALA  91   8.757   2.828  -7.989
  681    HA   ALA  91           HA       ALA  91   6.525   3.495  -9.806
  682    HB1  ALA  91           1HB      ALA  91   5.766   2.725  -7.595
  683    HB2  ALA  91           2HB      ALA  91   5.325   4.403  -7.910
  684    HB3  ALA  91           3HB      ALA  91   6.680   4.034  -6.844
  685    H    ARG  92           HN       ARG  92   5.975   5.815  -9.870
  686    HA   ARG  92           HA       ARG  92   8.442   7.414  -9.741
  687    HB2  ARG  92           2HB      ARG  92   7.595   8.442 -11.929
  688    HB3  ARG  92           1HB      ARG  92   8.299   6.832 -12.007
  689    HG2  ARG  92           2HG      ARG  92   6.069   5.849 -12.040
  690    HG3  ARG  92           1HG      ARG  92   5.353   7.457 -11.934
  691    HD2  ARG  92           2HD      ARG  92   6.119   8.047 -14.083
  692    HD3  ARG  92           1HD      ARG  92   7.221   6.672 -14.153
  693    HE   ARG  92           HE       ARG  92   4.869   5.432 -13.973
  694   HH11  ARG  92          1HH1      ARG  92   5.802   8.166 -15.953
  695   HH12  ARG  92          2HH1      ARG  92   4.799   7.688 -17.297
  696   HH21  ARG  92          1HH2      ARG  92   3.561   4.805 -15.730
  697   HH22  ARG  92          2HH2      ARG  92   3.534   5.785 -17.172
  698    H    VAL  93           HN       VAL  93   8.279   9.443  -9.074
  699    HA   VAL  93           HA       VAL  93   5.620  10.680  -8.856
  700    HB   VAL  93           HB       VAL  93   7.789  10.820  -6.741
  701   HG11  VAL  93          1HG1      VAL  93   6.549  12.914  -6.940
  702   HG12  VAL  93          2HG1      VAL  93   6.174  12.092  -5.428
  703   HG13  VAL  93          3HG1      VAL  93   5.029  12.037  -6.768
  704   HG21  VAL  93          3HG2      VAL  93   5.086   9.483  -6.667
  705   HG22  VAL  93          1HG2      VAL  93   6.188   9.638  -5.298
  706   HG23  VAL  93          2HG2      VAL  93   6.652   8.672  -6.700
  707    H    GLN  94           HN       GLN  94   5.566  12.833  -9.413
  708    HA   GLN  94           HA       GLN  94   8.090  13.923 -10.470
  709    HB2  GLN  94           2HB      GLN  94   6.326  13.617 -12.151
  710    HB3  GLN  94           1HB      GLN  94   5.245  14.633 -11.203
  711    HG2  GLN  94           2HG      GLN  94   6.835  16.506 -11.480
  712    HG3  GLN  94           1HG      GLN  94   7.809  15.484 -12.529
  713   HE21  GLN  94          1HE2      GLN  94   6.538  17.985 -13.102
  714   HE22  GLN  94          2HE2      GLN  94   5.477  17.698 -14.437
  715    H    LEU  95           HN       LEU  95   8.983  15.552  -9.426
  716    HA   LEU  95           HA       LEU  95   7.270  17.233  -7.727
  717    HB2  LEU  95           2HB      LEU  95  10.221  16.657  -7.484
  718    HB3  LEU  95           1HB      LEU  95   9.343  17.793  -6.481
  719    HG   LEU  95           HG       LEU  95   8.930  14.807  -6.583
  720   HD11  LEU  95          1HD1      LEU  95  10.051  16.628  -4.460
  721   HD12  LEU  95          2HD1      LEU  95  10.934  15.415  -5.391
  722   HD13  LEU  95          3HD1      LEU  95   9.693  14.914  -4.241
  723   HD21  LEU  95          3HD2      LEU  95   7.324  15.135  -4.783
  724   HD22  LEU  95          1HD2      LEU  95   6.812  15.976  -6.245
  725   HD23  LEU  95          2HD2      LEU  95   7.521  16.882  -4.909
  726    H    GLU  96           HN       GLU  96   7.062  19.295  -8.226
  727    HA   GLU  96           HA       GLU  96   8.987  20.499 -10.092
  728    HB2  GLU  96           2HB      GLU  96   6.875  19.844 -11.258
  729    HB3  GLU  96           1HB      GLU  96   6.001  20.942 -10.202
  730    HG2  GLU  96           2HG      GLU  96   6.477  21.905 -12.416
  731    HG3  GLU  96           1HG      GLU  96   7.190  22.833 -11.097
  732    H    GLU  97           HN       GLU  97   9.324  22.725  -9.857
  733    HA   GLU  97           HA       GLU  97   9.304  23.547  -7.138
  734    HB2  GLU  97           2HB      GLU  97  11.096  24.091  -8.773
  735    HB3  GLU  97           1HB      GLU  97   9.984  25.182  -9.586
  736    HG2  GLU  97           2HG      GLU  97   9.898  26.625  -7.693
  737    HG3  GLU  97           1HG      GLU  97  10.793  25.470  -6.706
  738    H    ARG  98           HN       ARG  98   7.012  23.390  -6.848
  739    HA   ARG  98           HA       ARG  98   4.951  24.213  -6.457
  740    HB2  ARG  98           2HB      ARG  98   6.463  25.289  -4.880
  741    HB3  ARG  98           1HB      ARG  98   6.513  26.679  -5.932
  742    HG2  ARG  98           2HG      ARG  98   4.119  27.007  -5.617
  743    HG3  ARG  98           1HG      ARG  98   4.066  25.586  -4.568
  744    HD2  ARG  98           2HD      ARG  98   4.159  27.526  -3.172
  745    HD3  ARG  98           1HD      ARG  98   5.724  26.718  -3.081
  746    HE   ARG  98           HE       ARG  98   5.160  29.179  -4.591
  747   HH11  ARG  98          1HH1      ARG  98   7.423  27.049  -2.952
  748   HH12  ARG  98          2HH1      ARG  98   8.775  28.113  -3.210
  749   HH21  ARG  98          1HH2      ARG  98   6.896  30.573  -4.874
  750   HH22  ARG  98          2HH2      ARG  98   8.484  30.125  -4.306
  751    H    GLN  99           HN       GLN  99   3.781  24.247  -8.044
  752    HA   GLN  99           HA       GLN  99   2.414  24.835  -9.736
  753    HB2  GLN  99           2HB      GLN  99   1.495  25.961  -7.832
  754    HB3  GLN  99           1HB      GLN  99   2.511  27.356  -8.133
  755    HG2  GLN  99           2HG      GLN  99   0.268  27.810  -8.851
  756    HG3  GLN  99           1HG      GLN  99   1.326  27.731 -10.255
  757   HE21  GLN  99          1HE2      GLN  99  -1.575  27.377 -10.024
  758   HE22  GLN  99          2HE2      GLN  99  -1.921  25.818 -10.687
  759    H    THR 100           HN       THR 100   4.327  27.811  -9.368
  760    HA   THR 100           HA       THR 100   5.546  29.022 -10.869
  761    HB   THR 100           HB       THR 100   4.671  27.138 -13.072
  762    HG1  THR 100           1HG      THR 100   5.808  25.776 -11.868
  763   HG21  THR 100          3HG2      THR 100   6.744  27.898 -14.171
  764   HG22  THR 100          1HG2      THR 100   7.034  29.015 -12.836
  765   HG23  THR 100          2HG2      THR 100   5.630  29.232 -13.880
  766    H    VAL 101           HN       VAL 101   2.314  28.560 -10.775
  767    HA   VAL 101           HA       VAL 101   1.802  30.863 -12.543
  768    HB   VAL 101           HB       VAL 101  -0.110  28.588 -11.959
  769   HG11  VAL 101          1HG1      VAL 101  -0.396  30.969 -13.788
  770   HG12  VAL 101          2HG1      VAL 101  -1.239  30.730 -12.259
  771   HG13  VAL 101          3HG1      VAL 101  -1.556  29.652 -13.616
  772   HG21  VAL 101          3HG2      VAL 101   1.702  27.908 -13.458
  773   HG22  VAL 101          1HG2      VAL 101   1.344  29.275 -14.512
  774   HG23  VAL 101          2HG2      VAL 101   0.157  27.986 -14.305
  775    H    SER 102           HN       SER 102   1.346  32.603 -11.339
  776    HA   SER 102           HA       SER 102   0.338  32.360  -8.656
  777    HB2  SER 102           2HB      SER 102   0.749  34.796 -10.405
  778    HB3  SER 102           1HB      SER 102   0.332  34.845  -8.691
  779    HG   SER 102           HG       SER 102   2.730  34.080  -9.938
  780    H    VAL 103           HN       VAL 103  -1.618  31.269  -8.948
  781    HA   VAL 103           HA       VAL 103  -3.701  32.645 -10.459
  782    HB   VAL 103           HB       VAL 103  -3.487  30.284 -10.938
  783   HG11  VAL 103          1HG1      VAL 103  -3.906  28.560  -9.254
  784   HG12  VAL 103          2HG1      VAL 103  -4.014  29.805  -8.009
  785   HG13  VAL 103          3HG1      VAL 103  -2.491  29.532  -8.853
  786   HG21  VAL 103          3HG2      VAL 103  -5.778  29.539 -10.515
  787   HG22  VAL 103          1HG2      VAL 103  -5.732  31.225 -11.029
  788   HG23  VAL 103          2HG2      VAL 103  -5.980  30.827  -9.328
  789    HA   PRO 104           HA       PRO 104  -5.327  34.212  -6.591
  790    HB2  PRO 104           2HB      PRO 104  -7.366  35.615  -7.651
  791    HB3  PRO 104           1HB      PRO 104  -5.690  36.165  -7.768
  792    HG2  PRO 104           2HG      PRO 104  -7.376  34.770  -9.813
  793    HG3  PRO 104           1HG      PRO 104  -6.258  36.131 -10.022
  794    HD2  PRO 104           2HD      PRO 104  -5.623  33.540 -10.618
  795    HD3  PRO 104           1HD      PRO 104  -4.423  34.760 -10.146
  796    H    VAL 105           HN       VAL 105  -6.974  33.607  -5.223
  797    HA   VAL 105           HA       VAL 105  -8.612  31.385  -6.096
  798    HB   VAL 105           HB       VAL 105  -9.317  31.203  -3.759
  799   HG11  VAL 105          1HG1      VAL 105  -7.249  30.112  -4.453
  800   HG12  VAL 105          2HG1      VAL 105  -7.144  30.657  -2.779
  801   HG13  VAL 105          3HG1      VAL 105  -6.336  31.569  -4.056
  802   HG21  VAL 105          3HG2      VAL 105  -8.399  32.674  -2.039
  803   HG22  VAL 105          1HG2      VAL 105  -9.364  33.589  -3.198
  804   HG23  VAL 105          2HG2      VAL 105  -7.602  33.644  -3.277
  805    H    THR 106           HN       THR 106 -10.897  31.301  -5.824
  806    HA   THR 106           HA       THR 106 -12.279  33.856  -5.594
  807    HB   THR 106           HB       THR 106 -11.916  33.645  -7.988
  808    HG1  THR 106           1HG      THR 106 -14.513  32.898  -8.167
  809   HG21  THR 106          3HG2      THR 106 -13.260  30.953  -7.764
  810   HG22  THR 106          1HG2      THR 106 -11.556  31.237  -8.117
  811   HG23  THR 106          2HG2      THR 106 -12.792  31.748  -9.265
  812    H    VAL 107           HN       VAL 107 -14.380  33.673  -4.843
  813    HA   VAL 107           HA       VAL 107 -15.215  30.946  -4.095
  814    HB   VAL 107           HB       VAL 107 -14.437  32.137  -2.109
  815   HG11  VAL 107          1HG1      VAL 107 -14.763  34.429  -2.839
  816   HG12  VAL 107          2HG1      VAL 107 -15.581  34.153  -1.301
  817   HG13  VAL 107          3HG1      VAL 107 -16.514  34.215  -2.796
  818   HG21  VAL 107          3HG2      VAL 107 -16.450  31.946  -0.722
  819   HG22  VAL 107          1HG2      VAL 107 -16.286  30.586  -1.832
  820   HG23  VAL 107          2HG2      VAL 107 -17.441  31.872  -2.177
  821    H    GLU 108           HN       GLU 108 -17.313  30.394  -4.476
  822    HA   GLU 108           HA       GLU 108 -18.981  32.375  -5.830
  823    HB2  GLU 108           2HB      GLU 108 -19.329  29.390  -5.468
  824    HB3  GLU 108           1HB      GLU 108 -20.465  30.428  -6.318
  825    HG2  GLU 108           2HG      GLU 108 -18.729  30.990  -7.948
  826    HG3  GLU 108           1HG      GLU 108 -17.597  29.939  -7.098
  827    H    MET 109           HN       MET 109 -19.515  33.649  -4.070
  828    HA   MET 109           HA       MET 109 -20.788  32.501  -1.747
  829    HB2  MET 109           2HB      MET 109 -19.424  34.527  -1.511
  830    HB3  MET 109           1HB      MET 109 -20.471  35.382  -2.635
  831    HG2  MET 109           2HG      MET 109 -22.336  35.145  -1.057
  832    HG3  MET 109           1HG      MET 109 -21.259  34.330   0.073
  833    HE1  MET 109           3HE      MET 109 -20.312  37.364  -2.256
  834    HE2  MET 109           1HE      MET 109 -20.738  38.732  -1.231
  835    HE3  MET 109           2HE      MET 109 -22.000  37.666  -1.850
  836    H    ILE 110           HN       ILE 110 -22.748  31.651  -2.046
  837    HA   ILE 110           HA       ILE 110 -24.570  33.063  -3.853
  838    HB   ILE 110           HB       ILE 110 -24.147  30.887  -4.701
  839   HG12  ILE 110          2HG1      ILE 110 -26.839  30.869  -3.313
  840   HG13  ILE 110          1HG1      ILE 110 -26.474  31.686  -4.831
  841   HG21  ILE 110          1HG2      ILE 110 -24.890  29.797  -1.991
  842   HG22  ILE 110          2HG2      ILE 110 -23.284  29.816  -2.715
  843   HG23  ILE 110          3HG2      ILE 110 -24.559  28.831  -3.429
  844   HD11  ILE 110          3HD1      ILE 110 -25.987  29.530  -5.862
  845   HD12  ILE 110          1HD1      ILE 110 -27.626  29.594  -5.214
  846   HD13  ILE 110          2HD1      ILE 110 -26.365  28.717  -4.342
  847    H    ASN 111           HN       ASN 111 -25.514  34.497  -2.476
  848    HA   ASN 111           HA       ASN 111 -27.245  33.302  -0.420
  849    HB2  ASN 111           2HB      ASN 111 -26.045  35.255   0.394
  850    HB3  ASN 111           1HB      ASN 111 -26.579  36.207  -0.986
  851   HD21  ASN 111          1HD2      ASN 111 -27.529  34.768   2.047
  852   HD22  ASN 111          2HD2      ASN 111 -29.032  35.627   2.210
  853    H    LEU 112           HN       LEU 112 -28.776  32.353  -1.669
  854    HA   LEU 112           HA       LEU 112 -30.046  34.007  -3.741
  855    HB2  LEU 112           2HB      LEU 112 -28.964  31.571  -4.060
  856    HB3  LEU 112           1HB      LEU 112 -30.575  31.088  -3.574
  857    HG   LEU 112           HG       LEU 112 -29.939  32.873  -5.925
  858   HD11  LEU 112          1HD1      LEU 112 -30.584  30.952  -7.286
  859   HD12  LEU 112          2HD1      LEU 112 -30.767  29.977  -5.826
  860   HD13  LEU 112          3HD1      LEU 112 -29.179  30.594  -6.285
  861   HD21  LEU 112          3HD2      LEU 112 -32.275  32.582  -6.526
  862   HD22  LEU 112          1HD2      LEU 112 -32.133  33.326  -4.936
  863   HD23  LEU 112          2HD2      LEU 112 -32.545  31.618  -5.076
  864    H    GLU 113           HN       GLU 113 -31.234  35.089  -2.077
  865    HA   GLU 113           HA       GLU 113 -33.515  33.501  -1.112
  866    HB2  GLU 113           2HB      GLU 113 -32.484  36.143  -0.055
  867    HB3  GLU 113           1HB      GLU 113 -33.812  35.205   0.616
  868    HG2  GLU 113           2HG      GLU 113 -32.188  33.357   1.043
  869    HG3  GLU 113           1HG      GLU 113 -30.898  34.454   0.554
  870    H    HIS 114           HN       HIS 114 -32.558  36.667  -2.348
  871    HA   HIS 114           HA       HIS 114 -33.401  37.984  -3.978
  872    HB2  HIS 114           2HB      HIS 114 -33.813  35.884  -5.223
  873    HB3  HIS 114           1HB      HIS 114 -35.417  35.797  -4.503
  874    HD1  HIS 114           1HD      HIS 114 -37.183  36.658  -5.992
  875    HD2  HIS 114           2HD      HIS 114 -33.538  38.534  -6.683
  876    HE1  HIS 114           1HE      HIS 114 -37.591  38.252  -7.896
  877    HE2  HIS 114           2HE      HIS 114 -35.392  39.441  -8.246
  878    H    HIS 115           HN       HIS 115 -35.618  36.647  -1.652
  879    HA   HIS 115           HA       HIS 115 -37.616  38.670  -1.979
  880    HB2  HIS 115           2HB      HIS 115 -38.007  36.393  -0.973
  881    HB3  HIS 115           1HB      HIS 115 -37.105  36.923   0.440
  882    HD1  HIS 115           1HD      HIS 115 -40.342  37.500  -1.381
  883    HD2  HIS 115           2HD      HIS 115 -38.527  38.500   2.226
  884    HE1  HIS 115           1HE      HIS 115 -42.163  38.486   0.045
  885    HE2  HIS 115           2HE      HIS 115 -41.093  38.852   2.293
  886    H    HIS 116           HN       HIS 116 -36.230  40.512  -2.022
  887    HA   HIS 116           HA       HIS 116 -35.793  41.750   0.520
  888    HB2  HIS 116           2HB      HIS 116 -33.800  40.285   0.383
  889    HB3  HIS 116           1HB      HIS 116 -33.378  41.017  -1.159
  890    HD1  HIS 116           1HD      HIS 116 -33.272  41.591   2.518
  891    HD2  HIS 116           2HD      HIS 116 -32.290  43.621  -0.978
  892    HE1  HIS 116           1HE      HIS 116 -31.789  43.503   3.231
  893    HE2  HIS 116           2HE      HIS 116 -31.278  44.767   1.106
  894    H    HIS 117           HN       HIS 117 -36.694  43.648   0.002
  895    HA   HIS 117           HA       HIS 117 -35.685  45.021  -2.401
  896    HB2  HIS 117           2HB      HIS 117 -38.492  45.084  -1.276
  897    HB3  HIS 117           1HB      HIS 117 -37.903  46.195  -2.507
  898    HD1  HIS 117           1HD      HIS 117 -39.907  43.359  -2.316
  899    HD2  HIS 117           2HD      HIS 117 -36.695  44.402  -4.746
  900    HE1  HIS 117           1HE      HIS 117 -40.104  41.911  -4.360
  901    HE2  HIS 117           2HE      HIS 117 -38.275  42.713  -5.905
  902    H    HIS 118           HN       HIS 118 -34.985  47.059  -2.133
  903    HA   HIS 118           HA       HIS 118 -35.405  48.290   0.509
  904    HB2  HIS 118           2HB      HIS 118 -33.193  49.198   0.480
  905    HB3  HIS 118           1HB      HIS 118 -33.040  47.489   0.102
  906    HD1  HIS 118           1HD      HIS 118 -32.673  46.960  -2.555
  907    HD2  HIS 118           2HD      HIS 118 -32.022  50.874  -1.307
  908    HE1  HIS 118           1HE      HIS 118 -31.306  48.034  -4.370
  909    HE2  HIS 118           2HE      HIS 118 -30.782  50.344  -3.514
  910    H    HIS 119           HN       HIS 119 -35.881  50.482   0.537
  911    HA   HIS 119           HA       HIS 119 -36.904  51.490  -1.978
  912    HB2  HIS 119           2HB      HIS 119 -37.971  53.225  -0.707
  913    HB3  HIS 119           1HB      HIS 119 -38.205  51.709   0.148
  914    HD1  HIS 119           1HD      HIS 119 -36.620  51.383   2.330
  915    HD2  HIS 119           2HD      HIS 119 -36.866  55.228   0.760
  916    HE1  HIS 119           1HE      HIS 119 -35.808  52.916   4.150
  917    HE2  HIS 119           2HE      HIS 119 -36.168  55.245   3.248
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1 -12.280 -29.315  -9.433
    2    H2   MET   1           H2       MET   1 -10.993 -30.240  -8.825
    3    H3   MET   1           H3       MET   1 -10.691 -28.989  -9.927
    4    HA   MET   1           HA       MET   1 -11.419 -27.351  -8.336
    5    HB2  MET   1           2HB      MET   1 -13.043 -28.781  -7.159
    6    HB3  MET   1           1HB      MET   1 -11.731 -29.749  -6.510
    7    HG2  MET   1           2HG      MET   1 -10.931 -27.869  -5.223
    8    HG3  MET   1           1HG      MET   1 -12.159 -26.827  -5.937
    9    HE1  MET   1           2HE      MET   1 -13.346 -27.199  -2.213
   10    HE2  MET   1           3HE      MET   1 -12.915 -26.069  -3.496
   11    HE3  MET   1           1HE      MET   1 -11.681 -27.115  -2.791
   12    HA   PRO   2           HA       PRO   2  -7.048 -27.473  -8.034
   13    HB2  PRO   2           2HB      PRO   2  -6.662 -25.084  -6.781
   14    HB3  PRO   2           1HB      PRO   2  -7.057 -25.241  -8.495
   15    HG2  PRO   2           2HG      PRO   2  -8.850 -24.597  -6.191
   16    HG3  PRO   2           1HG      PRO   2  -8.814 -23.888  -7.817
   17    HD2  PRO   2           2HD      PRO   2 -10.632 -25.750  -7.081
   18    HD3  PRO   2           1HD      PRO   2 -10.011 -25.630  -8.738
   19    H    THR   3           HN       THR   3  -5.938 -28.709  -6.684
   20    HA   THR   3           HA       THR   3  -6.339 -28.556  -3.821
   21    HB   THR   3           HB       THR   3  -4.348 -30.151  -3.796
   22    HG1  THR   3           1HG      THR   3  -3.606 -29.638  -5.932
   23   HG21  THR   3          3HG2      THR   3  -5.721 -32.068  -4.488
   24   HG22  THR   3          1HG2      THR   3  -6.851 -30.967  -5.280
   25   HG23  THR   3          2HG2      THR   3  -6.650 -30.917  -3.527
   26    H    PHE   4           HN       PHE   4  -5.610 -26.781  -2.906
   27    HA   PHE   4           HA       PHE   4  -3.445 -25.297  -4.071
   28    HB2  PHE   4           2HB      PHE   4  -4.036 -23.646  -2.265
   29    HB3  PHE   4           1HB      PHE   4  -5.325 -24.009  -3.397
   30    HD1  PHE   4           2HD      PHE   4  -4.100 -24.555   0.038
   31    HD2  PHE   4           1HD      PHE   4  -7.347 -25.010  -2.674
   32    HE1  PHE   4           2HE      PHE   4  -5.590 -25.098   1.917
   33    HE2  PHE   4           1HE      PHE   4  -8.843 -25.550  -0.797
   34    HZ   PHE   4           HZ       PHE   4  -7.966 -25.595   1.503
   35    H    ASP   5           HN       ASP   5  -2.120 -24.088  -2.200
   36    HA   ASP   5           HA       ASP   5  -1.129 -25.890  -0.197
   37    HB2  ASP   5           2HB      ASP   5   0.150 -26.546  -2.237
   38    HB3  ASP   5           1HB      ASP   5   0.718 -24.883  -2.375
   39    H    HIS   6           HN       HIS   6  -1.295 -24.595   1.411
   40    HA   HIS   6           HA       HIS   6  -0.997 -22.850   2.840
   41    HB2  HIS   6           2HB      HIS   6   0.658 -21.643   0.608
   42    HB3  HIS   6           1HB      HIS   6   0.439 -20.902   2.192
   43    HD1  HIS   6           1HD      HIS   6   2.806 -22.839   0.421
   44    HD2  HIS   6           2HD      HIS   6   1.305 -22.928   4.304
   45    HE1  HIS   6           1HE      HIS   6   4.511 -24.097   1.787
   46    HE2  HIS   6           2HE      HIS   6   3.523 -24.228   4.109
   47    H    GLY   7           HN       GLY   7  -1.273 -20.142   2.513
   48    HA2  GLY   7           2HA      GLY   7  -3.739 -19.943   0.905
   49    HA3  GLY   7           1HA      GLY   7  -3.681 -19.371   2.567
   50    H    ASN   8           HN       ASN   8  -4.472 -17.519   0.978
   51    HA   ASN   8           HA       ASN   8  -2.294 -15.648   1.103
   52    HB2  ASN   8           2HB      ASN   8  -2.958 -14.757  -1.241
   53    HB3  ASN   8           1HB      ASN   8  -1.846 -16.108  -1.113
   54   HD21  ASN   8          1HD2      ASN   8  -2.237 -16.904  -3.096
   55   HD22  ASN   8          2HD2      ASN   8  -3.731 -17.644  -3.552
   56    H    LEU   9           HN       LEU   9  -2.909 -13.527   1.200
   57    HA   LEU   9           HA       LEU   9  -5.774 -12.996   1.546
   58    HB2  LEU   9           2HB      LEU   9  -4.487 -13.493   3.709
   59    HB3  LEU   9           1HB      LEU   9  -3.616 -12.005   3.413
   60    HG   LEU   9           HG       LEU   9  -5.463 -11.828   5.070
   61   HD11  LEU   9          1HD1      LEU   9  -4.645  -9.835   3.967
   62   HD12  LEU   9          2HD1      LEU   9  -6.387  -9.732   4.225
   63   HD13  LEU   9          3HD1      LEU   9  -5.754 -10.108   2.622
   64   HD21  LEU   9          3HD2      LEU   9  -7.064 -13.329   4.068
   65   HD22  LEU   9          1HD2      LEU   9  -7.217 -12.267   2.665
   66   HD23  LEU   9          2HD2      LEU   9  -7.770 -11.723   4.251
   67    H    SER  10           HN       SER  10  -6.368 -11.172   0.526
   68    HA   SER  10           HA       SER  10  -4.253  -9.494  -0.597
   69    HB2  SER  10           2HB      SER  10  -6.130  -8.627  -2.058
   70    HB3  SER  10           1HB      SER  10  -5.751 -10.336  -2.266
   71    HG   SER  10           HG       SER  10  -7.740 -10.746  -1.761
   72    H    LEU  11           HN       LEU  11  -3.768  -7.696   0.460
   73    HA   LEU  11           HA       LEU  11  -5.436  -6.591   2.489
   74    HB2  LEU  11           2HB      LEU  11  -3.014  -5.452   1.092
   75    HB3  LEU  11           1HB      LEU  11  -3.799  -4.709   2.471
   76    HG   LEU  11           HG       LEU  11  -2.438  -7.405   2.468
   77   HD11  LEU  11          1HD1      LEU  11  -0.854  -5.581   2.312
   78   HD12  LEU  11          2HD1      LEU  11  -0.807  -6.291   3.929
   79   HD13  LEU  11          3HD1      LEU  11  -1.638  -4.756   3.661
   80   HD21  LEU  11          3HD2      LEU  11  -2.783  -7.360   4.886
   81   HD22  LEU  11          1HD2      LEU  11  -4.327  -7.326   4.028
   82   HD23  LEU  11          2HD2      LEU  11  -3.678  -5.845   4.738
   83    H    GLY  12           HN       GLY  12  -4.571  -5.604  -0.796
   84    HA2  GLY  12           2HA      GLY  12  -6.355  -4.797  -2.242
   85    HA3  GLY  12           1HA      GLY  12  -7.035  -3.984  -0.841
   86    H    GLU  13           HN       GLU  13  -7.021  -1.949  -1.683
   87    HA   GLU  13           HA       GLU  13  -4.694  -0.822  -2.937
   88    HB2  GLU  13           2HB      GLU  13  -7.121   0.655  -1.917
   89    HB3  GLU  13           1HB      GLU  13  -6.003   1.168  -3.173
   90    HG2  GLU  13           2HG      GLU  13  -7.817  -1.218  -3.402
   91    HG3  GLU  13           1HG      GLU  13  -8.219   0.391  -3.992
   92    H    LEU  14           HN       LEU  14  -2.960  -0.311  -1.709
   93    HA   LEU  14           HA       LEU  14  -3.472   0.992   0.875
   94    HB2  LEU  14           2HB      LEU  14  -0.956  -0.275  -0.209
   95    HB3  LEU  14           1HB      LEU  14  -1.022   0.632   1.290
   96    HG   LEU  14           HG       LEU  14  -2.398  -1.982   0.681
   97   HD11  LEU  14          1HD1      LEU  14  -1.026  -2.820   2.503
   98   HD12  LEU  14          2HD1      LEU  14  -0.317  -1.219   2.722
   99   HD13  LEU  14          3HD1      LEU  14  -0.021  -2.119   1.235
  100   HD21  LEU  14          3HD2      LEU  14  -3.289  -1.893   2.946
  101   HD22  LEU  14          1HD2      LEU  14  -3.899  -0.549   1.977
  102   HD23  LEU  14          2HD2      LEU  14  -2.615  -0.275   3.159
  103    H    GLU  15           HN       GLU  15  -2.473   2.939   1.403
  104    HA   GLU  15           HA       GLU  15  -2.373   4.777  -0.797
  105    HB2  GLU  15           2HB      GLU  15  -1.787   5.265   2.130
  106    HB3  GLU  15           1HB      GLU  15  -2.144   6.487   0.921
  107    HG2  GLU  15           2HG      GLU  15  -4.401   5.670   0.697
  108    HG3  GLU  15           1HG      GLU  15  -4.060   4.341   1.806
  109    H    LEU  16           HN       LEU  16  -0.594   5.446  -1.872
  110    HA   LEU  16           HA       LEU  16   2.046   4.807  -0.842
  111    HB2  LEU  16           2HB      LEU  16   1.637   4.526  -3.237
  112    HB3  LEU  16           1HB      LEU  16   1.210   6.222  -3.380
  113    HG   LEU  16           HG       LEU  16   3.569   6.753  -2.604
  114   HD11  LEU  16          1HD1      LEU  16   4.091   4.582  -1.633
  115   HD12  LEU  16          2HD1      LEU  16   5.244   5.011  -2.898
  116   HD13  LEU  16          3HD1      LEU  16   3.971   3.836  -3.227
  117   HD21  LEU  16          3HD2      LEU  16   4.538   6.411  -4.805
  118   HD22  LEU  16          1HD2      LEU  16   2.865   6.953  -4.933
  119   HD23  LEU  16          2HD2      LEU  16   3.264   5.256  -5.200
  120    H    THR  17           HN       THR  17   2.852   6.107   0.677
  121    HA   THR  17           HA       THR  17   2.361   8.990   0.494
  122    HB   THR  17           HB       THR  17   3.685   7.414   2.715
  123    HG1  THR  17           1HG      THR  17   1.032   7.853   2.074
  124   HG21  THR  17          3HG2      THR  17   3.317   9.419   4.064
  125   HG22  THR  17          1HG2      THR  17   2.624  10.244   2.669
  126   HG23  THR  17          2HG2      THR  17   4.325   9.783   2.664
  127    H    VAL  18           HN       VAL  18   3.884  10.282  -0.350
  128    HA   VAL  18           HA       VAL  18   6.576   9.170  -0.743
  129    HB   VAL  18           HB       VAL  18   5.245  11.488  -2.160
  130   HG11  VAL  18          1HG1      VAL  18   7.898  10.145  -2.682
  131   HG12  VAL  18          2HG1      VAL  18   7.655  11.777  -2.057
  132   HG13  VAL  18          3HG1      VAL  18   7.154  11.379  -3.698
  133   HG21  VAL  18          3HG2      VAL  18   4.225   9.362  -2.758
  134   HG22  VAL  18          1HG2      VAL  18   5.811   8.683  -3.119
  135   HG23  VAL  18          2HG2      VAL  18   5.167   9.995  -4.107
  136    H    LEU  19           HN       LEU  19   8.222   9.979   0.371
  137    HA   LEU  19           HA       LEU  19   7.766  12.284   2.088
  138    HB2  LEU  19           2HB      LEU  19  10.173  10.468   1.865
  139    HB3  LEU  19           1HB      LEU  19   9.919  11.688   3.099
  140    HG   LEU  19           HG       LEU  19   8.225   9.213   2.718
  141   HD11  LEU  19          1HD1      LEU  19  10.446   8.658   3.525
  142   HD12  LEU  19          2HD1      LEU  19   9.256   8.458   4.808
  143   HD13  LEU  19          3HD1      LEU  19  10.311   9.871   4.796
  144   HD21  LEU  19          3HD2      LEU  19   6.948  11.067   3.630
  145   HD22  LEU  19          1HD2      LEU  19   8.185  11.339   4.859
  146   HD23  LEU  19          2HD2      LEU  19   7.242   9.847   4.873
  147    H    TYR  20           HN       TYR  20   8.241  14.237   1.419
  148    HA   TYR  20           HA       TYR  20  10.647  14.731  -0.129
  149    HB2  TYR  20           2HB      TYR  20   9.513  15.998  -1.859
  150    HB3  TYR  20           1HB      TYR  20   8.854  14.368  -1.818
  151    HD1  TYR  20           2HD      TYR  20   6.605  14.015  -0.657
  152    HD2  TYR  20           1HD      TYR  20   8.113  17.876  -1.620
  153    HE1  TYR  20           2HE      TYR  20   4.338  14.946  -0.456
  154    HE2  TYR  20           1HE      TYR  20   5.850  18.816  -1.420
  155    HH   TYR  20           HH       TYR  20   3.511  18.068  -1.551
  156    H    ASP  21           HN       ASP  21  10.610  17.319  -0.555
  157    HA   ASP  21           HA       ASP  21   9.983  18.494   2.068
  158    HB2  ASP  21           2HB      ASP  21  12.389  18.444   0.822
  159    HB3  ASP  21           1HB      ASP  21  11.749  19.968   0.213
  160    H    GLU  22           HN       GLU  22   8.405  19.940   2.161
  161    HA   GLU  22           HA       GLU  22   6.966  20.575  -0.248
  162    HB2  GLU  22           2HB      GLU  22   5.329  21.612   1.336
  163    HB3  GLU  22           1HB      GLU  22   5.672  19.917   1.654
  164    HG2  GLU  22           2HG      GLU  22   7.284  20.659   3.409
  165    HG3  GLU  22           1HG      GLU  22   6.711  22.306   3.151
  166    H    GLU  23           HN       GLU  23   9.639  21.886   0.636
  167    HA   GLU  23           HA       GLU  23   9.189  24.650   0.834
  168    HB2  GLU  23           2HB      GLU  23  11.474  22.935  -0.046
  169    HB3  GLU  23           1HB      GLU  23  11.556  24.675  -0.290
  170    HG2  GLU  23           2HG      GLU  23  10.884  23.537   2.389
  171    HG3  GLU  23           1HG      GLU  23  12.554  23.650   1.844
  172    H    ARG  24           HN       ARG  24  10.285  22.846  -2.054
  173    HA   ARG  24           HA       ARG  24   9.168  25.027  -3.674
  174    HB2  ARG  24           2HB      ARG  24  11.461  23.157  -4.245
  175    HB3  ARG  24           1HB      ARG  24  10.809  24.301  -5.400
  176    HG2  ARG  24           2HG      ARG  24  12.100  24.992  -2.774
  177    HG3  ARG  24           1HG      ARG  24  12.849  25.126  -4.365
  178    HD2  ARG  24           2HD      ARG  24  12.155  27.300  -3.897
  179    HD3  ARG  24           1HD      ARG  24  10.879  26.671  -4.938
  180    HE   ARG  24           HE       ARG  24   9.838  26.136  -2.568
  181   HH11  ARG  24          1HH1      ARG  24  11.403  29.050  -3.716
  182   HH12  ARG  24          2HH1      ARG  24  10.609  30.078  -2.560
  183   HH21  ARG  24          1HH2      ARG  24   8.782  27.479  -1.070
  184   HH22  ARG  24          2HH2      ARG  24   9.126  29.186  -1.038
  185    H    TYR  25           HN       TYR  25   9.505  21.506  -3.484
  186    HA   TYR  25           HA       TYR  25   7.968  21.238  -5.959
  187    HB2  TYR  25           2HB      TYR  25   9.386  19.072  -4.402
  188    HB3  TYR  25           1HB      TYR  25   8.765  18.967  -6.048
  189    HD1  TYR  25           2HD      TYR  25   9.897  20.280  -7.860
  190    HD2  TYR  25           1HD      TYR  25  11.527  19.946  -3.947
  191    HE1  TYR  25           2HE      TYR  25  12.089  21.000  -8.718
  192    HE2  TYR  25           1HE      TYR  25  13.717  20.663  -4.786
  193    HH   TYR  25           HH       TYR  25  14.949  20.700  -6.898
  194    H    ASP  26           HN       ASP  26   6.048  20.171  -6.084
  195    HA   ASP  26           HA       ASP  26   5.034  18.847  -3.666
  196    HB2  ASP  26           2HB      ASP  26   4.032  21.141  -3.869
  197    HB3  ASP  26           1HB      ASP  26   3.317  20.637  -5.395
  198    H    ILE  27           HN       ILE  27   3.161  17.404  -4.186
  199    HA   ILE  27           HA       ILE  27   4.017  15.727  -6.364
  200    HB   ILE  27           HB       ILE  27   1.691  15.340  -4.470
  201   HG12  ILE  27          2HG1      ILE  27   4.499  14.209  -4.371
  202   HG13  ILE  27          1HG1      ILE  27   3.876  15.480  -3.322
  203   HG21  ILE  27          1HG2      ILE  27   1.459  14.036  -6.520
  204   HG22  ILE  27          2HG2      ILE  27   1.822  12.983  -5.150
  205   HG23  ILE  27          3HG2      ILE  27   3.088  13.394  -6.307
  206   HD11  ILE  27          3HD1      ILE  27   2.242  13.910  -2.407
  207   HD12  ILE  27          1HD1      ILE  27   3.895  13.336  -2.191
  208   HD13  ILE  27          2HD1      ILE  27   2.879  12.641  -3.454
  209    H    VAL  28           HN       VAL  28   3.466  16.368  -8.343
  210    HA   VAL  28           HA       VAL  28   0.816  17.437  -8.876
  211    HB   VAL  28           HB       VAL  28   3.087  16.873 -10.793
  212   HG11  VAL  28          1HG1      VAL  28   0.558  18.474 -11.177
  213   HG12  VAL  28          2HG1      VAL  28   0.923  16.913 -11.912
  214   HG13  VAL  28          3HG1      VAL  28   1.876  18.332 -12.341
  215   HG21  VAL  28          3HG2      VAL  28   2.218  19.460  -9.509
  216   HG22  VAL  28          1HG2      VAL  28   3.486  19.286 -10.724
  217   HG23  VAL  28          2HG2      VAL  28   3.684  18.553  -9.130
  218    H    GLU  29           HN       GLU  29   2.780  14.666  -9.907
  219    HA   GLU  29           HA       GLU  29   0.330  13.105 -10.197
  220    HB2  GLU  29           2HB      GLU  29   2.504  13.353 -12.282
  221    HB3  GLU  29           1HB      GLU  29   1.336  12.036 -12.265
  222    HG2  GLU  29           2HG      GLU  29  -0.487  13.600 -12.527
  223    HG3  GLU  29           1HG      GLU  29   0.636  14.957 -12.453
  224    H    GLN  30           HN       GLN  30   0.699  10.781 -10.028
  225    HA   GLN  30           HA       GLN  30   3.222   9.737  -9.233
  226    HB2  GLN  30           2HB      GLN  30   2.776   9.377  -6.856
  227    HB3  GLN  30           1HB      GLN  30   2.795  11.097  -7.221
  228    HG2  GLN  30           2HG      GLN  30   0.467  11.281  -7.024
  229    HG3  GLN  30           1HG      GLN  30   0.236   9.537  -7.118
  230   HE21  GLN  30          1HE2      GLN  30  -0.947   9.501  -5.216
  231   HE22  GLN  30          2HE2      GLN  30  -0.217   9.701  -3.662
  232    H    THR  31           HN       THR  31   2.771   7.580  -7.908
  233    HA   THR  31           HA       THR  31   0.552   6.189  -9.207
  234    HB   THR  31           HB       THR  31   2.660   4.986  -7.398
  235    HG1  THR  31           1HG      THR  31   3.195   6.189  -9.598
  236   HG21  THR  31          3HG2      THR  31   2.127   2.925  -8.616
  237   HG22  THR  31          1HG2      THR  31   0.930   3.795  -9.573
  238   HG23  THR  31          2HG2      THR  31   0.690   3.589  -7.840
  239    H    GLU  32           HN       GLU  32  -1.294   6.648  -8.122
  240    HA   GLU  32           HA       GLU  32  -1.423   7.723  -5.574
  241    HB2  GLU  32           2HB      GLU  32  -3.633   6.227  -6.983
  242    HB3  GLU  32           1HB      GLU  32  -3.821   7.446  -5.730
  243    HG2  GLU  32           2HG      GLU  32  -2.906   9.139  -7.214
  244    HG3  GLU  32           1HG      GLU  32  -2.662   7.920  -8.465
  245    H    THR  33           HN       THR  33  -2.195   4.386  -6.552
  246    HA   THR  33           HA       THR  33  -1.965   3.603  -3.723
  247    HB   THR  33           HB       THR  33  -3.830   1.907  -4.284
  248    HG1  THR  33           1HG      THR  33  -4.501   3.905  -6.206
  249   HG21  THR  33          3HG2      THR  33  -5.572   3.516  -3.663
  250   HG22  THR  33          1HG2      THR  33  -4.484   4.848  -4.054
  251   HG23  THR  33          2HG2      THR  33  -4.106   3.765  -2.713
  252    H    VAL  34           HN       VAL  34  -1.701   1.218  -3.460
  253    HA   VAL  34           HA       VAL  34  -0.201   0.052  -5.722
  254    HB   VAL  34           HB       VAL  34   0.401  -0.509  -2.822
  255   HG11  VAL  34          1HG1      VAL  34   2.540  -1.328  -3.692
  256   HG12  VAL  34          2HG1      VAL  34   1.961  -1.027  -5.331
  257   HG13  VAL  34          3HG1      VAL  34   1.152  -2.222  -4.315
  258   HG21  VAL  34          3HG2      VAL  34   0.808   1.874  -3.215
  259   HG22  VAL  34          1HG2      VAL  34   1.813   1.472  -4.610
  260   HG23  VAL  34          2HG2      VAL  34   2.323   0.998  -2.990
  261    H    GLN  35           HN       GLN  35  -0.457  -2.142  -6.079
  262    HA   GLN  35           HA       GLN  35  -2.717  -3.456  -4.812
  263    HB2  GLN  35           2HB      GLN  35  -2.414  -3.653  -7.245
  264    HB3  GLN  35           1HB      GLN  35  -0.817  -4.345  -7.000
  265    HG2  GLN  35           2HG      GLN  35  -2.092  -6.155  -5.647
  266    HG3  GLN  35           1HG      GLN  35  -3.497  -5.559  -6.530
  267   HE21  GLN  35          1HE2      GLN  35  -1.810  -4.892  -8.886
  268   HE22  GLN  35          2HE2      GLN  35  -1.492  -6.411  -9.656
  269    H    VAL  36           HN       VAL  36  -2.330  -4.448  -2.903
  270    HA   VAL  36           HA       VAL  36   0.260  -5.821  -2.581
  271    HB   VAL  36           HB       VAL  36  -1.379  -4.546  -0.386
  272   HG11  VAL  36          1HG1      VAL  36   0.580  -5.017   1.022
  273   HG12  VAL  36          2HG1      VAL  36   1.336  -5.864  -0.326
  274   HG13  VAL  36          3HG1      VAL  36  -0.145  -6.496   0.391
  275   HG21  VAL  36          3HG2      VAL  36  -0.384  -2.831  -1.748
  276   HG22  VAL  36          1HG2      VAL  36   1.173  -3.658  -1.727
  277   HG23  VAL  36          2HG2      VAL  36   0.529  -2.954  -0.246
  278    H    ASP  37           HN       ASP  37   0.160  -7.878  -2.412
  279    HA   ASP  37           HA       ASP  37  -2.185  -9.197  -1.226
  280    HB2  ASP  37           2HB      ASP  37  -2.431  -9.255  -3.684
  281    HB3  ASP  37           1HB      ASP  37  -0.834  -9.973  -3.827
  282    H    LEU  38           HN       LEU  38  -1.642 -10.981   0.037
  283    HA   LEU  38           HA       LEU  38   1.255 -11.552   0.219
  284    HB2  LEU  38           2HB      LEU  38  -0.729 -11.390   2.489
  285    HB3  LEU  38           1HB      LEU  38   0.971 -11.791   2.640
  286    HG   LEU  38           HG       LEU  38  -0.115  -9.128   1.717
  287   HD11  LEU  38          1HD1      LEU  38   1.160  -9.943   4.326
  288   HD12  LEU  38          2HD1      LEU  38  -0.538  -9.534   4.087
  289   HD13  LEU  38          3HD1      LEU  38   0.706  -8.303   3.871
  290   HD21  LEU  38          3HD2      LEU  38   2.035  -9.656   0.704
  291   HD22  LEU  38          1HD2      LEU  38   2.706 -10.031   2.293
  292   HD23  LEU  38          2HD2      LEU  38   2.209  -8.381   1.911
  293    H    GLU  39           HN       GLU  39   1.787 -13.658   0.041
  294    HA   GLU  39           HA       GLU  39  -0.334 -15.642   0.575
  295    HB2  GLU  39           2HB      GLU  39   1.991 -15.977  -1.332
  296    HB3  GLU  39           1HB      GLU  39   0.686 -17.126  -1.052
  297    HG2  GLU  39           2HG      GLU  39  -0.918 -15.587  -1.956
  298    HG3  GLU  39           1HG      GLU  39   0.334 -14.373  -2.146
  299    H    GLY  40           HN       GLY  40   0.513 -17.772   1.202
  300    HA2  GLY  40           2HA      GLY  40   2.678 -18.819   2.092
  301    HA3  GLY  40           1HA      GLY  40   2.734 -17.393   3.117
  302    HA   PRO  41           HA       PRO  41   0.767 -20.709   5.660
  303    HB2  PRO  41           2HB      PRO  41   1.502 -19.430   8.003
  304    HB3  PRO  41           1HB      PRO  41   2.432 -20.698   7.198
  305    HG2  PRO  41           2HG      PRO  41   2.785 -17.736   7.111
  306    HG3  PRO  41           1HG      PRO  41   4.012 -19.015   7.151
  307    HD2  PRO  41           2HD      PRO  41   3.406 -17.710   4.885
  308    HD3  PRO  41           1HD      PRO  41   3.833 -19.435   4.882
  309    H    ARG  42           HN       ARG  42  -1.321 -20.591   5.909
  310    HA   ARG  42           HA       ARG  42  -2.861 -18.278   5.795
  311    HB2  ARG  42           2HB      ARG  42  -4.721 -19.762   6.689
  312    HB3  ARG  42           1HB      ARG  42  -3.915 -20.308   5.223
  313    HG2  ARG  42           2HG      ARG  42  -2.716 -21.971   6.380
  314    HG3  ARG  42           1HG      ARG  42  -3.131 -21.282   7.949
  315    HD2  ARG  42           2HD      ARG  42  -5.195 -22.359   6.050
  316    HD3  ARG  42           1HD      ARG  42  -4.392 -23.367   7.252
  317    HE   ARG  42           HE       ARG  42  -5.654 -20.946   8.249
  318   HH11  ARG  42          1HH1      ARG  42  -5.923 -24.400   7.719
  319   HH12  ARG  42          2HH1      ARG  42  -7.154 -24.614   8.919
  320   HH21  ARG  42          1HH2      ARG  42  -7.261 -21.229   9.834
  321   HH22  ARG  42          2HH2      ARG  42  -7.917 -22.815  10.129
  322    H    GLY  43           HN       GLY  43  -1.541 -19.939   8.591
  323    HA2  GLY  43           2HA      GLY  43  -3.163 -18.755  10.567
  324    HA3  GLY  43           1HA      GLY  43  -1.555 -19.418  10.822
  325    H    VAL  44           HN       VAL  44   0.052 -17.814   9.374
  326    HA   VAL  44           HA       VAL  44   0.334 -15.538  10.995
  327    HB   VAL  44           HB       VAL  44   1.549 -16.014   8.267
  328   HG11  VAL  44          1HG1      VAL  44   1.739 -13.690   8.963
  329   HG12  VAL  44          2HG1      VAL  44   3.314 -14.483   9.028
  330   HG13  VAL  44          3HG1      VAL  44   2.410 -14.193  10.516
  331   HG21  VAL  44          3HG2      VAL  44   2.587 -16.711  11.011
  332   HG22  VAL  44          1HG2      VAL  44   3.482 -16.886   9.502
  333   HG23  VAL  44          2HG2      VAL  44   2.031 -17.849   9.782
  334    H    LEU  45           HN       LEU  45  -1.040 -15.987   7.778
  335    HA   LEU  45           HA       LEU  45  -1.549 -13.319   7.120
  336    HB2  LEU  45           2HB      LEU  45  -3.174 -15.777   6.459
  337    HB3  LEU  45           1HB      LEU  45  -3.341 -14.220   5.671
  338    HG   LEU  45           HG       LEU  45  -0.817 -15.868   5.626
  339   HD11  LEU  45          1HD1      LEU  45  -2.618 -17.047   4.492
  340   HD12  LEU  45          2HD1      LEU  45  -1.431 -16.441   3.339
  341   HD13  LEU  45          3HD1      LEU  45  -2.972 -15.605   3.535
  342   HD21  LEU  45          3HD2      LEU  45  -0.451 -13.485   5.292
  343   HD22  LEU  45          1HD2      LEU  45  -1.679 -13.463   4.026
  344   HD23  LEU  45          2HD2      LEU  45  -0.188 -14.376   3.793
  345    H    THR  46           HN       THR  46  -3.421 -15.633   8.986
  346    HA   THR  46           HA       THR  46  -5.674 -13.952   9.405
  347    HB   THR  46           HB       THR  46  -4.790 -16.277  11.132
  348    HG1  THR  46           1HG      THR  46  -4.916 -16.818   8.847
  349   HG21  THR  46          3HG2      THR  46  -6.627 -14.945  12.054
  350   HG22  THR  46          1HG2      THR  46  -7.195 -16.537  11.547
  351   HG23  THR  46          2HG2      THR  46  -7.520 -15.124  10.543
  352    H    VAL  47           HN       VAL  47  -2.678 -14.526  11.180
  353    HA   VAL  47           HA       VAL  47  -3.338 -13.405  13.632
  354    HB   VAL  47           HB       VAL  47  -0.664 -13.434  12.224
  355   HG11  VAL  47          1HG1      VAL  47  -1.277 -12.839  15.119
  356   HG12  VAL  47          2HG1      VAL  47  -0.672 -11.689  13.927
  357   HG13  VAL  47          3HG1      VAL  47   0.330 -13.046  14.429
  358   HG21  VAL  47          3HG2      VAL  47  -1.816 -15.207  14.376
  359   HG22  VAL  47          1HG2      VAL  47  -0.196 -15.329  13.693
  360   HG23  VAL  47          2HG2      VAL  47  -1.605 -15.641  12.681
  361    H    PHE  48           HN       PHE  48  -1.820 -11.728  10.830
  362    HA   PHE  48           HA       PHE  48  -1.845  -9.237  12.204
  363    HB2  PHE  48           2HB      PHE  48  -1.162  -8.186  10.121
  364    HB3  PHE  48           1HB      PHE  48  -0.211  -9.627  10.427
  365    HD1  PHE  48           2HD      PHE  48  -3.100  -8.369   8.446
  366    HD2  PHE  48           1HD      PHE  48   0.022 -11.242   8.781
  367    HE1  PHE  48           2HE      PHE  48  -3.574  -9.145   6.162
  368    HE2  PHE  48           1HE      PHE  48  -0.442 -12.011   6.493
  369    HZ   PHE  48           HZ       PHE  48  -2.241 -10.966   5.183
  370    H    ARG  49           HN       ARG  49  -4.167 -10.911  10.263
  371    HA   ARG  49           HA       ARG  49  -5.807  -8.682   9.654
  372    HB2  ARG  49           2HB      ARG  49  -6.013 -11.632   9.469
  373    HB3  ARG  49           1HB      ARG  49  -7.511 -10.736   9.496
  374    HG2  ARG  49           2HG      ARG  49  -6.451  -9.320   7.639
  375    HG3  ARG  49           1HG      ARG  49  -5.308 -10.655   7.494
  376    HD2  ARG  49           2HD      ARG  49  -7.203 -10.863   5.937
  377    HD3  ARG  49           1HD      ARG  49  -7.111 -12.202   7.082
  378    HE   ARG  49           HE       ARG  49  -9.102 -11.527   8.021
  379   HH11  ARG  49          1HH1      ARG  49  -7.939  -9.059   5.828
  380   HH12  ARG  49          2HH1      ARG  49  -9.382  -8.101   5.922
  381   HH21  ARG  49          1HH2      ARG  49 -11.002 -10.275   8.151
  382   HH22  ARG  49          2HH2      ARG  49 -11.123  -8.777   7.277
  383    H    PHE  50           HN       PHE  50  -5.336 -10.552  12.488
  384    HA   PHE  50           HA       PHE  50  -7.867  -9.883  13.700
  385    HB2  PHE  50           2HB      PHE  50  -5.460 -11.407  14.462
  386    HB3  PHE  50           1HB      PHE  50  -6.289 -10.606  15.786
  387    HD1  PHE  50           1HD      PHE  50  -8.686 -11.125  16.217
  388    HD2  PHE  50           2HD      PHE  50  -6.333 -13.360  13.467
  389    HE1  PHE  50           1HE      PHE  50 -10.330 -12.952  16.307
  390    HE2  PHE  50           2HE      PHE  50  -7.973 -15.193  13.549
  391    HZ   PHE  50           HZ       PHE  50  -9.975 -14.991  14.970
  392    H    ALA  51           HN       ALA  51  -4.966  -8.287  13.146
  393    HA   ALA  51           HA       ALA  51  -5.341  -6.462  15.409
  394    HB1  ALA  51           1HB      ALA  51  -3.077  -7.361  15.088
  395    HB2  ALA  51           2HB      ALA  51  -3.122  -5.609  14.891
  396    HB3  ALA  51           3HB      ALA  51  -3.029  -6.653  13.472
  397    H    ARG  52           HN       ARG  52  -4.767  -4.097  14.769
  398    HA   ARG  52           HA       ARG  52  -6.657  -3.322  12.741
  399    HB2  ARG  52           2HB      ARG  52  -4.898  -1.661  14.545
  400    HB3  ARG  52           1HB      ARG  52  -6.253  -1.083  13.605
  401    HG2  ARG  52           2HG      ARG  52  -7.757  -2.515  14.915
  402    HG3  ARG  52           1HG      ARG  52  -6.377  -3.019  15.893
  403    HD2  ARG  52           2HD      ARG  52  -6.020  -0.613  16.476
  404    HD3  ARG  52           1HD      ARG  52  -7.543  -0.248  15.662
  405    HE   ARG  52           HE       ARG  52  -7.511  -2.226  17.835
  406   HH11  ARG  52          1HH1      ARG  52  -8.545   0.891  16.592
  407   HH12  ARG  52          2HH1      ARG  52  -9.647   1.186  17.911
  408   HH21  ARG  52          1HH2      ARG  52  -8.950  -1.831  19.557
  409   HH22  ARG  52          2HH2      ARG  52  -9.856  -0.351  19.606
  410    HA   PRO  53           HA       PRO  53  -3.835  -2.517   9.485
  411    HB2  PRO  53           2HB      PRO  53  -4.617   0.285   9.190
  412    HB3  PRO  53           1HB      PRO  53  -4.824  -1.054   8.062
  413    HG2  PRO  53           2HG      PRO  53  -6.904   0.054   9.386
  414    HG3  PRO  53           1HG      PRO  53  -6.854  -1.661   8.946
  415    HD2  PRO  53           2HD      PRO  53  -6.371  -0.366  11.591
  416    HD3  PRO  53           1HD      PRO  53  -7.159  -1.914  11.218
  417    H    SER  54           HN       SER  54  -1.756  -2.328   9.796
  418    HA   SER  54           HA       SER  54  -0.632   0.110  10.939
  419    HB2  SER  54           2HB      SER  54   0.238  -2.762  11.172
  420    HB3  SER  54           1HB      SER  54   1.192  -1.403  11.700
  421    HG   SER  54           HG       SER  54  -0.918  -0.898  12.914
  422    H    TYR  55           HN       TYR  55  -1.277  -0.940   8.168
  423    HA   TYR  55           HA       TYR  55   1.358  -1.465   7.040
  424    HB2  TYR  55           2HB      TYR  55  -1.164  -1.452   5.412
  425    HB3  TYR  55           1HB      TYR  55   0.276  -2.452   5.233
  426    HD1  TYR  55           2HD      TYR  55   0.715  -4.174   7.145
  427    HD2  TYR  55           1HD      TYR  55  -3.048  -2.341   6.405
  428    HE1  TYR  55           2HE      TYR  55  -0.398  -5.974   8.395
  429    HE2  TYR  55           1HE      TYR  55  -4.177  -4.128   7.657
  430    HH   TYR  55           HH       TYR  55  -2.575  -6.231   9.689
  431    H    GLU  56           HN       GLU  56   2.440   0.376   6.692
  432    HA   GLU  56           HA       GLU  56   1.045   2.515   5.224
  433    HB2  GLU  56           2HB      GLU  56   1.936   3.120   7.501
  434    HB3  GLU  56           1HB      GLU  56   3.552   2.786   6.897
  435    HG2  GLU  56           2HG      GLU  56   3.226   4.532   5.180
  436    HG3  GLU  56           1HG      GLU  56   1.659   4.902   5.894
  437    H    VAL  57           HN       VAL  57   2.005   3.311   3.379
  438    HA   VAL  57           HA       VAL  57   4.394   1.864   2.434
  439    HB   VAL  57           HB       VAL  57   2.115   2.932   0.748
  440   HG11  VAL  57          1HG1      VAL  57   4.228   3.037  -0.422
  441   HG12  VAL  57          2HG1      VAL  57   3.219   1.759  -1.099
  442   HG13  VAL  57          3HG1      VAL  57   4.558   1.351  -0.026
  443   HG21  VAL  57          3HG2      VAL  57   2.847   0.086   1.428
  444   HG22  VAL  57          1HG2      VAL  57   1.596   0.586   0.286
  445   HG23  VAL  57          2HG2      VAL  57   1.427   0.965   2.001
  446    H    PHE  58           HN       PHE  58   6.105   3.143   1.993
  447    HA   PHE  58           HA       PHE  58   5.708   5.930   1.318
  448    HB2  PHE  58           2HB      PHE  58   7.071   6.758   3.207
  449    HB3  PHE  58           1HB      PHE  58   5.580   6.002   3.754
  450    HD1  PHE  58           1HD      PHE  58   5.643   3.770   4.823
  451    HD2  PHE  58           2HD      PHE  58   9.200   5.872   3.800
  452    HE1  PHE  58           1HE      PHE  58   6.935   2.301   6.315
  453    HE2  PHE  58           2HE      PHE  58  10.499   4.406   5.291
  454    HZ   PHE  58           HZ       PHE  58   9.367   2.619   6.551
  455    H    VAL  59           HN       VAL  59   7.488   6.920   0.430
  456    HA   VAL  59           HA       VAL  59  10.023   5.450   0.350
  457    HB   VAL  59           HB       VAL  59   8.887   6.758  -2.119
  458   HG11  VAL  59          1HG1      VAL  59  11.240   4.914  -1.741
  459   HG12  VAL  59          2HG1      VAL  59  11.315   6.657  -2.010
  460   HG13  VAL  59          3HG1      VAL  59  10.694   5.597  -3.275
  461   HG21  VAL  59          3HG2      VAL  59   7.494   4.839  -1.630
  462   HG22  VAL  59          1HG2      VAL  59   8.923   3.821  -1.449
  463   HG23  VAL  59          2HG2      VAL  59   8.523   4.501  -3.024
  464    H    ASP  60           HN       ASP  60  11.788   6.798   0.490
  465    HA   ASP  60           HA       ASP  60  11.188   9.628   0.934
  466    HB2  ASP  60           2HB      ASP  60  12.602   8.296   2.566
  467    HB3  ASP  60           1HB      ASP  60  13.853   8.256   1.328
  468    H    LEU  61           HN       LEU  61  11.401  11.009  -0.663
  469    HA   LEU  61           HA       LEU  61  13.437  10.488  -2.714
  470    HB2  LEU  61           2HB      LEU  61  10.547  11.234  -3.134
  471    HB3  LEU  61           1HB      LEU  61  11.766  11.379  -4.388
  472    HG   LEU  61           HG       LEU  61  11.080   8.789  -3.007
  473   HD11  LEU  61          1HD1      LEU  61   9.153   9.580  -4.249
  474   HD12  LEU  61          2HD1      LEU  61   9.896   8.206  -5.069
  475   HD13  LEU  61          3HD1      LEU  61  10.156   9.840  -5.676
  476   HD21  LEU  61          3HD2      LEU  61  12.693   9.408  -5.478
  477   HD22  LEU  61          1HD2      LEU  61  12.303   7.796  -4.882
  478   HD23  LEU  61          2HD2      LEU  61  13.325   8.862  -3.924
  479    H    THR  62           HN       THR  62  13.531  12.185  -0.434
  480    HA   THR  62           HA       THR  62  12.983  14.879  -1.090
  481    HB   THR  62           HB       THR  62  14.646  15.371   0.757
  482    HG1  THR  62           1HG      THR  62  14.589  12.565   1.232
  483   HG21  THR  62          3HG2      THR  62  12.253  15.145   1.196
  484   HG22  THR  62          1HG2      THR  62  13.201  14.475   2.523
  485   HG23  THR  62          2HG2      THR  62  12.439  13.397   1.354
  486    H    GLU  63           HN       GLU  63  15.539  12.726  -1.936
  487    HA   GLU  63           HA       GLU  63  17.478  14.691  -2.613
  488    HB2  GLU  63           2HB      GLU  63  17.230  11.821  -3.482
  489    HB3  GLU  63           1HB      GLU  63  18.661  12.827  -3.667
  490    HG2  GLU  63           2HG      GLU  63  17.393  12.116  -1.038
  491    HG3  GLU  63           1HG      GLU  63  18.771  11.295  -1.748
  492    H    ALA  64           HN       ALA  64  15.055  12.914  -4.421
  493    HA   ALA  64           HA       ALA  64  15.893  14.258  -6.890
  494    HB1  ALA  64           1HB      ALA  64  14.075  11.879  -6.517
  495    HB2  ALA  64           2HB      ALA  64  15.768  11.824  -7.005
  496    HB3  ALA  64           3HB      ALA  64  14.568  12.567  -8.063
  497    H    GLY  65           HN       GLY  65  14.840  16.046  -7.395
  498    HA2  GLY  65           2HA      GLY  65  12.210  16.519  -6.225
  499    HA3  GLY  65           1HA      GLY  65  13.270  17.729  -6.911
  500    H    GLU  66           HN       GLU  66  13.391  17.938  -9.167
  501    HA   GLU  66           HA       GLU  66  10.772  17.974 -10.233
  502    HB2  GLU  66           2HB      GLU  66  11.691  19.162 -12.093
  503    HB3  GLU  66           1HB      GLU  66  12.480  19.739 -10.636
  504    HG2  GLU  66           2HG      GLU  66  13.688  17.677 -12.459
  505    HG3  GLU  66           1HG      GLU  66  13.958  19.408 -12.639
  506    H    GLY  67           HN       GLY  67  10.226  17.309 -12.444
  507    HA2  GLY  67           2HA      GLY  67  10.012  15.759 -14.117
  508    HA3  GLY  67           1HA      GLY  67  11.601  15.139 -13.684
  509    H    SER  68           HN       SER  68   9.619  13.420 -14.433
  510    HA   SER  68           HA       SER  68   8.571  12.225 -12.021
  511    HB2  SER  68           2HB      SER  68   7.296  12.017 -14.093
  512    HB3  SER  68           1HB      SER  68   8.642  11.176 -14.850
  513    HG   SER  68           HG       SER  68   7.381   9.566 -14.157
  514    H    HIS  69           HN       HIS  69   9.421  10.612 -10.940
  515    HA   HIS  69           HA       HIS  69  11.867   9.360 -11.948
  516    HB2  HIS  69           2HB      HIS  69  12.546   9.443  -9.353
  517    HB3  HIS  69           1HB      HIS  69  13.035  10.667 -10.514
  518    HD1  HIS  69           1HD      HIS  69  10.743  10.119  -7.587
  519    HD2  HIS  69           2HD      HIS  69  11.926  13.189 -10.127
  520    HE1  HIS  69           1HE      HIS  69   9.932  12.240  -6.509
  521    HE2  HIS  69           2HE      HIS  69  10.829  14.091  -7.968
  522    H    THR  70           HN       THR  70  11.987   7.276 -11.715
  523    HA   THR  70           HA       THR  70   9.732   5.948 -10.384
  524    HB   THR  70           HB       THR  70  11.554   4.745 -12.472
  525    HG1  THR  70           1HG      THR  70  10.640   6.585 -13.426
  526   HG21  THR  70          3HG2      THR  70   9.603   3.322 -12.915
  527   HG22  THR  70          1HG2      THR  70   8.712   4.154 -11.640
  528   HG23  THR  70          2HG2      THR  70  10.131   3.192 -11.239
  529    H    VAL  71           HN       VAL  71  10.156   4.854  -8.555
  530    HA   VAL  71           HA       VAL  71  12.847   3.743  -8.135
  531    HB   VAL  71           HB       VAL  71  12.832   4.530  -5.787
  532   HG11  VAL  71          1HG1      VAL  71  14.091   5.760  -7.494
  533   HG12  VAL  71          2HG1      VAL  71  13.469   6.840  -6.247
  534   HG13  VAL  71          3HG1      VAL  71  12.672   6.756  -7.817
  535   HG21  VAL  71          3HG2      VAL  71  11.303   6.304  -5.103
  536   HG22  VAL  71          1HG2      VAL  71  10.417   4.846  -5.544
  537   HG23  VAL  71          2HG2      VAL  71  10.482   6.210  -6.661
  538    H    ASP  72           HN       ASP  72  12.915   2.305  -6.190
  539    HA   ASP  72           HA       ASP  72  10.861   0.350  -6.274
  540    HB2  ASP  72           2HB      ASP  72  13.047   0.726  -4.211
  541    HB3  ASP  72           1HB      ASP  72  12.057  -0.714  -4.404
  542    H    VAL  73           HN       VAL  73   9.299  -0.172  -4.761
  543    HA   VAL  73           HA       VAL  73   8.566   2.023  -2.945
  544    HB   VAL  73           HB       VAL  73   6.833  -0.186  -4.072
  545   HG11  VAL  73          1HG1      VAL  73   4.959   1.101  -3.148
  546   HG12  VAL  73          2HG1      VAL  73   6.106   2.223  -2.411
  547   HG13  VAL  73          3HG1      VAL  73   6.058   0.538  -1.886
  548   HG21  VAL  73          3HG2      VAL  73   7.514   1.410  -5.776
  549   HG22  VAL  73          1HG2      VAL  73   6.976   2.746  -4.757
  550   HG23  VAL  73          2HG2      VAL  73   5.801   1.595  -5.398
  551    H    GLU  74           HN       GLU  74   8.995   1.700  -0.858
  552    HA   GLU  74           HA       GLU  74   9.010  -1.053   0.159
  553    HB2  GLU  74           2HB      GLU  74  10.477  -0.336   1.925
  554    HB3  GLU  74           1HB      GLU  74  11.146   0.166   0.382
  555    HG2  GLU  74           2HG      GLU  74  10.533   2.427   0.761
  556    HG3  GLU  74           1HG      GLU  74   9.577   1.990   2.179
  557    H    HIS  75           HN       HIS  75   8.190  -1.378   2.364
  558    HA   HIS  75           HA       HIS  75   5.994   0.445   3.030
  559    HB2  HIS  75           2HB      HIS  75   4.415  -1.498   3.135
  560    HB3  HIS  75           1HB      HIS  75   4.964  -1.119   1.505
  561    HD1  HIS  75           1HD      HIS  75   6.082  -2.964   0.217
  562    HD2  HIS  75           2HD      HIS  75   5.698  -3.858   4.261
  563    HE1  HIS  75           1HE      HIS  75   6.799  -5.360   0.450
  564    HE2  HIS  75           2HE      HIS  75   6.691  -5.837   2.923
  565    H    ARG  76           HN       ARG  76   4.962  -0.085   5.101
  566    HA   ARG  76           HA       ARG  76   6.678  -1.689   6.888
  567    HB2  ARG  76           2HB      ARG  76   6.938   0.786   7.248
  568    HB3  ARG  76           1HB      ARG  76   5.228   0.860   7.642
  569    HG2  ARG  76           2HG      ARG  76   5.656  -0.740   9.500
  570    HG3  ARG  76           1HG      ARG  76   7.378  -0.598   9.157
  571    HD2  ARG  76           2HD      ARG  76   7.235   1.826   9.565
  572    HD3  ARG  76           1HD      ARG  76   5.526   1.640   9.960
  573    HE   ARG  76           HE       ARG  76   7.672   0.311  11.493
  574   HH11  ARG  76          1HH1      ARG  76   4.711   2.195  11.343
  575   HH12  ARG  76          2HH1      ARG  76   4.484   2.190  13.070
  576   HH21  ARG  76          1HH2      ARG  76   7.387   0.342  13.760
  577   HH22  ARG  76          2HH2      ARG  76   6.012   1.165  14.444
  578    H    GLY  77           HN       GLY  77   5.515  -2.613   8.735
  579    HA2  GLY  77           2HA      GLY  77   3.232  -2.725   9.794
  580    HA3  GLY  77           1HA      GLY  77   2.641  -2.974   8.157
  581    H    PHE  78           HN       PHE  78   3.184  -4.919   7.071
  582    HA   PHE  78           HA       PHE  78   3.513  -7.171   8.868
  583    HB2  PHE  78           2HB      PHE  78   3.039  -8.509   6.779
  584    HB3  PHE  78           1HB      PHE  78   1.755  -7.405   7.256
  585    HD1  PHE  78           1HD      PHE  78   1.313  -5.378   5.969
  586    HD2  PHE  78           2HD      PHE  78   4.258  -8.190   4.746
  587    HE1  PHE  78           1HE      PHE  78   1.336  -4.368   3.728
  588    HE2  PHE  78           2HE      PHE  78   4.287  -7.186   2.503
  589    HZ   PHE  78           HZ       PHE  78   2.825  -5.273   1.991
  590    HA   PRO  79           HA       PRO  79   7.803  -7.642   7.962
  591    HB2  PRO  79           2HB      PRO  79   7.625 -10.459   8.666
  592    HB3  PRO  79           1HB      PRO  79   8.366  -9.135   9.566
  593    HG2  PRO  79           2HG      PRO  79   6.110 -10.402  10.392
  594    HG3  PRO  79           1HG      PRO  79   6.455  -8.702  10.758
  595    HD2  PRO  79           2HD      PRO  79   4.669  -9.859   8.649
  596    HD3  PRO  79           1HD      PRO  79   4.396  -8.463   9.713
  597    H    GLY  80           HN       GLY  80   9.295  -8.751   6.602
  598    HA2  GLY  80           2HA      GLY  80   8.093  -9.698   4.139
  599    HA3  GLY  80           1HA      GLY  80   9.800  -9.397   4.426
  600    H    ASP  81           HN       ASP  81   7.557 -11.463   6.196
  601    HA   ASP  81           HA       ASP  81   9.361 -13.728   5.862
  602    HB2  ASP  81           2HB      ASP  81   8.412 -13.201   8.100
  603    HB3  ASP  81           1HB      ASP  81   6.805 -13.503   7.458
  604    H    LEU  82           HN       LEU  82   6.141 -12.658   5.090
  605    HA   LEU  82           HA       LEU  82   5.343 -15.139   3.860
  606    HB2  LEU  82           2HB      LEU  82   4.012 -12.431   3.792
  607    HB3  LEU  82           1HB      LEU  82   3.272 -13.962   3.365
  608    HG   LEU  82           HG       LEU  82   4.255 -13.271   6.134
  609   HD11  LEU  82          1HD1      LEU  82   1.450 -13.249   5.028
  610   HD12  LEU  82          2HD1      LEU  82   2.393 -11.831   5.485
  611   HD13  LEU  82          3HD1      LEU  82   1.904 -12.997   6.715
  612   HD21  LEU  82          3HD2      LEU  82   2.962 -15.230   6.803
  613   HD22  LEU  82          1HD2      LEU  82   4.222 -15.662   5.650
  614   HD23  LEU  82          2HD2      LEU  82   2.544 -15.540   5.119
  615    H    ALA  83           HN       ALA  83   4.275 -14.890   1.583
  616    HA   ALA  83           HA       ALA  83   6.242 -13.793  -0.241
  617    HB1  ALA  83           1HB      ALA  83   3.584 -15.130  -0.793
  618    HB2  ALA  83           2HB      ALA  83   5.162 -15.921  -0.793
  619    HB3  ALA  83           3HB      ALA  83   4.788 -14.698  -2.008
  620    H    VAL  84           HN       VAL  84   6.247 -11.639  -0.372
  621    HA   VAL  84           HA       VAL  84   3.745 -10.181  -0.009
  622    HB   VAL  84           HB       VAL  84   6.590  -9.160  -0.072
  623   HG11  VAL  84          1HG1      VAL  84   4.032  -7.755   0.690
  624   HG12  VAL  84          2HG1      VAL  84   4.993  -7.455  -0.758
  625   HG13  VAL  84          3HG1      VAL  84   5.660  -7.091   0.834
  626   HG21  VAL  84          3HG2      VAL  84   6.182 -10.598   1.849
  627   HG22  VAL  84          1HG2      VAL  84   4.752  -9.657   2.267
  628   HG23  VAL  84          2HG2      VAL  84   6.350  -8.918   2.349
  629    H    THR  85           HN       THR  85   2.643  -9.724  -1.802
  630    HA   THR  85           HA       THR  85   4.148  -8.998  -4.206
  631    HB   THR  85           HB       THR  85   1.190  -9.449  -4.000
  632    HG1  THR  85           1HG      THR  85   1.879 -11.470  -3.704
  633   HG21  THR  85          3HG2      THR  85   1.318  -9.707  -6.434
  634   HG22  THR  85          1HG2      THR  85   3.046  -9.364  -6.372
  635   HG23  THR  85          2HG2      THR  85   1.882  -8.117  -5.921
  636    H    VAL  86           HN       VAL  86   4.344  -7.046  -4.716
  637    HA   VAL  86           HA       VAL  86   2.405  -4.969  -3.952
  638    HB   VAL  86           HB       VAL  86   4.899  -3.755  -4.444
  639   HG11  VAL  86          1HG1      VAL  86   4.722  -2.969  -2.118
  640   HG12  VAL  86          2HG1      VAL  86   3.498  -4.198  -1.794
  641   HG13  VAL  86          3HG1      VAL  86   3.163  -2.903  -2.942
  642   HG21  VAL  86          3HG2      VAL  86   6.326  -4.705  -2.631
  643   HG22  VAL  86          1HG2      VAL  86   6.115  -5.748  -4.041
  644   HG23  VAL  86          2HG2      VAL  86   5.220  -6.080  -2.553
  645    H    GLU  87           HN       GLU  87   1.669  -3.955  -5.965
  646    HA   GLU  87           HA       GLU  87   3.892  -3.899  -7.834
  647    HB2  GLU  87           2HB      GLU  87   2.741  -5.953  -8.389
  648    HB3  GLU  87           1HB      GLU  87   1.242  -5.069  -8.639
  649    HG2  GLU  87           2HG      GLU  87   2.252  -3.863 -10.496
  650    HG3  GLU  87           1HG      GLU  87   3.768  -4.723 -10.242
  651    HA   PRO  88           HA       PRO  88   3.743  -1.471 -10.191
  652    HB2  PRO  88           2HB      PRO  88   4.964   0.803  -9.171
  653    HB3  PRO  88           1HB      PRO  88   3.334   0.766  -9.832
  654    HG2  PRO  88           2HG      PRO  88   4.064   1.286  -7.138
  655    HG3  PRO  88           1HG      PRO  88   2.421   1.033  -7.758
  656    HD2  PRO  88           2HD      PRO  88   4.289  -0.928  -6.468
  657    HD3  PRO  88           1HD      PRO  88   2.516  -0.812  -6.349
  658    H    ARG  89           HN       ARG  89   5.812  -2.311 -10.687
  659    HA   ARG  89           HA       ARG  89   7.228  -3.503  -8.495
  660    HB2  ARG  89           2HB      ARG  89   7.636  -3.308 -11.450
  661    HB3  ARG  89           1HB      ARG  89   9.052  -3.673 -10.472
  662    HG2  ARG  89           2HG      ARG  89   6.480  -5.216 -10.344
  663    HG3  ARG  89           1HG      ARG  89   7.859  -5.650 -11.353
  664    HD2  ARG  89           2HD      ARG  89   9.260  -5.668  -9.274
  665    HD3  ARG  89           1HD      ARG  89   7.777  -5.456  -8.346
  666    HE   ARG  89           HE       ARG  89   7.409  -7.681  -9.972
  667   HH11  ARG  89          1HH1      ARG  89   9.522  -6.706  -7.354
  668   HH12  ARG  89          2HH1      ARG  89   9.757  -8.324  -6.765
  669   HH21  ARG  89          1HH2      ARG  89   7.705  -9.801  -9.206
  670   HH22  ARG  89          2HH2      ARG  89   8.711 -10.086  -7.813
  671    H    MET  90           HN       MET  90   8.090  -0.948 -10.774
  672    HA   MET  90           HA       MET  90   9.186   0.514  -8.475
  673    HB2  MET  90           2HB      MET  90  10.030   0.661 -11.381
  674    HB3  MET  90           1HB      MET  90  10.479   1.859 -10.176
  675    HG2  MET  90           2HG      MET  90  11.629   0.132  -8.888
  676    HG3  MET  90           1HG      MET  90  11.202  -1.056 -10.120
  677    HE1  MET  90           3HE      MET  90  13.870  -1.591 -10.067
  678    HE2  MET  90           1HE      MET  90  14.187  -0.234  -8.987
  679    HE3  MET  90           2HE      MET  90  15.098  -0.398 -10.486
  680    H    ALA  91           HN       ALA  91   8.492   2.712  -8.344
  681    HA   ALA  91           HA       ALA  91   6.058   3.172  -9.949
  682    HB1  ALA  91           1HB      ALA  91   5.079   4.274  -7.996
  683    HB2  ALA  91           2HB      ALA  91   6.531   3.906  -7.062
  684    HB3  ALA  91           3HB      ALA  91   5.503   2.598  -7.647
  685    H    ARG  92           HN       ARG  92   5.645   5.209 -10.676
  686    HA   ARG  92           HA       ARG  92   7.950   7.011 -10.526
  687    HB2  ARG  92           2HB      ARG  92   7.413   7.847 -12.670
  688    HB3  ARG  92           1HB      ARG  92   7.280   6.104 -12.794
  689    HG2  ARG  92           2HG      ARG  92   4.906   7.891 -12.355
  690    HG3  ARG  92           1HG      ARG  92   5.505   7.469 -13.959
  691    HD2  ARG  92           2HD      ARG  92   4.643   5.473 -11.868
  692    HD3  ARG  92           1HD      ARG  92   3.616   6.053 -13.179
  693    HE   ARG  92           HE       ARG  92   6.174   4.767 -13.846
  694   HH11  ARG  92          1HH1      ARG  92   2.667   4.756 -13.882
  695   HH12  ARG  92          2HH1      ARG  92   2.552   3.383 -14.944
  696   HH21  ARG  92          1HH2      ARG  92   6.021   2.951 -15.260
  697   HH22  ARG  92          2HH2      ARG  92   4.449   2.343 -15.702
  698    H    VAL  93           HN       VAL  93   7.745   8.977  -9.771
  699    HA   VAL  93           HA       VAL  93   5.086  10.142  -9.431
  700    HB   VAL  93           HB       VAL  93   5.581   9.235  -7.246
  701   HG11  VAL  93          1HG1      VAL  93   7.981   8.956  -7.462
  702   HG12  VAL  93          2HG1      VAL  93   7.602   9.866  -5.997
  703   HG13  VAL  93          3HG1      VAL  93   8.206  10.705  -7.427
  704   HG21  VAL  93          3HG2      VAL  93   6.118  12.203  -7.288
  705   HG22  VAL  93          1HG2      VAL  93   5.616  11.275  -5.875
  706   HG23  VAL  93          2HG2      VAL  93   4.533  11.431  -7.258
  707    H    GLN  94           HN       GLN  94   5.012  12.305  -9.820
  708    HA   GLN  94           HA       GLN  94   7.550  13.528 -10.656
  709    HB2  GLN  94           2HB      GLN  94   6.033  13.364 -12.515
  710    HB3  GLN  94           1HB      GLN  94   4.719  14.059 -11.569
  711    HG2  GLN  94           2HG      GLN  94   5.882  16.172 -11.456
  712    HG3  GLN  94           1HG      GLN  94   7.249  15.498 -12.333
  713   HE21  GLN  94          1HE2      GLN  94   5.646  17.763 -12.994
  714   HE22  GLN  94          2HE2      GLN  94   4.957  17.441 -14.541
  715    H    LEU  95           HN       LEU  95   8.327  14.999  -9.357
  716    HA   LEU  95           HA       LEU  95   6.462  16.618  -7.759
  717    HB2  LEU  95           2HB      LEU  95   9.441  16.225  -7.405
  718    HB3  LEU  95           1HB      LEU  95   8.403  17.179  -6.363
  719    HG   LEU  95           HG       LEU  95   8.221  14.185  -6.731
  720   HD11  LEU  95          1HD1      LEU  95   9.294  15.827  -4.441
  721   HD12  LEU  95          2HD1      LEU  95  10.244  14.832  -5.542
  722   HD13  LEU  95          3HD1      LEU  95   9.089  14.077  -4.445
  723   HD21  LEU  95          3HD2      LEU  95   6.063  15.197  -6.226
  724   HD22  LEU  95          1HD2      LEU  95   6.773  16.048  -4.853
  725   HD23  LEU  95          2HD2      LEU  95   6.669  14.288  -4.842
  726    H    GLU  96           HN       GLU  96   6.186  18.666  -8.384
  727    HA   GLU  96           HA       GLU  96   8.158  19.791 -10.257
  728    HB2  GLU  96           2HB      GLU  96   5.996  19.202 -11.331
  729    HB3  GLU  96           1HB      GLU  96   5.177  20.288 -10.219
  730    HG2  GLU  96           2HG      GLU  96   5.476  21.333 -12.379
  731    HG3  GLU  96           1HG      GLU  96   6.410  22.177 -11.145
  732    H    GLU  97           HN       GLU  97   8.747  21.911  -9.980
  733    HA   GLU  97           HA       GLU  97   8.459  22.947  -7.337
  734    HB2  GLU  97           2HB      GLU  97  10.493  23.270  -8.764
  735    HB3  GLU  97           1HB      GLU  97   9.553  24.358  -9.774
  736    HG2  GLU  97           2HG      GLU  97   9.222  25.856  -7.892
  737    HG3  GLU  97           1HG      GLU  97  10.110  24.750  -6.844
  738    H    ARG  98           HN       ARG  98   7.054  24.359  -6.580
  739    HA   ARG  98           HA       ARG  98   5.415  25.904  -6.406
  740    HB2  ARG  98           2HB      ARG  98   6.549  27.138  -8.136
  741    HB3  ARG  98           1HB      ARG  98   5.772  26.183  -9.370
  742    HG2  ARG  98           2HG      ARG  98   3.615  27.137  -8.753
  743    HG3  ARG  98           1HG      ARG  98   4.394  28.061  -7.462
  744    HD2  ARG  98           2HD      ARG  98   4.728  28.364 -10.440
  745    HD3  ARG  98           1HD      ARG  98   4.155  29.562  -9.278
  746    HE   ARG  98           HE       ARG  98   6.748  28.850  -8.542
  747   HH11  ARG  98          1HH1      ARG  98   5.120  30.515 -11.151
  748   HH12  ARG  98          2HH1      ARG  98   6.533  31.396 -11.637
  749   HH21  ARG  98          1HH2      ARG  98   8.594  30.024  -9.130
  750   HH22  ARG  98          2HH2      ARG  98   8.515  31.138 -10.467
  751    H    GLN  99           HN       GLN  99   3.218  25.798  -6.343
  752    HA   GLN  99           HA       GLN  99   2.299  23.146  -7.073
  753    HB2  GLN  99           2HB      GLN  99   2.178  24.402  -4.735
  754    HB3  GLN  99           1HB      GLN  99   0.651  24.963  -5.404
  755    HG2  GLN  99           2HG      GLN  99   0.000  22.640  -5.803
  756    HG3  GLN  99           1HG      GLN  99   1.511  22.116  -5.065
  757   HE21  GLN  99          1HE2      GLN  99   0.453  20.984  -3.462
  758   HE22  GLN  99          2HE2      GLN  99  -0.332  21.787  -2.138
  759    H    THR 100           HN       THR 100   1.205  22.897  -8.890
  760    HA   THR 100           HA       THR 100  -0.481  25.024  -9.934
  761    HB   THR 100           HB       THR 100  -0.032  22.267 -11.081
  762    HG1  THR 100           1HG      THR 100   1.800  22.969 -11.930
  763   HG21  THR 100          3HG2      THR 100  -0.658  23.318 -13.207
  764   HG22  THR 100          1HG2      THR 100  -0.914  24.851 -12.377
  765   HG23  THR 100          2HG2      THR 100  -1.951  23.471 -12.019
  766    H    VAL 101           HN       VAL 101  -0.694  22.189  -8.106
  767    HA   VAL 101           HA       VAL 101  -3.571  21.899  -8.616
  768    HB   VAL 101           HB       VAL 101  -3.370  19.656  -7.582
  769   HG11  VAL 101          1HG1      VAL 101  -3.211  19.953 -10.018
  770   HG12  VAL 101          2HG1      VAL 101  -2.259  18.579  -9.452
  771   HG13  VAL 101          3HG1      VAL 101  -1.458  20.093  -9.877
  772   HG21  VAL 101          3HG2      VAL 101  -1.149  18.685  -7.208
  773   HG22  VAL 101          1HG2      VAL 101  -1.436  20.068  -6.151
  774   HG23  VAL 101          2HG2      VAL 101  -0.404  20.244  -7.571
  775    H    SER 102           HN       SER 102  -4.919  21.326  -6.757
  776    HA   SER 102           HA       SER 102  -3.907  22.413  -4.218
  777    HB2  SER 102           2HB      SER 102  -6.653  22.892  -5.414
  778    HB3  SER 102           1HB      SER 102  -6.128  23.422  -3.815
  779    HG   SER 102           HG       SER 102  -4.338  24.491  -5.113
  780    H    VAL 103           HN       VAL 103  -3.964  20.888  -2.710
  781    HA   VAL 103           HA       VAL 103  -5.661  18.554  -3.110
  782    HB   VAL 103           HB       VAL 103  -3.494  19.012  -1.055
  783   HG11  VAL 103          1HG1      VAL 103  -4.913  16.483  -1.884
  784   HG12  VAL 103          2HG1      VAL 103  -5.112  17.332  -0.351
  785   HG13  VAL 103          3HG1      VAL 103  -3.567  16.584  -0.750
  786   HG21  VAL 103          3HG2      VAL 103  -2.119  17.549  -2.479
  787   HG22  VAL 103          1HG2      VAL 103  -2.568  19.045  -3.296
  788   HG23  VAL 103          2HG2      VAL 103  -3.400  17.542  -3.688
  789    HA   PRO 104           HA       PRO 104  -8.378  20.174   0.104
  790    HB2  PRO 104           2HB      PRO 104 -10.218  18.084  -0.662
  791    HB3  PRO 104           1HB      PRO 104 -10.371  19.825  -0.914
  792    HG2  PRO 104           2HG      PRO 104 -10.013  18.007  -2.936
  793    HG3  PRO 104           1HG      PRO 104  -9.545  19.712  -3.040
  794    HD2  PRO 104           2HD      PRO 104  -7.856  17.309  -2.475
  795    HD3  PRO 104           1HD      PRO 104  -7.487  18.738  -3.466
  796    H    VAL 105           HN       VAL 105  -7.458  19.528   1.991
  797    HA   VAL 105           HA       VAL 105  -6.880  16.794   2.551
  798    HB   VAL 105           HB       VAL 105  -6.345  17.591   4.858
  799   HG11  VAL 105          1HG1      VAL 105  -5.110  19.185   2.612
  800   HG12  VAL 105          2HG1      VAL 105  -4.653  17.552   3.089
  801   HG13  VAL 105          3HG1      VAL 105  -4.392  18.898   4.198
  802   HG21  VAL 105          3HG2      VAL 105  -7.107  20.288   3.740
  803   HG22  VAL 105          1HG2      VAL 105  -6.318  20.002   5.292
  804   HG23  VAL 105          2HG2      VAL 105  -7.956  19.411   5.015
  805    H    THR 106           HN       THR 106  -8.156  15.280   3.280
  806    HA   THR 106           HA       THR 106 -10.288  15.812   5.145
  807    HB   THR 106           HB       THR 106 -10.955  14.726   2.390
  808    HG1  THR 106           1HG      THR 106 -10.807  17.219   3.250
  809   HG21  THR 106          3HG2      THR 106 -12.743  15.216   4.775
  810   HG22  THR 106          1HG2      THR 106 -12.253  13.637   4.160
  811   HG23  THR 106          2HG2      THR 106 -13.268  14.690   3.177
  812    H    VAL 107           HN       VAL 107 -10.607  14.070   6.426
  813    HA   VAL 107           HA       VAL 107  -9.427  11.529   5.551
  814    HB   VAL 107           HB       VAL 107  -8.145  12.397   7.396
  815   HG11  VAL 107          1HG1      VAL 107  -9.763  13.929   8.354
  816   HG12  VAL 107          2HG1      VAL 107  -9.132  12.846   9.596
  817   HG13  VAL 107          3HG1      VAL 107 -10.739  12.573   8.920
  818   HG21  VAL 107          3HG2      VAL 107  -8.547   9.987   7.326
  819   HG22  VAL 107          1HG2      VAL 107  -9.962  10.194   8.358
  820   HG23  VAL 107          2HG2      VAL 107  -8.354  10.567   8.980
  821    H    GLU 108           HN       GLU 108 -10.853   9.994   5.172
  822    HA   GLU 108           HA       GLU 108 -13.576  10.273   6.134
  823    HB2  GLU 108           2HB      GLU 108 -12.345   8.165   4.345
  824    HB3  GLU 108           1HB      GLU 108 -14.056   8.320   4.703
  825    HG2  GLU 108           2HG      GLU 108 -13.845   9.273   2.603
  826    HG3  GLU 108           1HG      GLU 108 -13.856  10.666   3.684
  827    H    MET 109           HN       MET 109 -14.499   9.074   7.691
  828    HA   MET 109           HA       MET 109 -12.821   7.468   9.387
  829    HB2  MET 109           2HB      MET 109 -14.629   8.838  10.334
  830    HB3  MET 109           1HB      MET 109 -15.820   7.904   9.440
  831    HG2  MET 109           2HG      MET 109 -15.138   5.891  10.701
  832    HG3  MET 109           1HG      MET 109 -14.036   6.894  11.642
  833    HE1  MET 109           3HE      MET 109 -15.694   9.576  11.993
  834    HE2  MET 109           1HE      MET 109 -14.841   8.807  13.333
  835    HE3  MET 109           2HE      MET 109 -16.528   9.282  13.517
  836    H    ILE 110           HN       ILE 110 -15.816   6.765   7.612
  837    HA   ILE 110           HA       ILE 110 -16.649   4.893   6.666
  838    HB   ILE 110           HB       ILE 110 -13.768   4.073   6.259
  839   HG12  ILE 110          2HG1      ILE 110 -15.550   5.763   4.487
  840   HG13  ILE 110          1HG1      ILE 110 -14.198   6.373   5.438
  841   HG21  ILE 110          1HG2      ILE 110 -16.284   3.380   4.746
  842   HG22  ILE 110          2HG2      ILE 110 -15.399   2.305   5.828
  843   HG23  ILE 110          3HG2      ILE 110 -14.652   2.860   4.327
  844   HD11  ILE 110          3HD1      ILE 110 -14.011   4.383   3.188
  845   HD12  ILE 110          1HD1      ILE 110 -12.660   5.017   4.125
  846   HD13  ILE 110          2HD1      ILE 110 -13.600   6.097   3.096
  847    H    ASN 111           HN       ASN 111 -17.348   4.406   8.898
  848    HA   ASN 111           HA       ASN 111 -15.951   2.175  10.146
  849    HB2  ASN 111           2HB      ASN 111 -16.880   3.954  11.586
  850    HB3  ASN 111           1HB      ASN 111 -18.495   3.584  10.989
  851   HD21  ASN 111          1HD2      ASN 111 -19.595   1.845  11.814
  852   HD22  ASN 111          2HD2      ASN 111 -19.000   0.876  13.123
  853    H    LEU 112           HN       LEU 112 -16.241   0.704   8.417
  854    HA   LEU 112           HA       LEU 112 -18.929  -0.134   7.751
  855    HB2  LEU 112           2HB      LEU 112 -16.250  -1.246   6.910
  856    HB3  LEU 112           1HB      LEU 112 -17.799  -1.793   6.298
  857    HG   LEU 112           HG       LEU 112 -16.636   0.970   5.923
  858   HD11  LEU 112          1HD1      LEU 112 -17.014  -1.292   3.968
  859   HD12  LEU 112          2HD1      LEU 112 -15.475  -0.734   4.621
  860   HD13  LEU 112          3HD1      LEU 112 -16.428   0.327   3.581
  861   HD21  LEU 112          3HD2      LEU 112 -19.176  -0.259   4.864
  862   HD22  LEU 112          1HD2      LEU 112 -18.525   1.314   4.402
  863   HD23  LEU 112          2HD2      LEU 112 -19.059   1.033   6.059
  864    H    GLU 113           HN       GLU 113 -19.624  -0.795   9.800
  865    HA   GLU 113           HA       GLU 113 -18.308  -2.853  11.254
  866    HB2  GLU 113           2HB      GLU 113 -20.578  -2.958  12.460
  867    HB3  GLU 113           1HB      GLU 113 -19.650  -1.470  12.578
  868    HG2  GLU 113           2HG      GLU 113 -21.039  -0.440  10.874
  869    HG3  GLU 113           1HG      GLU 113 -21.941  -1.942  10.683
  870    H    HIS 114           HN       HIS 114 -17.955  -4.545   9.851
  871    HA   HIS 114           HA       HIS 114 -20.304  -5.896   8.744
  872    HB2  HIS 114           2HB      HIS 114 -17.352  -6.320   8.245
  873    HB3  HIS 114           1HB      HIS 114 -18.619  -7.328   7.558
  874    HD1  HIS 114           1HD      HIS 114 -16.573  -5.540   5.920
  875    HD2  HIS 114           2HD      HIS 114 -20.535  -4.605   6.772
  876    HE1  HIS 114           1HE      HIS 114 -17.274  -3.886   4.162
  877    HE2  HIS 114           2HE      HIS 114 -19.734  -3.515   4.564
  878    H    HIS 115           HN       HIS 115 -21.177  -6.842  10.559
  879    HA   HIS 115           HA       HIS 115 -19.507  -8.736  12.038
  880    HB2  HIS 115           2HB      HIS 115 -21.018  -7.195  13.296
  881    HB3  HIS 115           1HB      HIS 115 -22.398  -7.954  12.511
  882    HD1  HIS 115           1HD      HIS 115 -23.522  -9.231  14.321
  883    HD2  HIS 115           2HD      HIS 115 -19.393  -9.764  14.345
  884    HE1  HIS 115           1HE      HIS 115 -23.064 -10.944  16.104
  885    HE2  HIS 115           2HE      HIS 115 -20.592 -11.410  15.946
  886    H    HIS 116           HN       HIS 116 -19.300 -10.652  11.092
  887    HA   HIS 116           HA       HIS 116 -21.464 -11.561   9.318
  888    HB2  HIS 116           2HB      HIS 116 -18.989 -11.187   8.559
  889    HB3  HIS 116           1HB      HIS 116 -18.702 -12.737   9.339
  890    HD1  HIS 116           1HD      HIS 116 -20.327 -11.173   6.372
  891    HD2  HIS 116           2HD      HIS 116 -19.815 -14.964   8.013
  892    HE1  HIS 116           1HE      HIS 116 -21.028 -12.796   4.577
  893    HE2  HIS 116           2HE      HIS 116 -20.909 -15.065   5.669
  894    H    HIS 117           HN       HIS 117 -22.448 -13.496   9.593
  895    HA   HIS 117           HA       HIS 117 -21.738 -14.998  12.033
  896    HB2  HIS 117           2HB      HIS 117 -24.355 -14.926  10.506
  897    HB3  HIS 117           1HB      HIS 117 -24.045 -15.896  11.940
  898    HD1  HIS 117           1HD      HIS 117 -24.078 -14.698  14.221
  899    HD2  HIS 117           2HD      HIS 117 -24.734 -12.181  10.970
  900    HE1  HIS 117           1HE      HIS 117 -24.942 -12.543  15.188
  901    HE2  HIS 117           2HE      HIS 117 -25.532 -11.124  13.189
  902    H    HIS 118           HN       HIS 118 -22.561 -17.420  11.773
  903    HA   HIS 118           HA       HIS 118 -21.687 -18.364   9.125
  904    HB2  HIS 118           2HB      HIS 118 -21.112 -19.516  11.847
  905    HB3  HIS 118           1HB      HIS 118 -21.000 -20.494  10.388
  906    HD1  HIS 118           1HD      HIS 118 -19.143 -19.803   8.642
  907    HD2  HIS 118           2HD      HIS 118 -18.979 -17.816  12.300
  908    HE1  HIS 118           1HE      HIS 118 -16.873 -18.724   8.733
  909    HE2  HIS 118           2HE      HIS 118 -16.773 -17.550  10.961
  910    H    HIS 119           HN       HIS 119 -23.680 -18.543   8.241
  911    HA   HIS 119           HA       HIS 119 -25.587 -20.345   9.562
  912    HB2  HIS 119           2HB      HIS 119 -26.484 -18.143   8.892
  913    HB3  HIS 119           1HB      HIS 119 -26.001 -18.454   7.229
  914    HD1  HIS 119           1HD      HIS 119 -28.770 -18.886   9.558
  915    HD2  HIS 119           2HD      HIS 119 -27.501 -20.666   6.016
  916    HE1  HIS 119           1HE      HIS 119 -30.763 -20.143   8.672
  917    HE2  HIS 119           2HE      HIS 119 -29.912 -21.364   6.636
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1  -7.808 -31.686   8.515
    2    H2   MET   1           H2       MET   1  -9.328 -31.624   7.766
    3    H3   MET   1           H3       MET   1  -8.409 -30.208   7.934
    4    HA   MET   1           HA       MET   1  -7.733 -32.561   6.268
    5    HB2  MET   1           2HB      MET   1  -8.612 -29.756   5.573
    6    HB3  MET   1           1HB      MET   1  -7.919 -30.867   4.406
    7    HG2  MET   1           2HG      MET   1  -9.760 -32.439   4.830
    8    HG3  MET   1           1HG      MET   1 -10.472 -31.267   5.940
    9    HE1  MET   1           2HE      MET   1 -11.527 -28.963   5.205
   10    HE2  MET   1           3HE      MET   1 -11.435 -28.323   3.564
   11    HE3  MET   1           1HE      MET   1  -9.968 -28.498   4.529
   12    HA   PRO   2           HA       PRO   2  -3.643 -30.842   6.754
   13    HB2  PRO   2           2HB      PRO   2  -2.306 -33.008   5.963
   14    HB3  PRO   2           1HB      PRO   2  -3.223 -33.001   7.474
   15    HG2  PRO   2           2HG      PRO   2  -3.859 -34.298   4.880
   16    HG3  PRO   2           1HG      PRO   2  -4.293 -34.793   6.522
   17    HD2  PRO   2           2HD      PRO   2  -5.912 -33.376   4.654
   18    HD3  PRO   2           1HD      PRO   2  -6.297 -33.762   6.343
   19    H    THR   3           HN       THR   3  -5.220 -31.422   3.837
   20    HA   THR   3           HA       THR   3  -2.917 -31.416   2.121
   21    HB   THR   3           HB       THR   3  -5.674 -31.048   1.120
   22    HG1  THR   3           1HG      THR   3  -4.781 -33.649   1.726
   23   HG21  THR   3          3HG2      THR   3  -4.881 -32.581  -0.644
   24   HG22  THR   3          1HG2      THR   3  -3.337 -32.734   0.198
   25   HG23  THR   3          2HG2      THR   3  -3.821 -31.181  -0.482
   26    H    PHE   4           HN       PHE   4  -3.882 -29.066   3.796
   27    HA   PHE   4           HA       PHE   4  -4.332 -26.967   1.933
   28    HB2  PHE   4           2HB      PHE   4  -3.677 -27.023   4.840
   29    HB3  PHE   4           1HB      PHE   4  -3.745 -25.517   3.953
   30    HD1  PHE   4           1HD      PHE   4  -5.903 -24.919   2.771
   31    HD2  PHE   4           2HD      PHE   4  -5.615 -28.034   5.654
   32    HE1  PHE   4           1HE      PHE   4  -8.341 -24.843   3.093
   33    HE2  PHE   4           2HE      PHE   4  -8.050 -27.964   5.978
   34    HZ   PHE   4           HZ       PHE   4  -9.419 -26.367   4.697
   35    H    ASP   5           HN       ASP   5  -2.922 -25.416   1.198
   36    HA   ASP   5           HA       ASP   5  -0.067 -25.889   1.633
   37    HB2  ASP   5           2HB      ASP   5  -0.661 -26.998  -0.480
   38    HB3  ASP   5           1HB      ASP   5  -1.375 -25.503  -1.075
   39    H    HIS   6           HN       HIS   6   0.037 -24.110   2.905
   40    HA   HIS   6           HA       HIS   6   0.640 -21.947   3.321
   41    HB2  HIS   6           2HB      HIS   6   0.181 -21.527   0.358
   42    HB3  HIS   6           1HB      HIS   6   0.837 -20.317   1.450
   43    HD1  HIS   6           1HD      HIS   6   1.748 -23.279  -0.558
   44    HD2  HIS   6           2HD      HIS   6   3.488 -20.859   2.346
   45    HE1  HIS   6           1HE      HIS   6   4.213 -23.757  -0.661
   46    HE2  HIS   6           2HE      HIS   6   5.255 -22.080   0.900
   47    H    GLY   7           HN       GLY   7  -0.305 -19.589   2.780
   48    HA2  GLY   7           2HA      GLY   7  -3.169 -19.616   2.267
   49    HA3  GLY   7           1HA      GLY   7  -2.663 -19.059   3.862
   50    H    ASN   8           HN       ASN   8  -3.991 -17.373   2.034
   51    HA   ASN   8           HA       ASN   8  -1.979 -15.311   1.889
   52    HB2  ASN   8           2HB      ASN   8  -2.790 -14.734  -0.503
   53    HB3  ASN   8           1HB      ASN   8  -1.573 -15.980  -0.279
   54   HD21  ASN   8          1HD2      ASN   8  -1.949 -17.085  -2.097
   55   HD22  ASN   8          2HD2      ASN   8  -3.409 -17.954  -2.411
   56    H    LEU   9           HN       LEU   9  -2.768 -13.225   1.693
   57    HA   LEU   9           HA       LEU   9  -5.638 -12.914   2.246
   58    HB2  LEU   9           2HB      LEU   9  -4.376 -12.985   4.371
   59    HB3  LEU   9           1HB      LEU   9  -3.374 -11.661   3.813
   60    HG   LEU   9           HG       LEU   9  -5.422 -10.229   3.728
   61   HD11  LEU   9          1HD1      LEU   9  -7.073 -12.012   3.516
   62   HD12  LEU   9          2HD1      LEU   9  -7.412 -10.990   4.915
   63   HD13  LEU   9          3HD1      LEU   9  -6.675 -12.579   5.139
   64   HD21  LEU   9          3HD2      LEU   9  -3.877 -10.156   5.618
   65   HD22  LEU   9          1HD2      LEU   9  -4.759 -11.470   6.396
   66   HD23  LEU   9          2HD2      LEU   9  -5.541  -9.910   6.148
   67    H    SER  10           HN       SER  10  -6.536 -11.108   1.365
   68    HA   SER  10           HA       SER  10  -4.780  -9.477  -0.305
   69    HB2  SER  10           2HB      SER  10  -7.048  -8.723  -1.278
   70    HB3  SER  10           1HB      SER  10  -6.519 -10.369  -1.620
   71    HG   SER  10           HG       SER  10  -8.744  -9.533  -0.363
   72    H    LEU  11           HN       LEU  11  -4.133  -7.594   0.512
   73    HA   LEU  11           HA       LEU  11  -5.565  -6.343   2.692
   74    HB2  LEU  11           2HB      LEU  11  -3.152  -5.393   1.144
   75    HB3  LEU  11           1HB      LEU  11  -3.777  -4.652   2.602
   76    HG   LEU  11           HG       LEU  11  -2.584  -7.421   2.400
   77   HD11  LEU  11          1HD1      LEU  11  -1.534  -4.905   3.688
   78   HD12  LEU  11          2HD1      LEU  11  -0.934  -5.629   2.195
   79   HD13  LEU  11          3HD1      LEU  11  -0.765  -6.494   3.725
   80   HD21  LEU  11          3HD2      LEU  11  -3.593  -5.904   4.803
   81   HD22  LEU  11          1HD2      LEU  11  -2.758  -7.455   4.840
   82   HD23  LEU  11          2HD2      LEU  11  -4.346  -7.326   4.085
   83    H    GLY  12           HN       GLY  12  -5.028  -5.831  -0.730
   84    HA2  GLY  12           2HA      GLY  12  -6.697  -4.861  -2.121
   85    HA3  GLY  12           1HA      GLY  12  -7.288  -3.960  -0.732
   86    H    GLU  13           HN       GLU  13  -7.228  -2.036  -1.962
   87    HA   GLU  13           HA       GLU  13  -4.633  -1.129  -2.896
   88    HB2  GLU  13           2HB      GLU  13  -5.918   0.858  -3.724
   89    HB3  GLU  13           1HB      GLU  13  -6.406  -0.681  -4.415
   90    HG2  GLU  13           2HG      GLU  13  -7.859   0.624  -2.127
   91    HG3  GLU  13           1HG      GLU  13  -8.253   0.915  -3.818
   92    H    LEU  14           HN       LEU  14  -3.323  -0.316  -1.466
   93    HA   LEU  14           HA       LEU  14  -4.375   1.146   0.841
   94    HB2  LEU  14           2HB      LEU  14  -1.594   0.118   0.272
   95    HB3  LEU  14           1HB      LEU  14  -2.108   0.900   1.755
   96    HG   LEU  14           HG       LEU  14  -3.146  -1.743   0.721
   97   HD11  LEU  14          1HD1      LEU  14  -0.841  -1.885   1.505
   98   HD12  LEU  14          2HD1      LEU  14  -1.939  -2.708   2.612
   99   HD13  LEU  14          3HD1      LEU  14  -1.302  -1.115   3.023
  100   HD21  LEU  14          3HD2      LEU  14  -4.825  -0.474   1.987
  101   HD22  LEU  14          1HD2      LEU  14  -3.687  -0.311   3.323
  102   HD23  LEU  14          2HD2      LEU  14  -4.287  -1.905   2.869
  103    H    GLU  15           HN       GLU  15  -3.422   3.143   1.469
  104    HA   GLU  15           HA       GLU  15  -3.108   4.935  -0.730
  105    HB2  GLU  15           2HB      GLU  15  -2.776   5.394   2.242
  106    HB3  GLU  15           1HB      GLU  15  -2.869   6.658   1.022
  107    HG2  GLU  15           2HG      GLU  15  -5.138   6.044   0.498
  108    HG3  GLU  15           1HG      GLU  15  -5.047   4.663   1.593
  109    H    LEU  16           HN       LEU  16  -1.275   5.438  -1.751
  110    HA   LEU  16           HA       LEU  16   1.276   4.635  -0.620
  111    HB2  LEU  16           2HB      LEU  16   0.902   4.217  -2.978
  112    HB3  LEU  16           1HB      LEU  16   0.552   5.912  -3.256
  113    HG   LEU  16           HG       LEU  16   2.888   6.478  -2.670
  114   HD11  LEU  16          1HD1      LEU  16   4.550   4.719  -2.476
  115   HD12  LEU  16          2HD1      LEU  16   3.285   3.494  -2.574
  116   HD13  LEU  16          3HD1      LEU  16   3.347   4.590  -1.193
  117   HD21  LEU  16          3HD2      LEU  16   2.557   4.431  -4.857
  118   HD22  LEU  16          1HD2      LEU  16   3.927   5.529  -4.692
  119   HD23  LEU  16          2HD2      LEU  16   2.314   6.174  -4.993
  120    H    THR  17           HN       THR  17   2.441   5.931   0.614
  121    HA   THR  17           HA       THR  17   1.899   8.816   0.536
  122    HB   THR  17           HB       THR  17   3.459   7.258   2.613
  123    HG1  THR  17           1HG      THR  17   1.294   6.600   2.622
  124   HG21  THR  17          3HG2      THR  17   3.087   9.246   4.011
  125   HG22  THR  17          1HG2      THR  17   2.288  10.045   2.656
  126   HG23  THR  17          2HG2      THR  17   4.003   9.643   2.557
  127    H    VAL  18           HN       VAL  18   3.415  10.242  -0.147
  128    HA   VAL  18           HA       VAL  18   6.066   9.186  -0.866
  129    HB   VAL  18           HB       VAL  18   4.684  11.708  -1.820
  130   HG11  VAL  18          1HG1      VAL  18   6.541  11.883  -3.414
  131   HG12  VAL  18          2HG1      VAL  18   7.318  10.494  -2.653
  132   HG13  VAL  18          3HG1      VAL  18   7.098  11.989  -1.743
  133   HG21  VAL  18          3HG2      VAL  18   3.652   9.708  -2.738
  134   HG22  VAL  18          1HG2      VAL  18   5.229   9.106  -3.247
  135   HG23  VAL  18          2HG2      VAL  18   4.558  10.558  -3.988
  136    H    LEU  19           HN       LEU  19   7.688   9.683   0.470
  137    HA   LEU  19           HA       LEU  19   7.183  11.677   2.527
  138    HB2  LEU  19           2HB      LEU  19   8.238   9.232   2.722
  139    HB3  LEU  19           1HB      LEU  19   9.719  10.119   2.421
  140    HG   LEU  19           HG       LEU  19   7.802  10.678   4.691
  141   HD11  LEU  19          1HD1      LEU  19   9.537   9.700   6.120
  142   HD12  LEU  19          2HD1      LEU  19  10.463   9.257   4.686
  143   HD13  LEU  19          3HD1      LEU  19   8.885   8.528   4.978
  144   HD21  LEU  19          3HD2      LEU  19  10.553  11.772   4.115
  145   HD22  LEU  19          1HD2      LEU  19   9.607  12.080   5.572
  146   HD23  LEU  19          2HD2      LEU  19   9.034  12.662   4.009
  147    H    TYR  20           HN       TYR  20   7.722  13.661   2.173
  148    HA   TYR  20           HA       TYR  20  10.330  14.557   1.739
  149    HB2  TYR  20           2HB      TYR  20   9.786  13.811  -0.632
  150    HB3  TYR  20           1HB      TYR  20   8.532  15.050  -0.653
  151    HD1  TYR  20           1HD      TYR  20  12.169  14.737   0.145
  152    HD2  TYR  20           2HD      TYR  20   9.087  17.093  -1.598
  153    HE1  TYR  20           1HE      TYR  20  13.842  16.391  -0.556
  154    HE2  TYR  20           2HE      TYR  20  10.753  18.759  -2.308
  155    HH   TYR  20           HH       TYR  20  13.070  19.478  -1.574
  156    H    ASP  21           HN       ASP  21  10.432  16.760   2.263
  157    HA   ASP  21           HA       ASP  21   7.922  17.852   3.268
  158    HB2  ASP  21           2HB      ASP  21   9.841  17.876   4.774
  159    HB3  ASP  21           1HB      ASP  21  10.777  18.802   3.606
  160    H    GLU  22           HN       GLU  22   7.289  20.015   2.834
  161    HA   GLU  22           HA       GLU  22   7.438  20.630   0.031
  162    HB2  GLU  22           2HB      GLU  22   5.820  22.427   0.648
  163    HB3  GLU  22           1HB      GLU  22   5.320  20.825   1.173
  164    HG2  GLU  22           2HG      GLU  22   6.388  21.445   3.421
  165    HG3  GLU  22           1HG      GLU  22   6.357  23.101   2.819
  166    H    GLU  23           HN       GLU  23   9.916  20.861   1.293
  167    HA   GLU  23           HA       GLU  23  10.481  23.576   2.026
  168    HB2  GLU  23           2HB      GLU  23  12.831  22.703   2.165
  169    HB3  GLU  23           1HB      GLU  23  11.664  21.845   3.163
  170    HG2  GLU  23           2HG      GLU  23  11.540  20.059   1.522
  171    HG3  GLU  23           1HG      GLU  23  12.655  20.925   0.469
  172    H    ARG  24           HN       ARG  24  10.608  21.750  -0.937
  173    HA   ARG  24           HA       ARG  24  11.939  23.989  -2.255
  174    HB2  ARG  24           2HB      ARG  24  13.489  21.957  -1.396
  175    HB3  ARG  24           1HB      ARG  24  13.030  21.335  -2.974
  176    HG2  ARG  24           2HG      ARG  24  15.125  22.505  -3.139
  177    HG3  ARG  24           1HG      ARG  24  13.880  23.405  -4.011
  178    HD2  ARG  24           2HD      ARG  24  13.689  25.003  -2.270
  179    HD3  ARG  24           1HD      ARG  24  14.641  24.014  -1.163
  180    HE   ARG  24           HE       ARG  24  16.097  24.800  -3.517
  181   HH11  ARG  24          1HH1      ARG  24  15.089  25.789  -0.322
  182   HH12  ARG  24          2HH1      ARG  24  16.390  26.917  -0.104
  183   HH21  ARG  24          1HH2      ARG  24  17.870  26.234  -3.225
  184   HH22  ARG  24          2HH2      ARG  24  18.008  27.127  -1.736
  185    H    TYR  25           HN       TYR  25  10.583  20.715  -2.738
  186    HA   TYR  25           HA       TYR  25   9.653  21.631  -5.375
  187    HB2  TYR  25           2HB      TYR  25  10.430  18.827  -4.550
  188    HB3  TYR  25           1HB      TYR  25   9.821  19.297  -6.134
  189    HD1  TYR  25           2HD      TYR  25  11.199  20.871  -7.543
  190    HD2  TYR  25           1HD      TYR  25  12.720  19.042  -4.015
  191    HE1  TYR  25           2HE      TYR  25  13.489  21.372  -8.275
  192    HE2  TYR  25           1HE      TYR  25  15.017  19.543  -4.739
  193    HH   TYR  25           HH       TYR  25  16.219  19.986  -6.870
  194    H    ASP  26           HN       ASP  26   7.652  20.796  -6.131
  195    HA   ASP  26           HA       ASP  26   5.845  19.936  -3.966
  196    HB2  ASP  26           2HB      ASP  26   5.640  22.297  -5.230
  197    HB3  ASP  26           1HB      ASP  26   4.709  21.306  -6.341
  198    H    ILE  27           HN       ILE  27   3.863  18.822  -4.855
  199    HA   ILE  27           HA       ILE  27   4.894  16.589  -6.413
  200    HB   ILE  27           HB       ILE  27   2.212  16.889  -5.052
  201   HG12  ILE  27          2HG1      ILE  27   4.725  15.489  -4.093
  202   HG13  ILE  27          1HG1      ILE  27   4.104  17.010  -3.462
  203   HG21  ILE  27          1HG2      ILE  27   2.088  14.450  -5.248
  204   HG22  ILE  27          2HG2      ILE  27   3.610  14.447  -6.140
  205   HG23  ILE  27          3HG2      ILE  27   2.186  15.229  -6.827
  206   HD11  ILE  27          3HD1      ILE  27   3.569  15.128  -2.011
  207   HD12  ILE  27          1HD1      ILE  27   2.687  14.360  -3.330
  208   HD13  ILE  27          2HD1      ILE  27   2.113  15.887  -2.658
  209    H    VAL  28           HN       VAL  28   4.593  16.400  -8.520
  210    HA   VAL  28           HA       VAL  28   2.350  17.817  -9.779
  211    HB   VAL  28           HB       VAL  28   4.802  16.569 -11.038
  212   HG11  VAL  28          1HG1      VAL  28   4.025  17.588 -13.130
  213   HG12  VAL  28          2HG1      VAL  28   2.544  18.108 -12.325
  214   HG13  VAL  28          3HG1      VAL  28   2.878  16.388 -12.532
  215   HG21  VAL  28          3HG2      VAL  28   5.273  18.625  -9.824
  216   HG22  VAL  28          1HG2      VAL  28   3.972  19.447 -10.685
  217   HG23  VAL  28          2HG2      VAL  28   5.398  18.894 -11.565
  218    H    GLU  29           HN       GLU  29   3.916  14.609  -9.720
  219    HA   GLU  29           HA       GLU  29   1.268  13.460 -10.109
  220    HB2  GLU  29           2HB      GLU  29   1.879  11.989 -11.853
  221    HB3  GLU  29           1HB      GLU  29   2.472  13.568 -12.348
  222    HG2  GLU  29           2HG      GLU  29   4.706  12.992 -11.832
  223    HG3  GLU  29           1HG      GLU  29   4.207  11.530 -10.984
  224    H    GLN  30           HN       GLN  30   1.068  11.305  -9.388
  225    HA   GLN  30           HA       GLN  30   3.206   9.824  -8.267
  226    HB2  GLN  30           2HB      GLN  30   2.519   9.912  -5.904
  227    HB3  GLN  30           1HB      GLN  30   3.032  11.493  -6.471
  228    HG2  GLN  30           2HG      GLN  30   0.749  12.219  -6.672
  229    HG3  GLN  30           1HG      GLN  30   0.167  10.609  -6.253
  230   HE21  GLN  30          1HE2      GLN  30  -0.984  11.353  -4.480
  231   HE22  GLN  30          2HE2      GLN  30  -0.207  11.889  -3.031
  232    H    THR  31           HN       THR  31   2.237   7.906  -6.990
  233    HA   THR  31           HA       THR  31  -0.121   7.009  -8.457
  234    HB   THR  31           HB       THR  31   1.602   5.408  -6.554
  235    HG1  THR  31           1HG      THR  31   2.258   6.428  -8.913
  236   HG21  THR  31          3HG2      THR  31  -0.578   4.412  -7.045
  237   HG22  THR  31          1HG2      THR  31   0.720   3.487  -7.802
  238   HG23  THR  31          2HG2      THR  31  -0.270   4.575  -8.775
  239    H    GLU  32           HN       GLU  32  -2.075   6.705  -7.515
  240    HA   GLU  32           HA       GLU  32  -2.561   8.021  -5.029
  241    HB2  GLU  32           2HB      GLU  32  -4.441   6.323  -6.677
  242    HB3  GLU  32           1HB      GLU  32  -4.900   7.482  -5.437
  243    HG2  GLU  32           2HG      GLU  32  -4.293   9.313  -6.759
  244    HG3  GLU  32           1HG      GLU  32  -3.362   8.310  -7.871
  245    H    THR  33           HN       THR  33  -3.520   4.744  -6.007
  246    HA   THR  33           HA       THR  33  -2.805   3.805  -3.320
  247    HB   THR  33           HB       THR  33  -4.820   2.221  -3.601
  248    HG1  THR  33           1HG      THR  33  -6.514   3.458  -4.866
  249   HG21  THR  33          3HG2      THR  33  -5.328   5.164  -3.159
  250   HG22  THR  33          1HG2      THR  33  -4.725   4.036  -1.948
  251   HG23  THR  33          2HG2      THR  33  -6.347   3.837  -2.603
  252    H    VAL  34           HN       VAL  34  -2.210   1.609  -3.164
  253    HA   VAL  34           HA       VAL  34  -1.594   0.294  -5.734
  254    HB   VAL  34           HB       VAL  34   0.383  -0.737  -4.556
  255   HG11  VAL  34          1HG1      VAL  34   0.687   1.019  -6.169
  256   HG12  VAL  34          2HG1      VAL  34   1.814   1.249  -4.833
  257   HG13  VAL  34          3HG1      VAL  34   0.364   2.248  -4.944
  258   HG21  VAL  34          3HG2      VAL  34   1.284   0.439  -2.594
  259   HG22  VAL  34          1HG2      VAL  34  -0.277  -0.308  -2.251
  260   HG23  VAL  34          2HG2      VAL  34  -0.174   1.431  -2.528
  261    H    GLN  35           HN       GLN  35  -1.786  -1.961  -5.781
  262    HA   GLN  35           HA       GLN  35  -3.609  -2.974  -3.747
  263    HB2  GLN  35           2HB      GLN  35  -4.206  -3.138  -6.148
  264    HB3  GLN  35           1HB      GLN  35  -2.819  -4.185  -6.401
  265    HG2  GLN  35           2HG      GLN  35  -3.764  -5.885  -5.020
  266    HG3  GLN  35           1HG      GLN  35  -5.069  -4.814  -4.510
  267   HE21  GLN  35          1HE2      GLN  35  -5.156  -7.425  -5.832
  268   HE22  GLN  35          2HE2      GLN  35  -6.092  -7.177  -7.272
  269    H    VAL  36           HN       VAL  36  -2.825  -4.079  -2.118
  270    HA   VAL  36           HA       VAL  36  -0.281  -5.524  -2.473
  271    HB   VAL  36           HB       VAL  36  -1.488  -4.595   0.134
  272   HG11  VAL  36          1HG1      VAL  36   1.276  -5.576  -0.560
  273   HG12  VAL  36          2HG1      VAL  36   0.049  -6.462   0.348
  274   HG13  VAL  36          3HG1      VAL  36   0.757  -4.993   1.022
  275   HG21  VAL  36          3HG2      VAL  36  -0.980  -2.644  -1.222
  276   HG22  VAL  36          1HG2      VAL  36   0.643  -3.263  -1.538
  277   HG23  VAL  36          2HG2      VAL  36   0.183  -2.791   0.098
  278    H    ASP  37           HN       ASP  37  -0.353  -7.645  -2.446
  279    HA   ASP  37           HA       ASP  37  -2.433  -9.006  -0.860
  280    HB2  ASP  37           2HB      ASP  37  -1.344  -9.875  -3.557
  281    HB3  ASP  37           1HB      ASP  37  -2.398 -10.847  -2.538
  282    H    LEU  38           HN       LEU  38  -1.705 -10.707   0.400
  283    HA   LEU  38           HA       LEU  38   1.223 -11.104   0.383
  284    HB2  LEU  38           2HB      LEU  38  -0.598 -11.069   2.792
  285    HB3  LEU  38           1HB      LEU  38   1.136 -11.320   2.814
  286    HG   LEU  38           HG       LEU  38  -0.242  -8.768   1.972
  287   HD11  LEU  38          1HD1      LEU  38  -0.450  -9.193   4.365
  288   HD12  LEU  38          2HD1      LEU  38   0.668  -7.864   4.055
  289   HD13  LEU  38          3HD1      LEU  38   1.290  -9.459   4.477
  290   HD21  LEU  38          3HD2      LEU  38   2.677  -9.441   2.316
  291   HD22  LEU  38          1HD2      LEU  38   2.033  -7.827   2.020
  292   HD23  LEU  38          2HD2      LEU  38   1.858  -9.086   0.797
  293    H    GLU  39           HN       GLU  39   1.924 -13.147   0.283
  294    HA   GLU  39           HA       GLU  39   0.058 -15.292   1.065
  295    HB2  GLU  39           2HB      GLU  39   2.298 -15.548  -0.949
  296    HB3  GLU  39           1HB      GLU  39   1.195 -16.821  -0.444
  297    HG2  GLU  39           2HG      GLU  39  -0.667 -15.462  -1.370
  298    HG3  GLU  39           1HG      GLU  39   0.555 -14.384  -2.035
  299    H    GLY  40           HN       GLY  40   1.243 -17.308   1.655
  300    HA2  GLY  40           2HA      GLY  40   3.649 -17.913   2.417
  301    HA3  GLY  40           1HA      GLY  40   3.389 -16.576   3.531
  302    HA   PRO  41           HA       PRO  41   2.040 -20.313   5.892
  303    HB2  PRO  41           2HB      PRO  41   2.644 -19.051   8.281
  304    HB3  PRO  41           1HB      PRO  41   3.730 -20.137   7.410
  305    HG2  PRO  41           2HG      PRO  41   3.667 -17.156   7.455
  306    HG3  PRO  41           1HG      PRO  41   5.061 -18.252   7.429
  307    HD2  PRO  41           2HD      PRO  41   4.240 -16.951   5.224
  308    HD3  PRO  41           1HD      PRO  41   4.910 -18.593   5.145
  309    H    ARG  42           HN       ARG  42  -0.082 -20.410   6.124
  310    HA   ARG  42           HA       ARG  42  -1.772 -18.175   6.173
  311    HB2  ARG  42           2HB      ARG  42  -3.578 -19.798   6.707
  312    HB3  ARG  42           1HB      ARG  42  -2.585 -20.274   5.337
  313    HG2  ARG  42           2HG      ARG  42  -1.369 -21.839   6.724
  314    HG3  ARG  42           1HG      ARG  42  -2.299 -21.335   8.135
  315    HD2  ARG  42           2HD      ARG  42  -4.340 -22.160   7.127
  316    HD3  ARG  42           1HD      ARG  42  -3.471 -22.572   5.649
  317    HE   ARG  42           HE       ARG  42  -2.128 -24.078   7.272
  318   HH11  ARG  42          1HH1      ARG  42  -5.585 -23.455   7.428
  319   HH12  ARG  42          2HH1      ARG  42  -5.937 -24.990   8.176
  320   HH21  ARG  42          1HH2      ARG  42  -2.596 -26.046   8.249
  321   HH22  ARG  42          2HH2      ARG  42  -4.234 -26.451   8.668
  322    H    GLY  43           HN       GLY  43  -0.323 -20.038   8.746
  323    HA2  GLY  43           2HA      GLY  43  -1.952 -19.320  10.892
  324    HA3  GLY  43           1HA      GLY  43  -0.236 -19.679  11.011
  325    H    VAL  44           HN       VAL  44   0.715 -17.552   9.409
  326    HA   VAL  44           HA       VAL  44   0.713 -15.423  11.305
  327    HB   VAL  44           HB       VAL  44   1.724 -15.407   8.452
  328   HG11  VAL  44          1HG1      VAL  44   3.147 -13.549   9.206
  329   HG12  VAL  44          2HG1      VAL  44   2.332 -13.576  10.771
  330   HG13  VAL  44          3HG1      VAL  44   1.429 -13.162   9.312
  331   HG21  VAL  44          3HG2      VAL  44   3.169 -16.021  11.025
  332   HG22  VAL  44          1HG2      VAL  44   3.935 -15.830   9.447
  333   HG23  VAL  44          2HG2      VAL  44   2.806 -17.159   9.725
  334    H    LEU  45           HN       LEU  45  -0.647 -15.798   8.045
  335    HA   LEU  45           HA       LEU  45  -1.569 -13.134   7.860
  336    HB2  LEU  45           2HB      LEU  45  -2.184 -15.620   6.293
  337    HB3  LEU  45           1HB      LEU  45  -2.904 -14.066   5.906
  338    HG   LEU  45           HG       LEU  45   0.072 -14.562   5.994
  339   HD11  LEU  45          1HD1      LEU  45  -0.033 -14.511   3.548
  340   HD12  LEU  45          2HD1      LEU  45  -1.795 -14.468   3.630
  341   HD13  LEU  45          3HD1      LEU  45  -0.918 -15.883   4.216
  342   HD21  LEU  45          3HD2      LEU  45  -1.563 -12.272   4.909
  343   HD22  LEU  45          1HD2      LEU  45   0.190 -12.429   4.819
  344   HD23  LEU  45          2HD2      LEU  45  -0.599 -12.248   6.385
  345    H    THR  46           HN       THR  46  -3.223 -16.140   8.790
  346    HA   THR  46           HA       THR  46  -5.821 -15.021   8.826
  347    HB   THR  46           HB       THR  46  -4.799 -17.354  10.464
  348    HG1  THR  46           1HG      THR  46  -6.210 -17.794   8.111
  349   HG21  THR  46          3HG2      THR  46  -7.587 -16.663   9.520
  350   HG22  THR  46          1HG2      THR  46  -6.998 -16.531  11.178
  351   HG23  THR  46          2HG2      THR  46  -7.126 -18.114  10.411
  352    H    VAL  47           HN       VAL  47  -3.339 -15.340  11.350
  353    HA   VAL  47           HA       VAL  47  -4.945 -14.189  13.411
  354    HB   VAL  47           HB       VAL  47  -1.934 -14.444  13.204
  355   HG11  VAL  47          1HG1      VAL  47  -3.653 -13.769  15.590
  356   HG12  VAL  47          2HG1      VAL  47  -2.549 -12.670  14.761
  357   HG13  VAL  47          3HG1      VAL  47  -1.915 -14.070  15.627
  358   HG21  VAL  47          3HG2      VAL  47  -3.982 -16.117  14.661
  359   HG22  VAL  47          1HG2      VAL  47  -2.232 -16.332  14.735
  360   HG23  VAL  47          2HG2      VAL  47  -3.089 -16.591  13.214
  361    H    PHE  48           HN       PHE  48  -2.626 -12.950  11.071
  362    HA   PHE  48           HA       PHE  48  -2.537 -10.281  11.956
  363    HB2  PHE  48           2HB      PHE  48  -1.004 -11.344  10.274
  364    HB3  PHE  48           1HB      PHE  48  -2.316 -11.282   9.107
  365    HD1  PHE  48           1HD      PHE  48  -0.077  -9.206  11.184
  366    HD2  PHE  48           2HD      PHE  48  -2.758  -9.323   7.883
  367    HE1  PHE  48           1HE      PHE  48   0.637  -6.944  10.532
  368    HE2  PHE  48           2HE      PHE  48  -2.052  -7.059   7.227
  369    HZ   PHE  48           HZ       PHE  48  -0.353  -5.869   8.551
  370    H    ARG  49           HN       ARG  49  -4.786 -12.036   9.916
  371    HA   ARG  49           HA       ARG  49  -6.285  -9.866   8.956
  372    HB2  ARG  49           2HB      ARG  49  -6.190 -12.442   8.359
  373    HB3  ARG  49           1HB      ARG  49  -7.531 -12.524   9.488
  374    HG2  ARG  49           2HG      ARG  49  -7.613 -10.502   7.327
  375    HG3  ARG  49           1HG      ARG  49  -7.906 -12.184   6.929
  376    HD2  ARG  49           2HD      ARG  49  -9.368 -10.877   9.189
  377    HD3  ARG  49           1HD      ARG  49  -9.912 -10.660   7.527
  378    HE   ARG  49           HE       ARG  49  -9.684 -13.339   7.709
  379   HH11  ARG  49          1HH1      ARG  49 -11.244 -10.979   9.787
  380   HH12  ARG  49          2HH1      ARG  49 -12.535 -12.047  10.244
  381   HH21  ARG  49          1HH2      ARG  49 -11.368 -14.751   8.321
  382   HH22  ARG  49          2HH2      ARG  49 -12.603 -14.204   9.417
  383    H    PHE  50           HN       PHE  50  -6.233 -11.495  12.015
  384    HA   PHE  50           HA       PHE  50  -8.838 -10.713  12.877
  385    HB2  PHE  50           2HB      PHE  50  -6.406 -11.702  14.372
  386    HB3  PHE  50           1HB      PHE  50  -7.960 -11.401  15.120
  387    HD1  PHE  50           2HD      PHE  50  -9.608 -12.456  12.737
  388    HD2  PHE  50           1HD      PHE  50  -6.291 -14.013  14.900
  389    HE1  PHE  50           2HE      PHE  50 -10.307 -14.742  12.159
  390    HE2  PHE  50           1HE      PHE  50  -6.984 -16.301  14.326
  391    HZ   PHE  50           HZ       PHE  50  -8.998 -16.668  12.953
  392    H    ALA  51           HN       ALA  51  -5.672  -9.310  12.945
  393    HA   ALA  51           HA       ALA  51  -6.410  -7.311  14.917
  394    HB1  ALA  51           1HB      ALA  51  -4.079  -6.647  14.858
  395    HB2  ALA  51           2HB      ALA  51  -3.785  -7.717  13.486
  396    HB3  ALA  51           3HB      ALA  51  -4.206  -8.396  15.061
  397    H    ARG  52           HN       ARG  52  -6.289  -5.096  14.532
  398    HA   ARG  52           HA       ARG  52  -7.194  -4.194  12.008
  399    HB2  ARG  52           2HB      ARG  52  -6.484  -2.956  14.621
  400    HB3  ARG  52           1HB      ARG  52  -6.668  -1.920  13.221
  401    HG2  ARG  52           2HG      ARG  52  -8.932  -2.581  12.925
  402    HG3  ARG  52           1HG      ARG  52  -8.766  -3.873  14.114
  403    HD2  ARG  52           2HD      ARG  52  -8.399  -0.964  14.787
  404    HD3  ARG  52           1HD      ARG  52  -9.954  -1.791  14.896
  405    HE   ARG  52           HE       ARG  52  -8.265  -3.370  16.341
  406   HH11  ARG  52          1HH1      ARG  52  -9.034   0.049  16.418
  407   HH12  ARG  52          2HH1      ARG  52  -8.900   0.171  18.148
  408   HH21  ARG  52          1HH2      ARG  52  -8.139  -3.236  18.617
  409   HH22  ARG  52          2HH2      ARG  52  -8.394  -1.703  19.401
  410    HA   PRO  53           HA       PRO  53  -3.501  -3.373   9.868
  411    HB2  PRO  53           2HB      PRO  53  -4.485  -0.828   8.854
  412    HB3  PRO  53           1HB      PRO  53  -4.223  -2.344   7.994
  413    HG2  PRO  53           2HG      PRO  53  -6.700  -1.362   8.483
  414    HG3  PRO  53           1HG      PRO  53  -6.352  -3.097   8.389
  415    HD2  PRO  53           2HD      PRO  53  -6.737  -1.372  10.801
  416    HD3  PRO  53           1HD      PRO  53  -7.298  -3.030  10.499
  417    H    SER  54           HN       SER  54  -1.661  -2.775  10.733
  418    HA   SER  54           HA       SER  54  -1.348  -0.075  11.801
  419    HB2  SER  54           2HB      SER  54   0.136  -2.643  12.311
  420    HB3  SER  54           1HB      SER  54   0.619  -1.090  12.943
  421    HG   SER  54           HG       SER  54  -1.501  -0.989  13.944
  422    H    TYR  55           HN       TYR  55  -1.046  -1.459   9.003
  423    HA   TYR  55           HA       TYR  55   1.779  -0.993   8.503
  424    HB2  TYR  55           2HB      TYR  55   1.223  -2.083   6.259
  425    HB3  TYR  55           1HB      TYR  55   1.160  -3.099   7.692
  426    HD1  TYR  55           2HD      TYR  55  -0.999  -1.156   5.357
  427    HD2  TYR  55           1HD      TYR  55  -0.771  -4.316   8.191
  428    HE1  TYR  55           2HE      TYR  55  -3.281  -1.854   4.759
  429    HE2  TYR  55           1HE      TYR  55  -3.048  -5.022   7.599
  430    HH   TYR  55           HH       TYR  55  -5.057  -4.116   6.601
  431    H    GLU  56           HN       GLU  56   2.521   0.145   6.689
  432    HA   GLU  56           HA       GLU  56   0.687   2.027   5.425
  433    HB2  GLU  56           2HB      GLU  56   1.517   3.152   7.465
  434    HB3  GLU  56           1HB      GLU  56   3.167   2.896   6.924
  435    HG2  GLU  56           2HG      GLU  56   2.782   4.333   5.003
  436    HG3  GLU  56           1HG      GLU  56   1.104   4.558   5.496
  437    H    VAL  57           HN       VAL  57   1.399   2.741   3.418
  438    HA   VAL  57           HA       VAL  57   3.859   1.475   2.399
  439    HB   VAL  57           HB       VAL  57   1.432   2.341   0.809
  440   HG11  VAL  57          1HG1      VAL  57   3.867   0.749   0.018
  441   HG12  VAL  57          2HG1      VAL  57   3.492   2.401  -0.477
  442   HG13  VAL  57          3HG1      VAL  57   2.472   1.066  -1.013
  443   HG21  VAL  57          3HG2      VAL  57   0.947  -0.049   0.554
  444   HG22  VAL  57          1HG2      VAL  57   0.873   0.447   2.243
  445   HG23  VAL  57          2HG2      VAL  57   2.279  -0.433   1.643
  446    H    PHE  58           HN       PHE  58   5.428   2.805   1.579
  447    HA   PHE  58           HA       PHE  58   4.817   5.561   0.929
  448    HB2  PHE  58           2HB      PHE  58   6.219   6.557   2.621
  449    HB3  PHE  58           1HB      PHE  58   5.041   5.525   3.424
  450    HD1  PHE  58           1HD      PHE  58   5.802   3.171   4.085
  451    HD2  PHE  58           2HD      PHE  58   8.490   6.298   3.033
  452    HE1  PHE  58           1HE      PHE  58   7.624   1.987   5.233
  453    HE2  PHE  58           2HE      PHE  58  10.319   5.118   4.180
  454    HZ   PHE  58           HZ       PHE  58   9.888   2.958   5.282
  455    H    VAL  59           HN       VAL  59   6.614   6.704   0.004
  456    HA   VAL  59           HA       VAL  59   8.989   5.060  -0.594
  457    HB   VAL  59           HB       VAL  59   7.811   7.060  -2.521
  458   HG11  VAL  59          1HG1      VAL  59   9.988   5.000  -2.822
  459   HG12  VAL  59          2HG1      VAL  59  10.191   6.752  -2.788
  460   HG13  VAL  59          3HG1      VAL  59   9.342   5.987  -4.132
  461   HG21  VAL  59          3HG2      VAL  59   7.585   4.052  -2.589
  462   HG22  VAL  59          1HG2      VAL  59   7.086   5.147  -3.880
  463   HG23  VAL  59          2HG2      VAL  59   6.264   5.189  -2.320
  464    H    ASP  60           HN       ASP  60  10.915   6.081  -0.331
  465    HA   ASP  60           HA       ASP  60  10.804   8.755   0.851
  466    HB2  ASP  60           2HB      ASP  60  12.054   6.977   2.056
  467    HB3  ASP  60           1HB      ASP  60  13.148   6.844   0.682
  468    H    LEU  61           HN       LEU  61  11.005  10.394  -0.490
  469    HA   LEU  61           HA       LEU  61  12.877  10.125  -2.742
  470    HB2  LEU  61           2HB      LEU  61  10.163  11.443  -2.717
  471    HB3  LEU  61           1HB      LEU  61  11.319  11.597  -4.029
  472    HG   LEU  61           HG       LEU  61  10.144   8.971  -3.107
  473   HD11  LEU  61          1HD1      LEU  61   8.813   9.058  -5.146
  474   HD12  LEU  61          2HD1      LEU  61   9.440  10.672  -5.489
  475   HD13  LEU  61          3HD1      LEU  61   8.424  10.402  -4.072
  476   HD21  LEU  61          3HD2      LEU  61  12.338   8.750  -4.144
  477   HD22  LEU  61          1HD2      LEU  61  11.793   9.707  -5.522
  478   HD23  LEU  61          2HD2      LEU  61  11.082   8.125  -5.213
  479    H    THR  62           HN       THR  62  13.649  11.086  -0.313
  480    HA   THR  62           HA       THR  62  13.408  13.874   0.029
  481    HB   THR  62           HB       THR  62  15.555  13.540   1.413
  482    HG1  THR  62           1HG      THR  62  14.940  10.785   1.272
  483   HG21  THR  62          3HG2      THR  62  13.098  11.909   2.053
  484   HG22  THR  62          1HG2      THR  62  13.307  13.629   2.383
  485   HG23  THR  62          2HG2      THR  62  14.315  12.440   3.213
  486    H    GLU  63           HN       GLU  63  15.422  11.956  -2.023
  487    HA   GLU  63           HA       GLU  63  17.194  14.211  -2.590
  488    HB2  GLU  63           2HB      GLU  63  17.350  11.322  -3.449
  489    HB3  GLU  63           1HB      GLU  63  18.525  12.549  -3.853
  490    HG2  GLU  63           2HG      GLU  63  18.948  12.853  -1.462
  491    HG3  GLU  63           1HG      GLU  63  17.867  11.511  -1.138
  492    H    ALA  64           HN       ALA  64  14.262  13.409  -3.587
  493    HA   ALA  64           HA       ALA  64  14.679  13.312  -6.439
  494    HB1  ALA  64           1HB      ALA  64  12.119  13.601  -4.882
  495    HB2  ALA  64           2HB      ALA  64  12.834  12.080  -5.418
  496    HB3  ALA  64           3HB      ALA  64  12.257  13.251  -6.606
  497    H    GLY  65           HN       GLY  65  15.223  15.045  -7.513
  498    HA2  GLY  65           2HA      GLY  65  13.576  17.424  -7.340
  499    HA3  GLY  65           1HA      GLY  65  15.271  17.652  -6.947
  500    H    GLU  66           HN       GLU  66  13.040  16.632  -9.411
  501    HA   GLU  66           HA       GLU  66  14.476  17.652 -11.596
  502    HB2  GLU  66           2HB      GLU  66  15.827  15.530 -10.714
  503    HB3  GLU  66           1HB      GLU  66  14.606  14.659 -11.626
  504    HG2  GLU  66           2HG      GLU  66  15.740  16.817 -13.174
  505    HG3  GLU  66           1HG      GLU  66  16.982  15.713 -12.585
  506    H    GLY  67           HN       GLY  67  13.582  15.876 -13.613
  507    HA2  GLY  67           2HA      GLY  67  10.772  16.337 -13.599
  508    HA3  GLY  67           1HA      GLY  67  11.664  15.396 -14.787
  509    H    SER  68           HN       SER  68   9.744  14.025 -14.711
  510    HA   SER  68           HA       SER  68   8.960  12.614 -12.405
  511    HB2  SER  68           2HB      SER  68   7.564  12.792 -14.413
  512    HB3  SER  68           1HB      SER  68   8.700  11.781 -15.294
  513    HG   SER  68           HG       SER  68   6.643  11.040 -13.787
  514    H    HIS  69           HN       HIS  69   9.592  10.775 -11.519
  515    HA   HIS  69           HA       HIS  69  11.799   9.281 -12.753
  516    HB2  HIS  69           2HB      HIS  69  11.774  10.606 -10.085
  517    HB3  HIS  69           1HB      HIS  69  12.562   9.036 -10.213
  518    HD1  HIS  69           1HD      HIS  69  14.932   9.079 -10.920
  519    HD2  HIS  69           2HD      HIS  69  12.910  12.537 -12.052
  520    HE1  HIS  69           1HE      HIS  69  16.674  10.587 -11.924
  521    HE2  HIS  69           2HE      HIS  69  15.395  12.577 -12.793
  522    H    THR  70           HN       THR  70  11.613   7.159 -12.671
  523    HA   THR  70           HA       THR  70   9.315   6.042 -11.245
  524    HB   THR  70           HB       THR  70  11.046   4.739 -13.357
  525    HG1  THR  70           1HG      THR  70   9.596   6.740 -13.825
  526   HG21  THR  70          3HG2      THR  70   9.169   3.186 -13.580
  527   HG22  THR  70          1HG2      THR  70   8.309   4.031 -12.294
  528   HG23  THR  70          2HG2      THR  70   9.803   3.169 -11.938
  529    H    VAL  71           HN       VAL  71   9.647   5.075  -9.367
  530    HA   VAL  71           HA       VAL  71  12.214   3.720  -8.865
  531    HB   VAL  71           HB       VAL  71  12.149   4.501  -6.516
  532   HG11  VAL  71          1HG1      VAL  71  12.169   6.732  -8.548
  533   HG12  VAL  71          2HG1      VAL  71  13.531   5.690  -8.137
  534   HG13  VAL  71          3HG1      VAL  71  12.877   6.802  -6.934
  535   HG21  VAL  71          3HG2      VAL  71  10.685   6.384  -5.905
  536   HG22  VAL  71          1HG2      VAL  71   9.761   4.938  -6.308
  537   HG23  VAL  71          2HG2      VAL  71   9.885   6.258  -7.471
  538    H    ASP  72           HN       ASP  72  12.055   2.223  -6.936
  539    HA   ASP  72           HA       ASP  72   9.646   0.642  -7.165
  540    HB2  ASP  72           2HB      ASP  72  12.130   0.219  -5.484
  541    HB3  ASP  72           1HB      ASP  72  10.803  -0.927  -5.622
  542    H    VAL  73           HN       VAL  73   8.257   0.121  -5.457
  543    HA   VAL  73           HA       VAL  73   7.952   2.292  -3.535
  544    HB   VAL  73           HB       VAL  73   6.091   0.008  -4.216
  545   HG11  VAL  73          1HG1      VAL  73   5.714   0.820  -1.956
  546   HG12  VAL  73          2HG1      VAL  73   4.389   1.297  -3.020
  547   HG13  VAL  73          3HG1      VAL  73   5.616   2.476  -2.554
  548   HG21  VAL  73          3HG2      VAL  73   6.428   1.553  -6.078
  549   HG22  VAL  73          1HG2      VAL  73   6.019   2.912  -5.031
  550   HG23  VAL  73          2HG2      VAL  73   4.799   1.698  -5.418
  551    H    GLU  74           HN       GLU  74   8.222   2.114  -1.381
  552    HA   GLU  74           HA       GLU  74   9.066  -0.485  -0.339
  553    HB2  GLU  74           2HB      GLU  74   9.937   2.230   0.170
  554    HB3  GLU  74           1HB      GLU  74   9.538   1.383   1.662
  555    HG2  GLU  74           2HG      GLU  74  11.595   0.695  -0.398
  556    HG3  GLU  74           1HG      GLU  74  11.785   0.904   1.345
  557    H    HIS  75           HN       HIS  75   8.427  -1.094   1.827
  558    HA   HIS  75           HA       HIS  75   5.723  -0.183   2.522
  559    HB2  HIS  75           2HB      HIS  75   5.028  -2.642   2.582
  560    HB3  HIS  75           1HB      HIS  75   5.213  -1.919   0.987
  561    HD1  HIS  75           1HD      HIS  75   7.195  -2.744  -0.473
  562    HD2  HIS  75           2HD      HIS  75   6.904  -4.653   3.210
  563    HE1  HIS  75           1HE      HIS  75   8.716  -4.734  -0.625
  564    HE2  HIS  75           2HE      HIS  75   8.695  -5.732   1.686
  565    H    ARG  76           HN       ARG  76   5.104  -0.605   4.644
  566    HA   ARG  76           HA       ARG  76   6.827  -2.251   6.332
  567    HB2  ARG  76           2HB      ARG  76   6.220   0.655   6.871
  568    HB3  ARG  76           1HB      ARG  76   6.705  -0.457   8.142
  569    HG2  ARG  76           2HG      ARG  76   8.751  -0.931   6.688
  570    HG3  ARG  76           1HG      ARG  76   8.290   0.524   5.799
  571    HD2  ARG  76           2HD      ARG  76   8.855   0.361   8.759
  572    HD3  ARG  76           1HD      ARG  76   9.949   1.001   7.536
  573    HE   ARG  76           HE       ARG  76   7.337   2.271   7.743
  574   HH11  ARG  76          1HH1      ARG  76  10.756   2.342   8.479
  575   HH12  ARG  76          2HH1      ARG  76  10.763   4.022   8.921
  576   HH21  ARG  76          1HH2      ARG  76   7.324   4.479   8.283
  577   HH22  ARG  76          2HH2      ARG  76   8.800   5.247   8.815
  578    H    GLY  77           HN       GLY  77   5.809  -2.624   8.495
  579    HA2  GLY  77           2HA      GLY  77   3.832  -2.609   9.858
  580    HA3  GLY  77           1HA      GLY  77   2.879  -2.379   8.398
  581    H    PHE  78           HN       PHE  78   3.026  -4.197   6.789
  582    HA   PHE  78           HA       PHE  78   2.606  -6.690   8.153
  583    HB2  PHE  78           2HB      PHE  78   2.274  -7.535   5.743
  584    HB3  PHE  78           1HB      PHE  78   1.109  -6.382   6.381
  585    HD1  PHE  78           1HD      PHE  78   3.945  -6.819   4.071
  586    HD2  PHE  78           2HD      PHE  78   0.869  -4.218   5.436
  587    HE1  PHE  78           1HE      PHE  78   4.322  -5.357   2.130
  588    HE2  PHE  78           2HE      PHE  78   1.241  -2.750   3.499
  589    HZ   PHE  78           HZ       PHE  78   2.968  -3.321   1.845
  590    HA   PRO  79           HA       PRO  79   6.635  -8.277   8.068
  591    HB2  PRO  79           2HB      PRO  79   5.544 -10.948   7.490
  592    HB3  PRO  79           1HB      PRO  79   6.405 -10.374   8.920
  593    HG2  PRO  79           2HG      PRO  79   3.778 -10.899   8.986
  594    HG3  PRO  79           1HG      PRO  79   4.489  -9.567   9.918
  595    HD2  PRO  79           2HD      PRO  79   2.985  -9.482   7.328
  596    HD3  PRO  79           1HD      PRO  79   2.882  -8.390   8.727
  597    H    GLY  80           HN       GLY  80   8.130  -8.148   6.562
  598    HA2  GLY  80           2HA      GLY  80   7.651  -8.814   3.803
  599    HA3  GLY  80           1HA      GLY  80   9.187  -8.327   4.511
  600    H    ASP  81           HN       ASP  81   8.218 -10.653   6.474
  601    HA   ASP  81           HA       ASP  81   9.879 -12.719   5.506
  602    HB2  ASP  81           2HB      ASP  81   9.197 -12.372   7.897
  603    HB3  ASP  81           1HB      ASP  81   7.593 -12.935   7.464
  604    H    LEU  82           HN       LEU  82   6.610 -11.836   4.964
  605    HA   LEU  82           HA       LEU  82   5.827 -14.409   3.869
  606    HB2  LEU  82           2HB      LEU  82   4.297 -11.806   3.929
  607    HB3  LEU  82           1HB      LEU  82   3.640 -13.407   3.647
  608    HG   LEU  82           HG       LEU  82   4.856 -12.469   6.247
  609   HD11  LEU  82          1HD1      LEU  82   1.972 -12.865   5.466
  610   HD12  LEU  82          2HD1      LEU  82   2.767 -11.321   5.773
  611   HD13  LEU  82          3HD1      LEU  82   2.559 -12.480   7.083
  612   HD21  LEU  82          3HD2      LEU  82   5.111 -14.857   5.925
  613   HD22  LEU  82          1HD2      LEU  82   3.400 -15.008   5.522
  614   HD23  LEU  82          2HD2      LEU  82   3.885 -14.535   7.151
  615    H    ALA  83           HN       ALA  83   4.523 -14.169   1.701
  616    HA   ALA  83           HA       ALA  83   6.283 -12.968  -0.253
  617    HB1  ALA  83           1HB      ALA  83   5.251 -15.145  -0.712
  618    HB2  ALA  83           2HB      ALA  83   4.775 -13.942  -1.911
  619    HB3  ALA  83           3HB      ALA  83   3.653 -14.404  -0.630
  620    H    VAL  84           HN       VAL  84   6.187 -10.826  -0.338
  621    HA   VAL  84           HA       VAL  84   3.655  -9.466   0.146
  622    HB   VAL  84           HB       VAL  84   6.452  -8.343  -0.090
  623   HG11  VAL  84          1HG1      VAL  84   5.501  -6.291   0.840
  624   HG12  VAL  84          2HG1      VAL  84   3.892  -7.013   0.795
  625   HG13  VAL  84          3HG1      VAL  84   4.762  -6.700  -0.709
  626   HG21  VAL  84          3HG2      VAL  84   4.751  -8.862   2.347
  627   HG22  VAL  84          1HG2      VAL  84   6.330  -8.074   2.338
  628   HG23  VAL  84          2HG2      VAL  84   6.186  -9.767   1.869
  629    H    THR  85           HN       THR  85   2.429  -9.091  -1.578
  630    HA   THR  85           HA       THR  85   3.787  -8.403  -4.088
  631    HB   THR  85           HB       THR  85   0.875  -8.998  -3.971
  632    HG1  THR  85           1HG      THR  85   1.618 -10.800  -2.940
  633   HG21  THR  85          3HG2      THR  85   1.323  -9.908  -6.206
  634   HG22  THR  85          1HG2      THR  85   3.039  -9.543  -6.000
  635   HG23  THR  85          2HG2      THR  85   1.858  -8.232  -6.063
  636    H    VAL  86           HN       VAL  86   3.788  -6.415  -4.641
  637    HA   VAL  86           HA       VAL  86   1.540  -4.610  -3.990
  638    HB   VAL  86           HB       VAL  86   3.913  -3.150  -4.645
  639   HG11  VAL  86          1HG1      VAL  86   2.369  -3.342  -2.047
  640   HG12  VAL  86          2HG1      VAL  86   2.040  -2.239  -3.384
  641   HG13  VAL  86          3HG1      VAL  86   3.530  -2.078  -2.454
  642   HG21  VAL  86          3HG2      VAL  86   5.297  -3.677  -2.619
  643   HG22  VAL  86          1HG2      VAL  86   5.307  -4.905  -3.888
  644   HG23  VAL  86          2HG2      VAL  86   4.341  -5.148  -2.426
  645    H    GLU  87           HN       GLU  87   0.550  -4.215  -6.114
  646    HA   GLU  87           HA       GLU  87   2.695  -4.102  -8.117
  647    HB2  GLU  87           2HB      GLU  87   0.414  -5.782  -7.995
  648    HB3  GLU  87           1HB      GLU  87   0.299  -4.767  -9.423
  649    HG2  GLU  87           2HG      GLU  87   2.832  -6.222  -8.806
  650    HG3  GLU  87           1HG      GLU  87   1.483  -7.055  -9.576
  651    HA   PRO  88           HA       PRO  88   2.533  -1.717 -10.506
  652    HB2  PRO  88           2HB      PRO  88   3.541   0.708  -9.719
  653    HB3  PRO  88           1HB      PRO  88   1.872   0.474 -10.222
  654    HG2  PRO  88           2HG      PRO  88   2.827   1.190  -7.617
  655    HG3  PRO  88           1HG      PRO  88   1.148   0.879  -8.093
  656    HD2  PRO  88           2HD      PRO  88   3.136  -0.980  -6.840
  657    HD3  PRO  88           1HD      PRO  88   1.365  -0.926  -6.652
  658    H    ARG  89           HN       ARG  89   4.640  -2.433 -10.956
  659    HA   ARG  89           HA       ARG  89   6.166  -3.298  -8.689
  660    HB2  ARG  89           2HB      ARG  89   6.811  -3.277 -11.642
  661    HB3  ARG  89           1HB      ARG  89   7.952  -3.852 -10.433
  662    HG2  ARG  89           2HG      ARG  89   6.089  -5.393  -9.664
  663    HG3  ARG  89           1HG      ARG  89   5.296  -4.998 -11.189
  664    HD2  ARG  89           2HD      ARG  89   7.312  -5.701 -12.387
  665    HD3  ARG  89           1HD      ARG  89   8.050  -6.170 -10.861
  666    HE   ARG  89           HE       ARG  89   5.559  -7.474 -11.205
  667   HH11  ARG  89          1HH1      ARG  89   8.859  -7.481 -12.369
  668   HH12  ARG  89          2HH1      ARG  89   8.860  -9.183 -12.741
  669   HH21  ARG  89          1HH2      ARG  89   5.536  -9.693 -11.711
  670   HH22  ARG  89          2HH2      ARG  89   6.954 -10.446 -12.384
  671    H    MET  90           HN       MET  90   6.691  -0.904 -11.186
  672    HA   MET  90           HA       MET  90   8.304   0.627  -9.264
  673    HB2  MET  90           2HB      MET  90   8.705   0.479 -12.269
  674    HB3  MET  90           1HB      MET  90   9.597   1.522 -11.168
  675    HG2  MET  90           2HG      MET  90  10.588  -0.375 -10.083
  676    HG3  MET  90           1HG      MET  90   9.603  -1.484 -11.032
  677    HE1  MET  90           3HE      MET  90  11.348   1.799 -12.269
  678    HE2  MET  90           1HE      MET  90  12.896   1.188 -12.852
  679    HE3  MET  90           2HE      MET  90  12.526   1.149 -11.127
  680    H    ALA  91           HN       ALA  91   7.676   2.728  -9.018
  681    HA   ALA  91           HA       ALA  91   5.376   3.588 -10.659
  682    HB1  ALA  91           1HB      ALA  91   4.665   2.938  -8.406
  683    HB2  ALA  91           2HB      ALA  91   4.452   4.665  -8.671
  684    HB3  ALA  91           3HB      ALA  91   5.808   4.084  -7.709
  685    H    ARG  92           HN       ARG  92   5.260   5.791 -11.174
  686    HA   ARG  92           HA       ARG  92   7.807   7.190 -10.797
  687    HB2  ARG  92           2HB      ARG  92   7.216   8.524 -12.770
  688    HB3  ARG  92           1HB      ARG  92   7.289   6.810 -13.129
  689    HG2  ARG  92           2HG      ARG  92   4.906   6.654 -13.204
  690    HG3  ARG  92           1HG      ARG  92   4.727   8.312 -12.625
  691    HD2  ARG  92           2HD      ARG  92   5.798   9.147 -14.651
  692    HD3  ARG  92           1HD      ARG  92   6.043   7.497 -15.217
  693    HE   ARG  92           HE       ARG  92   3.341   7.716 -14.809
  694   HH11  ARG  92          1HH1      ARG  92   5.676   9.533 -16.671
  695   HH12  ARG  92          2HH1      ARG  92   4.573   9.896 -17.956
  696   HH21  ARG  92          1HH2      ARG  92   1.869   8.192 -16.504
  697   HH22  ARG  92          2HH2      ARG  92   2.425   9.100 -17.883
  698    H    VAL  93           HN       VAL  93   7.921   8.918  -9.644
  699    HA   VAL  93           HA       VAL  93   5.475  10.463  -9.090
  700    HB   VAL  93           HB       VAL  93   7.757   9.978  -7.155
  701   HG11  VAL  93          1HG1      VAL  93   6.763  12.198  -6.912
  702   HG12  VAL  93          2HG1      VAL  93   6.383  11.177  -5.526
  703   HG13  VAL  93          3HG1      VAL  93   5.164  11.471  -6.763
  704   HG21  VAL  93          3HG2      VAL  93   6.138   8.736  -5.809
  705   HG22  VAL  93          1HG2      VAL  93   6.364   7.993  -7.392
  706   HG23  VAL  93          2HG2      VAL  93   4.919   8.953  -7.067
  707    H    GLN  94           HN       GLN  94   5.688  12.649  -9.369
  708    HA   GLN  94           HA       GLN  94   8.368  13.552 -10.200
  709    HB2  GLN  94           2HB      GLN  94   6.914  13.482 -12.113
  710    HB3  GLN  94           1HB      GLN  94   5.652  14.345 -11.246
  711    HG2  GLN  94           2HG      GLN  94   6.924  16.358 -11.243
  712    HG3  GLN  94           1HG      GLN  94   8.334  15.531 -11.900
  713   HE21  GLN  94          1HE2      GLN  94   6.899  17.819 -12.931
  714   HE22  GLN  94          2HE2      GLN  94   6.350  17.375 -14.505
  715    H    LEU  95           HN       LEU  95   9.249  14.908  -8.844
  716    HA   LEU  95           HA       LEU  95   7.536  16.822  -7.405
  717    HB2  LEU  95           2HB      LEU  95  10.358  15.910  -6.796
  718    HB3  LEU  95           1HB      LEU  95   9.470  17.116  -5.885
  719    HG   LEU  95           HG       LEU  95   8.722  14.199  -6.129
  720   HD11  LEU  95          1HD1      LEU  95   9.327  14.091  -3.758
  721   HD12  LEU  95          2HD1      LEU  95   9.856  15.773  -3.819
  722   HD13  LEU  95          3HD1      LEU  95  10.707  14.547  -4.758
  723   HD21  LEU  95          3HD2      LEU  95   7.474  16.432  -4.530
  724   HD22  LEU  95          1HD2      LEU  95   7.052  14.725  -4.404
  725   HD23  LEU  95          2HD2      LEU  95   6.750  15.599  -5.905
  726    H    GLU  96           HN       GLU  96   7.689  18.904  -7.984
  727    HA   GLU  96           HA       GLU  96   9.799  19.595  -9.912
  728    HB2  GLU  96           2HB      GLU  96   7.784  18.926 -11.117
  729    HB3  GLU  96           1HB      GLU  96   6.842  20.107 -10.217
  730    HG2  GLU  96           2HG      GLU  96   7.950  21.915 -11.277
  731    HG3  GLU  96           1HG      GLU  96   9.150  20.838 -11.993
  732    H    GLU  97           HN       GLU  97  10.435  21.704  -9.992
  733    HA   GLU  97           HA       GLU  97  10.069  23.254  -7.645
  734    HB2  GLU  97           2HB      GLU  97  11.364  24.981  -9.163
  735    HB3  GLU  97           1HB      GLU  97  12.175  23.602  -8.451
  736    HG2  GLU  97           2HG      GLU  97  12.922  23.788 -10.686
  737    HG3  GLU  97           1HG      GLU  97  11.855  22.395 -10.614
  738    H    ARG  98           HN       ARG  98   7.668  23.247  -7.943
  739    HA   ARG  98           HA       ARG  98   6.845  25.794  -9.069
  740    HB2  ARG  98           2HB      ARG  98   6.610  23.734 -10.752
  741    HB3  ARG  98           1HB      ARG  98   5.147  23.454  -9.817
  742    HG2  ARG  98           2HG      ARG  98   4.669  24.757 -11.804
  743    HG3  ARG  98           1HG      ARG  98   4.378  25.715 -10.351
  744    HD2  ARG  98           2HD      ARG  98   5.595  26.889 -12.228
  745    HD3  ARG  98           1HD      ARG  98   6.373  26.946 -10.646
  746    HE   ARG  98           HE       ARG  98   7.886  25.205 -11.431
  747   HH11  ARG  98          1HH1      ARG  98   6.062  26.961 -13.861
  748   HH12  ARG  98          2HH1      ARG  98   7.168  26.568 -15.145
  749   HH21  ARG  98          1HH2      ARG  98   9.330  24.682 -13.116
  750   HH22  ARG  98          2HH2      ARG  98   9.031  25.304 -14.717
  751    H    GLN  99           HN       GLN  99   4.447  26.155  -8.460
  752    HA   GLN  99           HA       GLN  99   3.997  25.056  -5.813
  753    HB2  GLN  99           2HB      GLN  99   2.496  26.974  -5.587
  754    HB3  GLN  99           1HB      GLN  99   4.126  27.468  -5.971
  755    HG2  GLN  99           2HG      GLN  99   3.477  27.840  -8.278
  756    HG3  GLN  99           1HG      GLN  99   1.846  27.267  -7.931
  757   HE21  GLN  99          1HE2      GLN  99   0.468  28.554  -6.688
  758   HE22  GLN  99          2HE2      GLN  99   0.763  30.242  -6.451
  759    H    THR 100           HN       THR 100   1.941  24.301  -5.207
  760    HA   THR 100           HA       THR 100  -0.183  23.536  -5.363
  761    HB   THR 100           HB       THR 100  -0.212  24.837  -8.090
  762    HG1  THR 100           1HG      THR 100  -0.768  25.713  -5.458
  763   HG21  THR 100          3HG2      THR 100  -2.498  23.866  -6.366
  764   HG22  THR 100          1HG2      THR 100  -1.944  23.108  -7.858
  765   HG23  THR 100          2HG2      THR 100  -2.648  24.724  -7.899
  766    H    VAL 101           HN       VAL 101  -0.474  21.455  -5.432
  767    HA   VAL 101           HA       VAL 101   0.710  19.677  -7.271
  768    HB   VAL 101           HB       VAL 101  -1.740  19.234  -5.543
  769   HG11  VAL 101          1HG1      VAL 101  -1.229  16.843  -5.781
  770   HG12  VAL 101          2HG1      VAL 101   0.058  17.242  -6.921
  771   HG13  VAL 101          3HG1      VAL 101  -1.623  17.596  -7.330
  772   HG21  VAL 101          3HG2      VAL 101   1.158  18.571  -5.029
  773   HG22  VAL 101          1HG2      VAL 101  -0.200  18.166  -3.978
  774   HG23  VAL 101          2HG2      VAL 101   0.235  19.854  -4.247
  775    H    SER 102           HN       SER 102   0.317  20.023  -9.369
  776    HA   SER 102           HA       SER 102  -2.486  19.998 -10.245
  777    HB2  SER 102           2HB      SER 102  -1.425  21.196 -12.336
  778    HB3  SER 102           1HB      SER 102  -1.836  22.122 -10.891
  779    HG   SER 102           HG       SER 102   0.361  21.940 -10.245
  780    H    VAL 103           HN       VAL 103  -2.732  17.883 -10.686
  781    HA   VAL 103           HA       VAL 103  -0.701  16.552 -12.318
  782    HB   VAL 103           HB       VAL 103  -1.279  15.362 -10.289
  783   HG11  VAL 103          1HG1      VAL 103  -3.501  16.229  -9.907
  784   HG12  VAL 103          2HG1      VAL 103  -3.524  14.463  -9.904
  785   HG13  VAL 103          3HG1      VAL 103  -4.109  15.351 -11.312
  786   HG21  VAL 103          3HG2      VAL 103  -1.948  13.188 -11.228
  787   HG22  VAL 103          1HG2      VAL 103  -0.713  13.992 -12.197
  788   HG23  VAL 103          2HG2      VAL 103  -2.394  13.995 -12.735
  789    HA   PRO 104           HA       PRO 104  -3.550  16.887 -15.747
  790    HB2  PRO 104           2HB      PRO 104  -1.866  16.043 -17.645
  791    HB3  PRO 104           1HB      PRO 104  -1.671  17.630 -16.890
  792    HG2  PRO 104           2HG      PRO 104  -0.186  15.087 -16.372
  793    HG3  PRO 104           1HG      PRO 104   0.431  16.746 -16.461
  794    HD2  PRO 104           2HD      PRO 104  -0.127  15.395 -14.114
  795    HD3  PRO 104           1HD      PRO 104  -0.052  17.159 -14.273
  796    H    VAL 105           HN       VAL 105  -4.294  15.364 -17.478
  797    HA   VAL 105           HA       VAL 105  -4.715  12.727 -16.396
  798    HB   VAL 105           HB       VAL 105  -5.472  13.797 -19.129
  799   HG11  VAL 105          1HG1      VAL 105  -7.130  11.969 -19.107
  800   HG12  VAL 105          2HG1      VAL 105  -6.443  11.383 -17.594
  801   HG13  VAL 105          3HG1      VAL 105  -5.472  11.371 -19.066
  802   HG21  VAL 105          3HG2      VAL 105  -6.468  15.133 -17.353
  803   HG22  VAL 105          1HG2      VAL 105  -7.081  13.673 -16.581
  804   HG23  VAL 105          2HG2      VAL 105  -7.698  14.159 -18.161
  805    H    THR 106           HN       THR 106  -3.040  11.390 -16.415
  806    HA   THR 106           HA       THR 106  -0.932  11.593 -18.315
  807    HB   THR 106           HB       THR 106  -0.075   9.504 -17.210
  808    HG1  THR 106           1HG      THR 106  -1.285   8.480 -15.794
  809   HG21  THR 106          3HG2      THR 106  -0.824  11.811 -15.414
  810   HG22  THR 106          1HG2      THR 106   0.610  11.705 -16.433
  811   HG23  THR 106          2HG2      THR 106   0.419  10.610 -15.061
  812    H    VAL 107           HN       VAL 107  -0.397  10.284 -19.994
  813    HA   VAL 107           HA       VAL 107  -2.344   8.212 -20.740
  814    HB   VAL 107           HB       VAL 107  -2.784  10.234 -22.071
  815   HG11  VAL 107          1HG1      VAL 107   0.034   9.899 -23.086
  816   HG12  VAL 107          2HG1      VAL 107  -0.560  11.219 -22.077
  817   HG13  VAL 107          3HG1      VAL 107  -1.165  11.024 -23.723
  818   HG21  VAL 107          3HG2      VAL 107  -2.751   9.201 -24.265
  819   HG22  VAL 107          1HG2      VAL 107  -3.202   8.022 -23.034
  820   HG23  VAL 107          2HG2      VAL 107  -1.570   8.013 -23.710
  821    H    GLU 108           HN       GLU 108  -1.473   6.354 -21.584
  822    HA   GLU 108           HA       GLU 108   1.425   6.112 -21.265
  823    HB2  GLU 108           2HB      GLU 108  -0.178   4.521 -20.137
  824    HB3  GLU 108           1HB      GLU 108  -0.610   3.923 -21.731
  825    HG2  GLU 108           2HG      GLU 108   0.967   2.423 -20.768
  826    HG3  GLU 108           1HG      GLU 108   1.763   3.294 -22.078
  827    H    MET 109           HN       MET 109  -0.929   4.639 -23.467
  828    HA   MET 109           HA       MET 109  -0.965   4.249 -25.691
  829    HB2  MET 109           2HB      MET 109   0.909   6.609 -25.737
  830    HB3  MET 109           1HB      MET 109   0.331   5.815 -27.195
  831    HG2  MET 109           2HG      MET 109  -1.972   6.314 -26.557
  832    HG3  MET 109           1HG      MET 109  -1.385   7.135 -25.111
  833    HE1  MET 109           3HE      MET 109  -0.455   8.595 -29.389
  834    HE2  MET 109           1HE      MET 109  -1.408   7.146 -29.047
  835    HE3  MET 109           2HE      MET 109   0.310   7.191 -28.644
  836    H    ILE 110           HN       ILE 110   0.010   3.016 -27.256
  837    HA   ILE 110           HA       ILE 110   2.733   2.111 -26.588
  838    HB   ILE 110           HB       ILE 110   1.012   0.371 -26.291
  839   HG12  ILE 110          2HG1      ILE 110   3.402  -0.113 -27.129
  840   HG13  ILE 110          1HG1      ILE 110   2.208  -1.393 -27.254
  841   HG21  ILE 110          1HG2      ILE 110  -0.141  -0.601 -28.222
  842   HG22  ILE 110          2HG2      ILE 110   0.502   0.688 -29.239
  843   HG23  ILE 110          3HG2      ILE 110  -0.610   1.074 -27.925
  844   HD11  ILE 110          3HD1      ILE 110   1.926  -0.893 -29.631
  845   HD12  ILE 110          1HD1      ILE 110   3.600  -1.289 -29.233
  846   HD13  ILE 110          2HD1      ILE 110   3.132   0.392 -29.497
  847    H    ASN 111           HN       ASN 111   4.272   2.496 -28.023
  848    HA   ASN 111           HA       ASN 111   3.501   3.029 -30.810
  849    HB2  ASN 111           2HB      ASN 111   3.787   5.194 -29.660
  850    HB3  ASN 111           1HB      ASN 111   5.415   4.719 -29.183
  851   HD21  ASN 111          1HD2      ASN 111   3.348   5.606 -31.843
  852   HD22  ASN 111          2HD2      ASN 111   4.626   6.020 -32.944
  853    H    LEU 112           HN       LEU 112   4.708   1.964 -32.227
  854    HA   LEU 112           HA       LEU 112   7.442   1.225 -31.612
  855    HB2  LEU 112           2HB      LEU 112   5.942  -0.567 -30.657
  856    HB3  LEU 112           1HB      LEU 112   5.391  -0.892 -32.287
  857    HG   LEU 112           HG       LEU 112   8.311  -1.087 -31.603
  858   HD11  LEU 112          1HD1      LEU 112   7.987  -3.456 -31.131
  859   HD12  LEU 112          2HD1      LEU 112   6.242  -3.251 -31.267
  860   HD13  LEU 112          3HD1      LEU 112   7.123  -2.454 -29.964
  861   HD21  LEU 112          3HD2      LEU 112   7.705  -1.140 -33.960
  862   HD22  LEU 112          1HD2      LEU 112   6.552  -2.438 -33.649
  863   HD23  LEU 112          2HD2      LEU 112   8.278  -2.724 -33.434
  864    H    GLU 113           HN       GLU 113   8.556   1.696 -33.382
  865    HA   GLU 113           HA       GLU 113   7.744   0.740 -35.953
  866    HB2  GLU 113           2HB      GLU 113   6.394   2.822 -35.819
  867    HB3  GLU 113           1HB      GLU 113   7.874   3.741 -35.577
  868    HG2  GLU 113           2HG      GLU 113   8.674   3.013 -37.778
  869    HG3  GLU 113           1HG      GLU 113   7.172   2.122 -38.020
  870    H    HIS 114           HN       HIS 114   9.682  -0.241 -36.181
  871    HA   HIS 114           HA       HIS 114  12.008   1.557 -36.368
  872    HB2  HIS 114           2HB      HIS 114  11.852  -1.332 -35.523
  873    HB3  HIS 114           1HB      HIS 114  13.355  -0.625 -36.110
  874    HD1  HIS 114           1HD      HIS 114  11.663  -1.271 -33.040
  875    HD2  HIS 114           2HD      HIS 114  13.932   1.886 -34.522
  876    HE1  HIS 114           1HE      HIS 114  12.454   0.008 -31.024
  877    HE2  HIS 114           2HE      HIS 114  13.679   2.009 -31.955
  878    H    HIS 115           HN       HIS 115  11.504   2.112 -38.475
  879    HA   HIS 115           HA       HIS 115  11.551  -0.083 -40.445
  880    HB2  HIS 115           2HB      HIS 115   9.445   1.293 -40.250
  881    HB3  HIS 115           1HB      HIS 115  10.371   2.685 -40.798
  882    HD1  HIS 115           1HD      HIS 115  10.028   3.125 -43.193
  883    HD2  HIS 115           2HD      HIS 115   9.787  -0.937 -42.332
  884    HE1  HIS 115           1HE      HIS 115   9.518   1.997 -45.382
  885    HE2  HIS 115           2HE      HIS 115   9.467  -0.469 -44.858
  886    H    HIS 116           HN       HIS 116  13.893   1.306 -39.265
  887    HA   HIS 116           HA       HIS 116  14.972   3.022 -41.280
  888    HB2  HIS 116           2HB      HIS 116  16.054   1.653 -38.858
  889    HB3  HIS 116           1HB      HIS 116  17.195   2.230 -40.065
  890    HD1  HIS 116           1HD      HIS 116  14.783   3.447 -37.453
  891    HD2  HIS 116           2HD      HIS 116  17.445   5.001 -40.253
  892    HE1  HIS 116           1HE      HIS 116  15.056   5.879 -36.863
  893    HE2  HIS 116           2HE      HIS 116  16.810   6.744 -38.458
  894    H    HIS 117           HN       HIS 117  15.292   2.309 -43.279
  895    HA   HIS 117           HA       HIS 117  16.845  -0.167 -43.597
  896    HB2  HIS 117           2HB      HIS 117  14.440  -0.540 -44.201
  897    HB3  HIS 117           1HB      HIS 117  14.605   0.701 -45.440
  898    HD1  HIS 117           1HD      HIS 117  15.415  -2.855 -44.694
  899    HD2  HIS 117           2HD      HIS 117  16.165  -0.057 -47.678
  900    HE1  HIS 117           1HE      HIS 117  16.254  -4.173 -46.667
  901    HE2  HIS 117           2HE      HIS 117  16.571  -2.473 -48.504
  902    H    HIS 118           HN       HIS 118  18.735   0.309 -44.480
  903    HA   HIS 118           HA       HIS 118  18.993   2.838 -45.942
  904    HB2  HIS 118           2HB      HIS 118  21.079   1.061 -44.666
  905    HB3  HIS 118           1HB      HIS 118  21.436   2.539 -45.550
  906    HD1  HIS 118           1HD      HIS 118  20.456   1.280 -42.244
  907    HD2  HIS 118           2HD      HIS 118  20.462   4.924 -44.249
  908    HE1  HIS 118           1HE      HIS 118  20.166   3.036 -40.465
  909    HE2  HIS 118           2HE      HIS 118  19.942   5.204 -41.732
  910    H    HIS 119           HN       HIS 119  20.736   2.796 -47.683
  911    HA   HIS 119           HA       HIS 119  20.771   0.276 -49.169
  912    HB2  HIS 119           2HB      HIS 119  18.876   1.673 -50.018
  913    HB3  HIS 119           1HB      HIS 119  20.037   2.932 -50.425
  914    HD1  HIS 119           1HD      HIS 119  21.437   2.612 -52.556
  915    HD2  HIS 119           2HD      HIS 119  18.938  -0.603 -51.676
  916    HE1  HIS 119           1HE      HIS 119  21.452   1.150 -54.606
  917    HE2  HIS 119           2HE      HIS 119  19.890  -0.761 -54.078
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1  -8.167 -27.030   5.587
    2    H2   MET   1           H2       MET   1  -9.634 -27.859   5.401
    3    H3   MET   1           H3       MET   1  -9.585 -26.174   5.217
    4    HA   MET   1           HA       MET   1  -9.735 -27.268   3.085
    5    HB2  MET   1           2HB      MET   1  -7.854 -26.143   2.009
    6    HB3  MET   1           1HB      MET   1  -8.535 -25.124   3.269
    7    HG2  MET   1           2HG      MET   1  -6.703 -25.968   4.777
    8    HG3  MET   1           1HG      MET   1  -5.975 -26.691   3.344
    9    HE1  MET   1           2HE      MET   1  -7.892 -23.266   3.813
   10    HE2  MET   1           3HE      MET   1  -6.531 -22.170   4.055
   11    HE3  MET   1           1HE      MET   1  -6.878 -23.425   5.246
   12    HA   PRO   2           HA       PRO   2  -7.473 -31.073   2.730
   13    HB2  PRO   2           2HB      PRO   2  -8.368 -31.693   0.208
   14    HB3  PRO   2           1HB      PRO   2  -9.316 -31.906   1.679
   15    HG2  PRO   2           2HG      PRO   2  -9.723 -30.029  -0.480
   16    HG3  PRO   2           1HG      PRO   2 -10.766 -30.366   0.907
   17    HD2  PRO   2           2HD      PRO   2  -8.896 -28.160   0.486
   18    HD3  PRO   2           1HD      PRO   2 -10.181 -28.325   1.697
   19    H    THR   3           HN       THR   3  -6.014 -28.654   2.052
   20    HA   THR   3           HA       THR   3  -4.032 -29.797   0.281
   21    HB   THR   3           HB       THR   3  -5.108 -27.048  -0.317
   22    HG1  THR   3           1HG      THR   3  -6.099 -29.480  -1.017
   23   HG21  THR   3          3HG2      THR   3  -3.268 -28.877  -1.857
   24   HG22  THR   3          1HG2      THR   3  -2.806 -27.391  -1.031
   25   HG23  THR   3          2HG2      THR   3  -3.870 -27.323  -2.437
   26    H    PHE   4           HN       PHE   4  -2.020 -28.297   0.325
   27    HA   PHE   4           HA       PHE   4  -1.143 -27.728   2.839
   28    HB2  PHE   4           2HB      PHE   4  -0.402 -26.270   0.326
   29    HB3  PHE   4           1HB      PHE   4   0.540 -26.308   1.798
   30    HD1  PHE   4           2HD      PHE   4   1.650 -28.394   2.508
   31    HD2  PHE   4           1HD      PHE   4  -0.335 -28.057  -1.241
   32    HE1  PHE   4           2HE      PHE   4   2.833 -30.396   1.705
   33    HE2  PHE   4           1HE      PHE   4   0.844 -30.057  -2.049
   34    HZ   PHE   4           HZ       PHE   4   2.429 -31.230  -0.577
   35    H    ASP   5           HN       ASP   5  -1.304 -26.059   4.260
   36    HA   ASP   5           HA       ASP   5  -3.522 -24.302   3.837
   37    HB2  ASP   5           2HB      ASP   5  -3.287 -23.775   6.178
   38    HB3  ASP   5           1HB      ASP   5  -3.188 -25.508   5.963
   39    H    HIS   6           HN       HIS   6  -1.329 -23.799   2.178
   40    HA   HIS   6           HA       HIS   6  -0.430 -21.152   3.083
   41    HB2  HIS   6           2HB      HIS   6   0.538 -22.899   0.806
   42    HB3  HIS   6           1HB      HIS   6   1.088 -21.249   1.075
   43    HD1  HIS   6           1HD      HIS   6   2.492 -24.302   1.382
   44    HD2  HIS   6           2HD      HIS   6   1.801 -21.339   4.225
   45    HE1  HIS   6           1HE      HIS   6   4.147 -24.728   3.229
   46    HE2  HIS   6           2HE      HIS   6   3.674 -22.968   4.969
   47    H    GLY   7           HN       GLY   7  -1.857 -19.626   2.559
   48    HA2  GLY   7           2HA      GLY   7  -3.192 -19.854  -0.063
   49    HA3  GLY   7           1HA      GLY   7  -4.047 -19.326   1.381
   50    H    ASN   8           HN       ASN   8  -4.429 -17.563  -0.328
   51    HA   ASN   8           HA       ASN   8  -2.316 -15.535  -0.060
   52    HB2  ASN   8           2HB      ASN   8  -4.330 -15.813  -2.296
   53    HB3  ASN   8           1HB      ASN   8  -3.114 -14.556  -2.168
   54   HD21  ASN   8          1HD2      ASN   8  -0.971 -15.047  -2.571
   55   HD22  ASN   8          2HD2      ASN   8  -0.484 -16.511  -3.359
   56    H    LEU   9           HN       LEU   9  -3.000 -13.394   0.184
   57    HA   LEU   9           HA       LEU   9  -5.802 -12.897   0.767
   58    HB2  LEU   9           2HB      LEU   9  -4.809 -13.645   2.916
   59    HB3  LEU   9           1HB      LEU   9  -3.627 -12.358   2.795
   60    HG   LEU   9           HG       LEU   9  -5.442 -10.688   2.938
   61   HD11  LEU   9          1HD1      LEU   9  -7.694 -11.415   3.581
   62   HD12  LEU   9          2HD1      LEU   9  -7.204 -13.096   3.369
   63   HD13  LEU   9          3HD1      LEU   9  -7.248 -12.009   1.981
   64   HD21  LEU   9          3HD2      LEU   9  -5.418 -12.716   5.171
   65   HD22  LEU   9          1HD2      LEU   9  -5.968 -11.046   5.301
   66   HD23  LEU   9          2HD2      LEU   9  -4.272 -11.390   4.961
   67    H    SER  10           HN       SER  10  -6.328 -11.027  -0.132
   68    HA   SER  10           HA       SER  10  -4.207  -9.248  -1.014
   69    HB2  SER  10           2HB      SER  10  -6.265  -8.157  -2.196
   70    HB3  SER  10           1HB      SER  10  -5.655  -9.705  -2.784
   71    HG   SER  10           HG       SER  10  -8.084  -9.098  -1.753
   72    H    LEU  11           HN       LEU  11  -3.928  -7.201  -0.325
   73    HA   LEU  11           HA       LEU  11  -5.431  -6.361   2.034
   74    HB2  LEU  11           2HB      LEU  11  -3.052  -5.082   0.674
   75    HB3  LEU  11           1HB      LEU  11  -3.747  -4.581   2.202
   76    HG   LEU  11           HG       LEU  11  -2.372  -7.219   1.675
   77   HD11  LEU  11          1HD1      LEU  11  -0.818  -5.360   1.715
   78   HD12  LEU  11          2HD1      LEU  11  -0.650  -6.332   3.176
   79   HD13  LEU  11          3HD1      LEU  11  -1.507  -4.791   3.235
   80   HD21  LEU  11          3HD2      LEU  11  -3.485  -6.071   4.233
   81   HD22  LEU  11          1HD2      LEU  11  -2.549  -7.558   4.087
   82   HD23  LEU  11          2HD2      LEU  11  -4.142  -7.442   3.340
   83    H    GLY  12           HN       GLY  12  -5.918  -6.191  -1.144
   84    HA2  GLY  12           2HA      GLY  12  -7.246  -4.839  -2.459
   85    HA3  GLY  12           1HA      GLY  12  -7.556  -3.847  -1.039
   86    H    GLU  13           HN       GLU  13  -7.196  -1.860  -1.916
   87    HA   GLU  13           HA       GLU  13  -4.509  -1.391  -2.993
   88    HB2  GLU  13           2HB      GLU  13  -5.466   0.851  -3.667
   89    HB3  GLU  13           1HB      GLU  13  -6.121  -0.552  -4.496
   90    HG2  GLU  13           2HG      GLU  13  -8.049  -0.485  -2.898
   91    HG3  GLU  13           1HG      GLU  13  -7.415   1.051  -2.306
   92    H    LEU  14           HN       LEU  14  -3.040  -0.400  -1.832
   93    HA   LEU  14           HA       LEU  14  -3.856   0.720   0.758
   94    HB2  LEU  14           2HB      LEU  14  -1.144  -0.224  -0.173
   95    HB3  LEU  14           1HB      LEU  14  -1.504   0.412   1.419
   96    HG   LEU  14           HG       LEU  14  -2.560  -2.150   0.232
   97   HD11  LEU  14          1HD1      LEU  14  -1.281  -3.188   2.052
   98   HD12  LEU  14          2HD1      LEU  14  -0.663  -1.600   2.508
   99   HD13  LEU  14          3HD1      LEU  14  -0.247  -2.292   0.939
  100   HD21  LEU  14          3HD2      LEU  14  -3.602  -2.513   2.422
  101   HD22  LEU  14          1HD2      LEU  14  -4.271  -1.101   1.604
  102   HD23  LEU  14          2HD2      LEU  14  -3.112  -0.893   2.918
  103    H    GLU  15           HN       GLU  15  -2.783   2.622   1.532
  104    HA   GLU  15           HA       GLU  15  -2.644   4.639  -0.510
  105    HB2  GLU  15           2HB      GLU  15  -2.204   4.798   2.477
  106    HB3  GLU  15           1HB      GLU  15  -2.304   6.182   1.399
  107    HG2  GLU  15           2HG      GLU  15  -4.582   5.792   0.948
  108    HG3  GLU  15           1HG      GLU  15  -4.528   4.189   1.683
  109    H    LEU  16           HN       LEU  16  -0.859   5.113  -1.606
  110    HA   LEU  16           HA       LEU  16   1.752   4.491  -0.503
  111    HB2  LEU  16           2HB      LEU  16   1.489   3.996  -2.818
  112    HB3  LEU  16           1HB      LEU  16   0.836   5.587  -3.153
  113    HG   LEU  16           HG       LEU  16   2.998   6.613  -2.853
  114   HD11  LEU  16          1HD1      LEU  16   4.008   3.869  -2.140
  115   HD12  LEU  16          2HD1      LEU  16   3.861   5.243  -1.043
  116   HD13  LEU  16          3HD1      LEU  16   5.000   5.303  -2.390
  117   HD21  LEU  16          3HD2      LEU  16   3.327   4.123  -4.509
  118   HD22  LEU  16          1HD2      LEU  16   4.179   5.654  -4.705
  119   HD23  LEU  16          2HD2      LEU  16   2.445   5.560  -5.021
  120    H    THR  17           HN       THR  17   2.579   5.816   0.898
  121    HA   THR  17           HA       THR  17   1.950   8.662   0.815
  122    HB   THR  17           HB       THR  17   3.592   7.168   2.869
  123    HG1  THR  17           1HG      THR  17   1.095   6.759   2.376
  124   HG21  THR  17          3HG2      THR  17   2.126   9.810   2.984
  125   HG22  THR  17          1HG2      THR  17   3.877   9.600   2.899
  126   HG23  THR  17          2HG2      THR  17   2.989   9.055   4.324
  127    H    VAL  18           HN       VAL  18   3.416  10.196   0.261
  128    HA   VAL  18           HA       VAL  18   6.026   9.224  -0.675
  129    HB   VAL  18           HB       VAL  18   4.554  11.753  -1.443
  130   HG11  VAL  18          1HG1      VAL  18   7.068  10.534  -2.581
  131   HG12  VAL  18          2HG1      VAL  18   6.974  11.994  -1.597
  132   HG13  VAL  18          3HG1      VAL  18   6.241  11.965  -3.200
  133   HG21  VAL  18          3HG2      VAL  18   4.195  10.655  -3.612
  134   HG22  VAL  18          1HG2      VAL  18   3.407   9.785  -2.296
  135   HG23  VAL  18          2HG2      VAL  18   4.916   9.177  -2.976
  136    H    LEU  19           HN       LEU  19   7.762   9.776   0.472
  137    HA   LEU  19           HA       LEU  19   7.634  12.060   2.287
  138    HB2  LEU  19           2HB      LEU  19   9.870  10.091   1.741
  139    HB3  LEU  19           1HB      LEU  19   9.891  11.337   2.977
  140    HG   LEU  19           HG       LEU  19   7.990   8.990   2.896
  141   HD11  LEU  19          1HD1      LEU  19  10.291   8.329   3.385
  142   HD12  LEU  19          2HD1      LEU  19   9.256   8.159   4.801
  143   HD13  LEU  19          3HD1      LEU  19  10.363   9.526   4.679
  144   HD21  LEU  19          3HD2      LEU  19   7.018  10.980   3.943
  145   HD22  LEU  19          1HD2      LEU  19   8.415  11.096   5.015
  146   HD23  LEU  19          2HD2      LEU  19   7.330   9.710   5.126
  147    H    TYR  20           HN       TYR  20   8.237  14.021   1.597
  148    HA   TYR  20           HA       TYR  20   9.952  14.187  -0.784
  149    HB2  TYR  20           2HB      TYR  20   8.383  15.925  -1.707
  150    HB3  TYR  20           1HB      TYR  20   7.724  14.294  -1.681
  151    HD1  TYR  20           2HD      TYR  20   7.497  17.654  -0.213
  152    HD2  TYR  20           1HD      TYR  20   5.899  13.712  -0.202
  153    HE1  TYR  20           2HE      TYR  20   5.548  18.452   1.054
  154    HE2  TYR  20           1HE      TYR  20   3.948  14.499   1.065
  155    HH   TYR  20           HH       TYR  20   3.425  16.383   2.627
  156    H    ASP  21           HN       ASP  21  10.139  16.726  -1.267
  157    HA   ASP  21           HA       ASP  21  11.074  17.945   1.228
  158    HB2  ASP  21           2HB      ASP  21  12.743  17.807  -0.545
  159    HB3  ASP  21           1HB      ASP  21  11.657  18.626  -1.664
  160    H    GLU  22           HN       GLU  22   9.538  19.129   2.166
  161    HA   GLU  22           HA       GLU  22   7.520  20.427   0.525
  162    HB2  GLU  22           2HB      GLU  22   6.516  21.053   2.759
  163    HB3  GLU  22           1HB      GLU  22   6.599  19.336   2.403
  164    HG2  GLU  22           2HG      GLU  22   8.735  20.674   4.011
  165    HG3  GLU  22           1HG      GLU  22   7.223  20.163   4.753
  166    H    GLU  23           HN       GLU  23  10.455  21.324   0.930
  167    HA   GLU  23           HA       GLU  23  10.066  24.001   1.941
  168    HB2  GLU  23           2HB      GLU  23  12.460  22.716   0.621
  169    HB3  GLU  23           1HB      GLU  23  12.437  24.325   1.309
  170    HG2  GLU  23           2HG      GLU  23  11.844  23.272   3.508
  171    HG3  GLU  23           1HG      GLU  23  12.179  21.713   2.754
  172    H    ARG  24           HN       ARG  24  11.121  22.604  -1.200
  173    HA   ARG  24           HA       ARG  24  10.010  25.030  -2.455
  174    HB2  ARG  24           2HB      ARG  24  12.513  23.505  -3.116
  175    HB3  ARG  24           1HB      ARG  24  11.769  24.623  -4.240
  176    HG2  ARG  24           2HG      ARG  24  13.244  26.042  -3.299
  177    HG3  ARG  24           1HG      ARG  24  11.940  26.233  -2.126
  178    HD2  ARG  24           2HD      ARG  24  14.167  25.905  -1.088
  179    HD3  ARG  24           1HD      ARG  24  12.991  24.674  -0.628
  180    HE   ARG  24           HE       ARG  24  14.403  23.121  -1.492
  181   HH11  ARG  24          1HH1      ARG  24  15.114  26.181  -3.087
  182   HH12  ARG  24          2HH1      ARG  24  16.331  25.491  -4.125
  183   HH21  ARG  24          1HH2      ARG  24  16.033  22.246  -2.826
  184   HH22  ARG  24          2HH2      ARG  24  16.862  23.267  -3.956
  185    H    TYR  25           HN       TYR  25  10.008  21.571  -2.485
  186    HA   TYR  25           HA       TYR  25   9.277  21.535  -5.311
  187    HB2  TYR  25           2HB      TYR  25   9.894  19.227  -3.465
  188    HB3  TYR  25           1HB      TYR  25   9.617  19.115  -5.201
  189    HD1  TYR  25           1HD      TYR  25  11.182  20.870  -6.581
  190    HD2  TYR  25           2HD      TYR  25  12.093  19.171  -2.793
  191    HE1  TYR  25           1HE      TYR  25  13.575  21.277  -6.978
  192    HE2  TYR  25           2HE      TYR  25  14.485  19.574  -3.179
  193    HH   TYR  25           HH       TYR  25  16.018  19.901  -5.034
  194    H    ASP  26           HN       ASP  26   7.332  21.223  -6.043
  195    HA   ASP  26           HA       ASP  26   5.210  20.328  -4.200
  196    HB2  ASP  26           2HB      ASP  26   5.089  22.056  -6.672
  197    HB3  ASP  26           1HB      ASP  26   3.659  21.318  -5.975
  198    H    ILE  27           HN       ILE  27   3.675  18.834  -5.003
  199    HA   ILE  27           HA       ILE  27   4.864  16.949  -6.888
  200    HB   ILE  27           HB       ILE  27   2.439  16.586  -5.122
  201   HG12  ILE  27          2HG1      ILE  27   5.291  15.634  -4.741
  202   HG13  ILE  27          1HG1      ILE  27   4.517  16.921  -3.827
  203   HG21  ILE  27          1HG2      ILE  27   4.062  14.576  -6.678
  204   HG22  ILE  27          2HG2      ILE  27   2.439  15.133  -7.086
  205   HG23  ILE  27          3HG2      ILE  27   2.707  14.207  -5.609
  206   HD11  ILE  27          3HD1      ILE  27   4.599  14.836  -2.571
  207   HD12  ILE  27          1HD1      ILE  27   3.670  14.038  -3.839
  208   HD13  ILE  27          2HD1      ILE  27   2.936  15.333  -2.893
  209    H    VAL  28           HN       VAL  28   4.302  17.043  -8.948
  210    HA   VAL  28           HA       VAL  28   1.867  18.370  -9.780
  211    HB   VAL  28           HB       VAL  28   3.886  16.858 -11.456
  212   HG11  VAL  28          1HG1      VAL  28   1.745  17.058 -12.583
  213   HG12  VAL  28          2HG1      VAL  28   2.928  18.131 -13.333
  214   HG13  VAL  28          3HG1      VAL  28   1.707  18.791 -12.246
  215   HG21  VAL  28          3HG2      VAL  28   3.648  19.819 -10.919
  216   HG22  VAL  28          1HG2      VAL  28   4.796  19.052 -12.018
  217   HG23  VAL  28          2HG2      VAL  28   4.900  18.748 -10.284
  218    H    GLU  29           HN       GLU  29   3.218  15.094  -9.972
  219    HA   GLU  29           HA       GLU  29   0.573  13.988  -9.602
  220    HB2  GLU  29           2HB      GLU  29   0.722  12.468 -11.535
  221    HB3  GLU  29           1HB      GLU  29   0.665  14.151 -12.037
  222    HG2  GLU  29           2HG      GLU  29   3.107  14.115 -12.339
  223    HG3  GLU  29           1HG      GLU  29   3.112  12.405 -11.908
  224    H    GLN  30           HN       GLN  30   0.643  11.746  -9.000
  225    HA   GLN  30           HA       GLN  30   3.238  10.585  -8.382
  226    HB2  GLN  30           2HB      GLN  30   2.800  10.402  -5.985
  227    HB3  GLN  30           1HB      GLN  30   2.813  12.092  -6.468
  228    HG2  GLN  30           2HG      GLN  30   0.391  12.144  -6.446
  229    HG3  GLN  30           1HG      GLN  30   0.339  10.431  -6.039
  230   HE21  GLN  30          1HE2      GLN  30   0.936  13.643  -4.873
  231   HE22  GLN  30          2HE2      GLN  30   1.005  13.235  -3.196
  232    H    THR  31           HN       THR  31   2.716   8.481  -6.952
  233    HA   THR  31           HA       THR  31   0.446   7.165  -8.257
  234    HB   THR  31           HB       THR  31   2.715   5.926  -6.686
  235    HG1  THR  31           1HG      THR  31   2.732   6.952  -9.110
  236   HG21  THR  31          3HG2      THR  31   1.964   3.823  -7.707
  237   HG22  THR  31          1HG2      THR  31   0.620   4.673  -8.466
  238   HG23  THR  31          2HG2      THR  31   0.696   4.538  -6.709
  239    H    GLU  32           HN       GLU  32  -1.350   6.723  -7.105
  240    HA   GLU  32           HA       GLU  32  -1.417   7.845  -4.420
  241    HB2  GLU  32           2HB      GLU  32  -3.680   6.824  -6.145
  242    HB3  GLU  32           1HB      GLU  32  -3.845   7.744  -4.658
  243    HG2  GLU  32           2HG      GLU  32  -2.728   9.650  -5.730
  244    HG3  GLU  32           1HG      GLU  32  -2.626   8.725  -7.228
  245    H    THR  33           HN       THR  33  -2.348   4.825  -6.024
  246    HA   THR  33           HA       THR  33  -2.376   3.511  -3.399
  247    HB   THR  33           HB       THR  33  -4.349   2.158  -4.388
  248    HG1  THR  33           1HG      THR  33  -5.478   3.124  -6.018
  249   HG21  THR  33          3HG2      THR  33  -4.572   3.659  -2.472
  250   HG22  THR  33          1HG2      THR  33  -5.979   3.780  -3.527
  251   HG23  THR  33          2HG2      THR  33  -4.743   5.037  -3.558
  252    H    VAL  34           HN       VAL  34  -1.848   1.324  -3.386
  253    HA   VAL  34           HA       VAL  34  -0.995   0.159  -5.964
  254    HB   VAL  34           HB       VAL  34   0.260  -0.485  -3.296
  255   HG11  VAL  34          1HG1      VAL  34   1.080  -1.162  -6.096
  256   HG12  VAL  34          2HG1      VAL  34   0.365  -2.260  -4.913
  257   HG13  VAL  34          3HG1      VAL  34   1.967  -1.576  -4.629
  258   HG21  VAL  34          3HG2      VAL  34   0.789   1.831  -3.859
  259   HG22  VAL  34          1HG2      VAL  34   1.334   1.322  -5.458
  260   HG23  VAL  34          2HG2      VAL  34   2.213   0.805  -4.020
  261    H    GLN  35           HN       GLN  35  -1.514  -2.009  -6.278
  262    HA   GLN  35           HA       GLN  35  -3.380  -3.162  -4.358
  263    HB2  GLN  35           2HB      GLN  35  -3.860  -3.158  -6.838
  264    HB3  GLN  35           1HB      GLN  35  -2.531  -4.294  -7.026
  265    HG2  GLN  35           2HG      GLN  35  -3.653  -5.948  -5.747
  266    HG3  GLN  35           1HG      GLN  35  -4.893  -4.801  -5.241
  267   HE21  GLN  35          1HE2      GLN  35  -5.173  -7.362  -6.593
  268   HE22  GLN  35          2HE2      GLN  35  -6.016  -7.030  -8.077
  269    H    VAL  36           HN       VAL  36  -2.774  -4.635  -2.935
  270    HA   VAL  36           HA       VAL  36  -0.115  -5.876  -3.237
  271    HB   VAL  36           HB       VAL  36  -1.292  -4.866  -0.640
  272   HG11  VAL  36          1HG1      VAL  36   0.951  -5.264   0.256
  273   HG12  VAL  36          2HG1      VAL  36   1.457  -5.915  -1.301
  274   HG13  VAL  36          3HG1      VAL  36   0.222  -6.747  -0.356
  275   HG21  VAL  36          3HG2      VAL  36   0.859  -3.634  -2.361
  276   HG22  VAL  36          1HG2      VAL  36   0.405  -3.093  -0.745
  277   HG23  VAL  36          2HG2      VAL  36  -0.753  -2.979  -2.069
  278    H    ASP  37           HN       ASP  37  -0.032  -7.996  -2.914
  279    HA   ASP  37           HA       ASP  37  -2.285  -9.346  -1.577
  280    HB2  ASP  37           2HB      ASP  37  -2.565  -9.482  -4.035
  281    HB3  ASP  37           1HB      ASP  37  -0.970 -10.213  -4.161
  282    H    LEU  38           HN       LEU  38  -1.652 -10.891  -0.138
  283    HA   LEU  38           HA       LEU  38   1.226 -11.527  -0.101
  284    HB2  LEU  38           2HB      LEU  38  -0.721 -11.123   2.154
  285    HB3  LEU  38           1HB      LEU  38   0.787 -11.983   2.386
  286    HG   LEU  38           HG       LEU  38   1.953  -9.884   1.532
  287   HD11  LEU  38          1HD1      LEU  38   0.724  -7.797   1.737
  288   HD12  LEU  38          2HD1      LEU  38  -0.757  -8.691   2.078
  289   HD13  LEU  38          3HD1      LEU  38   0.012  -8.829   0.496
  290   HD21  LEU  38          3HD2      LEU  38   1.799  -8.781   3.715
  291   HD22  LEU  38          1HD2      LEU  38   1.943 -10.531   3.876
  292   HD23  LEU  38          2HD2      LEU  38   0.377  -9.751   4.099
  293    H    GLU  39           HN       GLU  39   1.876 -13.594   0.520
  294    HA   GLU  39           HA       GLU  39  -0.202 -15.672   0.509
  295    HB2  GLU  39           2HB      GLU  39   0.899 -15.539  -1.710
  296    HB3  GLU  39           1HB      GLU  39   2.453 -15.802  -0.936
  297    HG2  GLU  39           2HG      GLU  39   1.792 -18.014  -0.255
  298    HG3  GLU  39           1HG      GLU  39   0.166 -17.758  -0.888
  299    H    GLY  40           HN       GLY  40   0.110 -17.321   1.961
  300    HA2  GLY  40           2HA      GLY  40   2.501 -18.209   3.032
  301    HA3  GLY  40           1HA      GLY  40   1.973 -16.896   4.074
  302    HA   PRO  41           HA       PRO  41  -0.011 -20.883   5.494
  303    HB2  PRO  41           2HB      PRO  41   0.948 -20.032   8.130
  304    HB3  PRO  41           1HB      PRO  41   1.190 -21.567   7.294
  305    HG2  PRO  41           2HG      PRO  41   3.190 -19.793   7.666
  306    HG3  PRO  41           1HG      PRO  41   3.103 -20.848   6.244
  307    HD2  PRO  41           2HD      PRO  41   2.389 -17.952   6.503
  308    HD3  PRO  41           1HD      PRO  41   3.210 -18.795   5.171
  309    H    ARG  42           HN       ARG  42  -2.068 -20.862   6.090
  310    HA   ARG  42           HA       ARG  42  -3.523 -18.554   6.583
  311    HB2  ARG  42           2HB      ARG  42  -5.302 -20.168   7.495
  312    HB3  ARG  42           1HB      ARG  42  -4.776 -20.373   5.831
  313    HG2  ARG  42           2HG      ARG  42  -4.874 -22.531   6.669
  314    HG3  ARG  42           1HG      ARG  42  -3.161 -22.126   6.739
  315    HD2  ARG  42           2HD      ARG  42  -3.822 -21.339   9.176
  316    HD3  ARG  42           1HD      ARG  42  -5.126 -22.502   8.934
  317    HE   ARG  42           HE       ARG  42  -2.407 -23.414   8.380
  318   HH11  ARG  42          1HH1      ARG  42  -5.196 -23.390  10.510
  319   HH12  ARG  42          2HH1      ARG  42  -4.610 -24.698  11.499
  320   HH21  ARG  42          1HH2      ARG  42  -1.628 -25.131   9.695
  321   HH22  ARG  42          2HH2      ARG  42  -2.587 -25.686  11.031
  322    H    GLY  43           HN       GLY  43  -1.821 -20.598   8.844
  323    HA2  GLY  43           2HA      GLY  43  -2.989 -19.741  11.245
  324    HA3  GLY  43           1HA      GLY  43  -1.339 -20.321  11.070
  325    H    VAL  44           HN       VAL  44  -0.254 -18.398   9.430
  326    HA   VAL  44           HA       VAL  44   0.217 -16.253  11.238
  327    HB   VAL  44           HB       VAL  44   0.931 -16.392   8.301
  328   HG11  VAL  44          1HG1      VAL  44   1.104 -14.150   9.251
  329   HG12  VAL  44          2HG1      VAL  44   2.697 -14.805   8.879
  330   HG13  VAL  44          3HG1      VAL  44   2.127 -14.767  10.549
  331   HG21  VAL  44          3HG2      VAL  44   3.125 -17.216   9.059
  332   HG22  VAL  44          1HG2      VAL  44   1.816 -18.336   9.444
  333   HG23  VAL  44          2HG2      VAL  44   2.501 -17.314  10.708
  334    H    LEU  45           HN       LEU  45  -1.628 -16.619   8.252
  335    HA   LEU  45           HA       LEU  45  -2.399 -13.953   7.889
  336    HB2  LEU  45           2HB      LEU  45  -3.889 -16.474   7.152
  337    HB3  LEU  45           1HB      LEU  45  -4.237 -14.876   6.524
  338    HG   LEU  45           HG       LEU  45  -1.668 -16.400   6.088
  339   HD11  LEU  45          1HD1      LEU  45  -2.442 -16.587   3.774
  340   HD12  LEU  45          2HD1      LEU  45  -3.966 -15.821   4.226
  341   HD13  LEU  45          3HD1      LEU  45  -3.537 -17.395   4.896
  342   HD21  LEU  45          3HD2      LEU  45  -1.285 -14.006   6.103
  343   HD22  LEU  45          1HD2      LEU  45  -2.625 -13.762   4.982
  344   HD23  LEU  45          2HD2      LEU  45  -1.180 -14.626   4.457
  345    H    THR  46           HN       THR  46  -3.734 -16.494   9.918
  346    HA   THR  46           HA       THR  46  -6.130 -15.149  10.618
  347    HB   THR  46           HB       THR  46  -4.618 -17.213  12.236
  348    HG1  THR  46           1HG      THR  46  -5.222 -17.835  10.032
  349   HG21  THR  46          3HG2      THR  46  -7.518 -16.369  12.276
  350   HG22  THR  46          1HG2      THR  46  -6.328 -16.072  13.543
  351   HG23  THR  46          2HG2      THR  46  -6.838 -17.721  13.180
  352    H    VAL  47           HN       VAL  47  -2.934 -15.327  12.193
  353    HA   VAL  47           HA       VAL  47  -3.545 -13.639  14.362
  354    HB   VAL  47           HB       VAL  47  -0.877 -14.002  12.986
  355   HG11  VAL  47          1HG1      VAL  47  -1.500 -13.038  15.776
  356   HG12  VAL  47          2HG1      VAL  47  -0.950 -12.029  14.438
  357   HG13  VAL  47          3HG1      VAL  47   0.106 -13.281  15.091
  358   HG21  VAL  47          3HG2      VAL  47  -1.771 -16.132  13.696
  359   HG22  VAL  47          1HG2      VAL  47  -2.119 -15.485  15.299
  360   HG23  VAL  47          2HG2      VAL  47  -0.447 -15.661  14.764
  361    H    PHE  48           HN       PHE  48  -2.419 -13.014  11.097
  362    HA   PHE  48           HA       PHE  48  -2.056 -10.226  11.317
  363    HB2  PHE  48           2HB      PHE  48  -1.148 -11.589   9.479
  364    HB3  PHE  48           1HB      PHE  48  -2.781 -11.921   8.912
  365    HD1  PHE  48           1HD      PHE  48  -0.368  -9.158   9.497
  366    HD2  PHE  48           2HD      PHE  48  -3.796 -10.518   7.375
  367    HE1  PHE  48           1HE      PHE  48  -0.260  -7.169   8.055
  368    HE2  PHE  48           2HE      PHE  48  -3.692  -8.532   5.931
  369    HZ   PHE  48           HZ       PHE  48  -1.922  -6.855   6.267
  370    H    ARG  49           HN       ARG  49  -4.865 -12.230  10.668
  371    HA   ARG  49           HA       ARG  49  -6.608 -10.101   9.953
  372    HB2  ARG  49           2HB      ARG  49  -6.774 -13.000  10.438
  373    HB3  ARG  49           1HB      ARG  49  -8.247 -12.109  10.745
  374    HG2  ARG  49           2HG      ARG  49  -6.704 -11.996   8.168
  375    HG3  ARG  49           1HG      ARG  49  -8.078 -13.063   8.460
  376    HD2  ARG  49           2HD      ARG  49  -8.982 -11.216   7.333
  377    HD3  ARG  49           1HD      ARG  49  -9.385 -10.950   9.027
  378    HE   ARG  49           HE       ARG  49  -6.968  -9.674   8.007
  379   HH11  ARG  49          1HH1      ARG  49 -10.326  -9.363   8.945
  380   HH12  ARG  49          2HH1      ARG  49 -10.273  -7.631   9.049
  381   HH21  ARG  49          1HH2      ARG  49  -6.906  -7.393   8.095
  382   HH22  ARG  49          2HH2      ARG  49  -8.338  -6.504   8.521
  383    H    PHE  50           HN       PHE  50  -5.611 -11.561  12.962
  384    HA   PHE  50           HA       PHE  50  -7.721 -10.554  14.569
  385    HB2  PHE  50           2HB      PHE  50  -4.995 -11.657  15.109
  386    HB3  PHE  50           1HB      PHE  50  -5.850 -10.830  16.397
  387    HD1  PHE  50           1HD      PHE  50  -8.461 -11.633  16.490
  388    HD2  PHE  50           2HD      PHE  50  -5.148 -13.937  15.147
  389    HE1  PHE  50           1HE      PHE  50  -9.695 -13.698  17.004
  390    HE2  PHE  50           2HE      PHE  50  -6.377 -16.007  15.654
  391    HZ   PHE  50           HZ       PHE  50  -8.653 -15.889  16.588
  392    H    ALA  51           HN       ALA  51  -4.883  -9.147  13.226
  393    HA   ALA  51           HA       ALA  51  -5.004  -6.852  15.017
  394    HB1  ALA  51           1HB      ALA  51  -2.945  -6.138  13.916
  395    HB2  ALA  51           2HB      ALA  51  -3.059  -7.505  12.808
  396    HB3  ALA  51           3HB      ALA  51  -2.802  -7.785  14.532
  397    H    ARG  52           HN       ARG  52  -5.313  -4.749  14.232
  398    HA   ARG  52           HA       ARG  52  -6.976  -4.510  11.906
  399    HB2  ARG  52           2HB      ARG  52  -5.902  -2.455  13.833
  400    HB3  ARG  52           1HB      ARG  52  -7.092  -2.149  12.595
  401    HG2  ARG  52           2HG      ARG  52  -8.596  -3.778  13.699
  402    HG3  ARG  52           1HG      ARG  52  -7.412  -3.913  15.002
  403    HD2  ARG  52           2HD      ARG  52  -8.876  -1.416  14.148
  404    HD3  ARG  52           1HD      ARG  52  -9.162  -2.349  15.616
  405    HE   ARG  52           HE       ARG  52  -6.559  -1.692  15.850
  406   HH11  ARG  52          1HH1      ARG  52  -9.382   0.247  15.074
  407   HH12  ARG  52          2HH1      ARG  52  -8.756   1.681  15.840
  408   HH21  ARG  52          1HH2      ARG  52  -5.748   0.195  16.856
  409   HH22  ARG  52          2HH2      ARG  52  -6.701   1.654  16.855
  410    HA   PRO  53           HA       PRO  53  -3.991  -3.159   8.891
  411    HB2  PRO  53           2HB      PRO  53  -5.383  -0.547   8.747
  412    HB3  PRO  53           1HB      PRO  53  -4.967  -1.669   7.452
  413    HG2  PRO  53           2HG      PRO  53  -7.487  -1.449   8.344
  414    HG3  PRO  53           1HG      PRO  53  -6.815  -3.002   7.814
  415    HD2  PRO  53           2HD      PRO  53  -7.372  -2.017  10.564
  416    HD3  PRO  53           1HD      PRO  53  -7.412  -3.672   9.923
  417    H    SER  54           HN       SER  54  -2.040  -2.539   9.320
  418    HA   SER  54           HA       SER  54  -1.496  -0.109  10.847
  419    HB2  SER  54           2HB      SER  54  -1.563  -2.185  12.328
  420    HB3  SER  54           1HB      SER  54  -0.140  -2.732  11.459
  421    HG   SER  54           HG       SER  54  -0.380  -0.328  12.958
  422    H    TYR  55           HN       TYR  55  -1.321  -1.254   8.085
  423    HA   TYR  55           HA       TYR  55   1.578  -1.101   7.658
  424    HB2  TYR  55           2HB      TYR  55   0.940  -2.418   5.496
  425    HB3  TYR  55           1HB      TYR  55   1.069  -3.269   7.029
  426    HD1  TYR  55           2HD      TYR  55  -1.310  -1.899   4.555
  427    HD2  TYR  55           1HD      TYR  55  -0.823  -4.322   8.017
  428    HE1  TYR  55           2HE      TYR  55  -3.602  -2.743   4.282
  429    HE2  TYR  55           1HE      TYR  55  -3.112  -5.171   7.752
  430    HH   TYR  55           HH       TYR  55  -4.955  -4.649   4.926
  431    H    GLU  56           HN       GLU  56   2.376   0.302   6.226
  432    HA   GLU  56           HA       GLU  56   0.526   1.737   4.457
  433    HB2  GLU  56           2HB      GLU  56   2.587   3.065   6.234
  434    HB3  GLU  56           1HB      GLU  56   1.563   3.884   5.061
  435    HG2  GLU  56           2HG      GLU  56  -0.411   3.289   6.348
  436    HG3  GLU  56           1HG      GLU  56   0.587   2.410   7.500
  437    H    VAL  57           HN       VAL  57   1.496   2.563   2.585
  438    HA   VAL  57           HA       VAL  57   4.111   1.375   1.947
  439    HB   VAL  57           HB       VAL  57   2.034   2.507   0.057
  440   HG11  VAL  57          1HG1      VAL  57   3.260   1.258  -1.659
  441   HG12  VAL  57          2HG1      VAL  57   4.440   0.765  -0.446
  442   HG13  VAL  57          3HG1      VAL  57   4.279   2.469  -0.875
  443   HG21  VAL  57          3HG2      VAL  57   1.089   0.599   1.228
  444   HG22  VAL  57          1HG2      VAL  57   2.524  -0.360   0.858
  445   HG23  VAL  57          2HG2      VAL  57   1.456   0.163  -0.444
  446    H    PHE  58           HN       PHE  58   5.796   2.708   1.102
  447    HA   PHE  58           HA       PHE  58   5.289   5.555   0.877
  448    HB2  PHE  58           2HB      PHE  58   6.993   6.170   2.566
  449    HB3  PHE  58           1HB      PHE  58   5.593   5.368   3.265
  450    HD1  PHE  58           1HD      PHE  58   5.777   3.016   4.042
  451    HD2  PHE  58           2HD      PHE  58   9.170   5.227   2.725
  452    HE1  PHE  58           1HE      PHE  58   7.262   1.392   5.144
  453    HE2  PHE  58           2HE      PHE  58  10.658   3.604   3.823
  454    HZ   PHE  58           HZ       PHE  58   9.702   1.686   5.034
  455    H    VAL  59           HN       VAL  59   6.971   6.748  -0.062
  456    HA   VAL  59           HA       VAL  59   9.289   5.221  -1.039
  457    HB   VAL  59           HB       VAL  59   9.198   6.545  -3.162
  458   HG11  VAL  59          1HG1      VAL  59   8.460   4.238  -3.123
  459   HG12  VAL  59          2HG1      VAL  59   7.441   5.182  -4.211
  460   HG13  VAL  59          3HG1      VAL  59   6.847   4.739  -2.610
  461   HG21  VAL  59          3HG2      VAL  59   7.063   7.566  -3.817
  462   HG22  VAL  59          1HG2      VAL  59   7.776   8.371  -2.418
  463   HG23  VAL  59          2HG2      VAL  59   6.427   7.256  -2.202
  464    H    ASP  60           HN       ASP  60  11.225   6.404  -1.226
  465    HA   ASP  60           HA       ASP  60  11.226   8.866   0.360
  466    HB2  ASP  60           2HB      ASP  60  13.424   6.947  -0.405
  467    HB3  ASP  60           1HB      ASP  60  13.751   8.503   0.349
  468    H    LEU  61           HN       LEU  61  10.985  10.647  -0.788
  469    HA   LEU  61           HA       LEU  61  12.639  10.985  -3.196
  470    HB2  LEU  61           2HB      LEU  61   9.744  11.754  -2.827
  471    HB3  LEU  61           1HB      LEU  61  10.743  12.324  -4.151
  472    HG   LEU  61           HG       LEU  61  10.224   9.403  -3.629
  473   HD11  LEU  61          1HD1      LEU  61   8.789  11.252  -5.524
  474   HD12  LEU  61          2HD1      LEU  61   8.108  10.527  -4.068
  475   HD13  LEU  61          3HD1      LEU  61   8.584   9.504  -5.422
  476   HD21  LEU  61          3HD2      LEU  61  12.212   9.903  -4.944
  477   HD22  LEU  61          1HD2      LEU  61  11.247  10.893  -6.041
  478   HD23  LEU  61          2HD2      LEU  61  10.963   9.155  -5.941
  479    H    THR  62           HN       THR  62  13.027  11.814  -0.409
  480    HA   THR  62           HA       THR  62  12.430  14.602  -0.214
  481    HB   THR  62           HB       THR  62  14.061  14.487   1.738
  482    HG1  THR  62           1HG      THR  62  14.738  12.435   2.357
  483   HG21  THR  62          3HG2      THR  62  12.498  13.226   3.146
  484   HG22  THR  62          1HG2      THR  62  11.733  12.565   1.702
  485   HG23  THR  62          2HG2      THR  62  11.642  14.294   2.035
  486    H    GLU  63           HN       GLU  63  15.040  12.717  -1.517
  487    HA   GLU  63           HA       GLU  63  16.762  15.066  -1.770
  488    HB2  GLU  63           2HB      GLU  63  17.199  12.180  -2.521
  489    HB3  GLU  63           1HB      GLU  63  18.370  13.448  -2.778
  490    HG2  GLU  63           2HG      GLU  63  18.377  13.835  -0.350
  491    HG3  GLU  63           1HG      GLU  63  17.335  12.436  -0.172
  492    H    ALA  64           HN       ALA  64  14.237  13.719  -3.403
  493    HA   ALA  64           HA       ALA  64  15.202  13.962  -6.087
  494    HB1  ALA  64           1HB      ALA  64  12.887  13.580  -6.750
  495    HB2  ALA  64           2HB      ALA  64  12.365  13.778  -5.078
  496    HB3  ALA  64           3HB      ALA  64  13.389  12.414  -5.525
  497    H    GLY  65           HN       GLY  65  15.404  15.744  -7.238
  498    HA2  GLY  65           2HA      GLY  65  13.686  18.042  -6.690
  499    HA3  GLY  65           1HA      GLY  65  15.408  18.265  -6.458
  500    H    GLU  66           HN       GLU  66  13.177  16.963  -8.820
  501    HA   GLU  66           HA       GLU  66  13.957  18.635 -10.931
  502    HB2  GLU  66           2HB      GLU  66  16.011  17.078 -10.609
  503    HB3  GLU  66           1HB      GLU  66  14.991  15.816 -11.281
  504    HG2  GLU  66           2HG      GLU  66  15.010  16.724 -13.381
  505    HG3  GLU  66           1HG      GLU  66  15.293  18.362 -12.792
  506    H    GLY  67           HN       GLY  67  13.325  16.959 -13.101
  507    HA2  GLY  67           2HA      GLY  67  10.529  16.747 -12.867
  508    HA3  GLY  67           1HA      GLY  67  11.500  16.142 -14.200
  509    H    SER  68           HN       SER  68   9.860  14.443 -14.155
  510    HA   SER  68           HA       SER  68   9.229  12.824 -12.031
  511    HB2  SER  68           2HB      SER  68   8.076  12.798 -14.213
  512    HB3  SER  68           1HB      SER  68   9.438  11.929 -14.905
  513    HG   SER  68           HG       SER  68   7.368  11.012 -13.402
  514    H    HIS  69           HN       HIS  69  10.033  11.165 -11.047
  515    HA   HIS  69           HA       HIS  69  12.592  10.037 -11.956
  516    HB2  HIS  69           2HB      HIS  69  12.757  11.813 -10.077
  517    HB3  HIS  69           1HB      HIS  69  12.030  10.586  -9.048
  518    HD1  HIS  69           1HD      HIS  69  15.231  11.719 -10.355
  519    HD2  HIS  69           2HD      HIS  69  13.677   8.168  -8.849
  520    HE1  HIS  69           1HE      HIS  69  17.227  10.304  -9.755
  521    HE2  HIS  69           2HE      HIS  69  16.265   8.194  -8.757
  522    H    THR  70           HN       THR  70  12.778   7.853 -11.694
  523    HA   THR  70           HA       THR  70  10.377   6.498 -10.681
  524    HB   THR  70           HB       THR  70  12.567   5.308 -12.387
  525    HG1  THR  70           1HG      THR  70  10.997   7.235 -13.102
  526   HG21  THR  70          3HG2      THR  70  11.126   3.691 -11.258
  527   HG22  THR  70          1HG2      THR  70  10.804   3.700 -12.993
  528   HG23  THR  70          2HG2      THR  70   9.697   4.512 -11.886
  529    H    VAL  71           HN       VAL  71  10.506   5.622  -8.723
  530    HA   VAL  71           HA       VAL  71  13.142   4.737  -7.736
  531    HB   VAL  71           HB       VAL  71  12.405   5.404  -5.447
  532   HG11  VAL  71          1HG1      VAL  71  12.841   7.793  -5.738
  533   HG12  VAL  71          2HG1      VAL  71  12.565   7.629  -7.470
  534   HG13  VAL  71          3HG1      VAL  71  13.929   6.807  -6.712
  535   HG21  VAL  71          3HG2      VAL  71  10.568   7.013  -5.223
  536   HG22  VAL  71          1HG2      VAL  71  10.003   5.454  -5.821
  537   HG23  VAL  71          2HG2      VAL  71  10.188   6.809  -6.934
  538    H    ASP  72           HN       ASP  72  12.938   3.264  -5.814
  539    HA   ASP  72           HA       ASP  72  11.121   1.109  -6.448
  540    HB2  ASP  72           2HB      ASP  72  13.425   0.599  -5.805
  541    HB3  ASP  72           1HB      ASP  72  13.198   1.411  -4.262
  542    H    VAL  73           HN       VAL  73   9.506   0.287  -5.079
  543    HA   VAL  73           HA       VAL  73   8.335   2.340  -3.348
  544    HB   VAL  73           HB       VAL  73   7.063  -0.184  -4.409
  545   HG11  VAL  73          1HG1      VAL  73   5.972   0.718  -2.433
  546   HG12  VAL  73          2HG1      VAL  73   4.956   0.920  -3.861
  547   HG13  VAL  73          3HG1      VAL  73   5.847   2.297  -3.210
  548   HG21  VAL  73          3HG2      VAL  73   5.966   1.269  -6.070
  549   HG22  VAL  73          1HG2      VAL  73   7.717   1.211  -6.273
  550   HG23  VAL  73          2HG2      VAL  73   6.963   2.616  -5.520
  551    H    GLU  74           HN       GLU  74   8.650   2.145  -1.214
  552    HA   GLU  74           HA       GLU  74   9.354  -0.474  -0.128
  553    HB2  GLU  74           2HB      GLU  74  10.322   2.080   0.380
  554    HB3  GLU  74           1HB      GLU  74   9.321   1.727   1.783
  555    HG2  GLU  74           2HG      GLU  74  11.551  -0.014   0.751
  556    HG3  GLU  74           1HG      GLU  74  11.669   1.096   2.114
  557    H    HIS  75           HN       HIS  75   8.358  -1.269   1.771
  558    HA   HIS  75           HA       HIS  75   5.665  -0.286   2.351
  559    HB2  HIS  75           2HB      HIS  75   4.968  -2.823   2.170
  560    HB3  HIS  75           1HB      HIS  75   4.975  -1.808   0.734
  561    HD1  HIS  75           1HD      HIS  75   7.025  -4.518   2.423
  562    HD2  HIS  75           2HD      HIS  75   6.704  -2.576  -1.245
  563    HE1  HIS  75           1HE      HIS  75   8.496  -5.802   0.841
  564    HE2  HIS  75           2HE      HIS  75   8.509  -4.425  -1.272
  565    H    ARG  76           HN       ARG  76   4.878  -1.022   4.390
  566    HA   ARG  76           HA       ARG  76   6.504  -2.779   5.993
  567    HB2  ARG  76           2HB      ARG  76   7.609  -0.443   5.957
  568    HB3  ARG  76           1HB      ARG  76   6.248   0.066   6.942
  569    HG2  ARG  76           2HG      ARG  76   6.862  -1.643   8.613
  570    HG3  ARG  76           1HG      ARG  76   8.277  -2.045   7.635
  571    HD2  ARG  76           2HD      ARG  76   9.015   0.313   7.836
  572    HD3  ARG  76           1HD      ARG  76   7.655   0.611   8.915
  573    HE   ARG  76           HE       ARG  76   9.938  -1.161   9.499
  574   HH11  ARG  76          1HH1      ARG  76   7.159   0.685  10.567
  575   HH12  ARG  76          2HH1      ARG  76   7.668   0.723  12.233
  576   HH21  ARG  76          1HH2      ARG  76  10.581  -1.161  11.679
  577   HH22  ARG  76          2HH2      ARG  76   9.612  -0.344  12.868
  578    H    GLY  77           HN       GLY  77   5.555  -3.115   8.139
  579    HA2  GLY  77           2HA      GLY  77   3.701  -2.412   9.654
  580    HA3  GLY  77           1HA      GLY  77   2.696  -2.375   8.212
  581    H    PHE  78           HN       PHE  78   2.953  -4.549   6.918
  582    HA   PHE  78           HA       PHE  78   2.001  -6.637   8.627
  583    HB2  PHE  78           2HB      PHE  78   2.152  -7.965   6.389
  584    HB3  PHE  78           1HB      PHE  78   0.965  -6.677   6.543
  585    HD1  PHE  78           2HD      PHE  78   4.348  -7.435   5.206
  586    HD2  PHE  78           1HD      PHE  78   0.936  -4.899   5.053
  587    HE1  PHE  78           2HE      PHE  78   5.250  -6.344   3.192
  588    HE2  PHE  78           1HE      PHE  78   1.831  -3.805   3.043
  589    HZ   PHE  78           HZ       PHE  78   3.987  -4.527   2.112
  590    HA   PRO  79           HA       PRO  79   5.619  -8.822   9.774
  591    HB2  PRO  79           2HB      PRO  79   4.902 -11.410   8.990
  592    HB3  PRO  79           1HB      PRO  79   4.536 -10.658  10.544
  593    HG2  PRO  79           2HG      PRO  79   2.818 -10.944   8.124
  594    HG3  PRO  79           1HG      PRO  79   2.374 -11.034   9.838
  595    HD2  PRO  79           2HD      PRO  79   1.821  -8.866   8.375
  596    HD3  PRO  79           1HD      PRO  79   2.324  -8.724  10.074
  597    H    GLY  80           HN       GLY  80   7.489  -8.766   8.770
  598    HA2  GLY  80           2HA      GLY  80   7.703  -9.017   5.910
  599    HA3  GLY  80           1HA      GLY  80   9.014  -8.689   7.032
  600    H    ASP  81           HN       ASP  81   6.735 -11.350   6.654
  601    HA   ASP  81           HA       ASP  81   8.990 -13.179   6.210
  602    HB2  ASP  81           2HB      ASP  81   8.262 -13.265   8.593
  603    HB3  ASP  81           1HB      ASP  81   6.674 -13.783   8.039
  604    H    LEU  82           HN       LEU  82   5.674 -12.343   5.679
  605    HA   LEU  82           HA       LEU  82   5.005 -14.725   4.224
  606    HB2  LEU  82           2HB      LEU  82   3.625 -12.039   4.351
  607    HB3  LEU  82           1HB      LEU  82   2.953 -13.490   3.631
  608    HG   LEU  82           HG       LEU  82   3.638 -13.157   6.552
  609   HD11  LEU  82          1HD1      LEU  82   1.245 -13.080   6.920
  610   HD12  LEU  82          2HD1      LEU  82   0.951 -13.203   5.186
  611   HD13  LEU  82          3HD1      LEU  82   1.739 -11.770   5.847
  612   HD21  LEU  82          3HD2      LEU  82   2.405 -15.263   6.823
  613   HD22  LEU  82          1HD2      LEU  82   3.850 -15.457   5.828
  614   HD23  LEU  82          2HD2      LEU  82   2.260 -15.391   5.070
  615    H    ALA  83           HN       ALA  83   4.316 -14.625   1.921
  616    HA   ALA  83           HA       ALA  83   6.304 -13.243   0.338
  617    HB1  ALA  83           1HB      ALA  83   5.308 -14.404  -1.562
  618    HB2  ALA  83           2HB      ALA  83   3.994 -14.976  -0.534
  619    HB3  ALA  83           3HB      ALA  83   5.645 -15.523  -0.244
  620    H    VAL  84           HN       VAL  84   5.987 -11.120   0.145
  621    HA   VAL  84           HA       VAL  84   3.270 -10.079  -0.093
  622    HB   VAL  84           HB       VAL  84   5.870  -8.569   0.223
  623   HG11  VAL  84          1HG1      VAL  84   4.101  -7.223  -0.775
  624   HG12  VAL  84          2HG1      VAL  84   4.441  -6.686   0.870
  625   HG13  VAL  84          3HG1      VAL  84   3.009  -7.659   0.537
  626   HG21  VAL  84          3HG2      VAL  84   5.437 -10.012   2.149
  627   HG22  VAL  84          1HG2      VAL  84   3.826  -9.317   2.312
  628   HG23  VAL  84          2HG2      VAL  84   5.249  -8.309   2.571
  629    H    THR  85           HN       THR  85   2.436  -9.497  -1.988
  630    HA   THR  85           HA       THR  85   4.298  -8.951  -4.200
  631    HB   THR  85           HB       THR  85   1.425  -9.731  -4.547
  632    HG1  THR  85           1HG      THR  85   3.279 -11.274  -3.510
  633   HG21  THR  85          3HG2      THR  85   2.534  -8.735  -6.475
  634   HG22  THR  85          1HG2      THR  85   2.196 -10.443  -6.765
  635   HG23  THR  85          2HG2      THR  85   3.831  -9.924  -6.355
  636    H    VAL  86           HN       VAL  86   4.320  -7.023  -4.929
  637    HA   VAL  86           HA       VAL  86   2.090  -5.138  -4.455
  638    HB   VAL  86           HB       VAL  86   4.427  -3.753  -5.302
  639   HG11  VAL  86          1HG1      VAL  86   4.244  -2.645  -3.100
  640   HG12  VAL  86          2HG1      VAL  86   3.135  -3.905  -2.560
  641   HG13  VAL  86          3HG1      VAL  86   2.672  -2.829  -3.876
  642   HG21  VAL  86          3HG2      VAL  86   5.041  -5.755  -3.131
  643   HG22  VAL  86          1HG2      VAL  86   5.964  -4.268  -3.370
  644   HG23  VAL  86          2HG2      VAL  86   5.889  -5.471  -4.657
  645    H    GLU  87           HN       GLU  87   1.390  -3.942  -6.456
  646    HA   GLU  87           HA       GLU  87   3.714  -3.856  -8.203
  647    HB2  GLU  87           2HB      GLU  87   2.395  -5.703  -9.122
  648    HB3  GLU  87           1HB      GLU  87   1.049  -4.601  -9.384
  649    HG2  GLU  87           2HG      GLU  87   2.226  -3.392 -11.029
  650    HG3  GLU  87           1HG      GLU  87   3.760  -4.139 -10.590
  651    HA   PRO  88           HA       PRO  88   3.695  -0.892 -10.150
  652    HB2  PRO  88           2HB      PRO  88   4.994   1.087  -8.751
  653    HB3  PRO  88           1HB      PRO  88   3.296   1.181  -9.207
  654    HG2  PRO  88           2HG      PRO  88   4.380   0.993  -6.563
  655    HG3  PRO  88           1HG      PRO  88   2.668   0.985  -7.023
  656    HD2  PRO  88           2HD      PRO  88   4.493  -1.324  -6.477
  657    HD3  PRO  88           1HD      PRO  88   2.743  -1.173  -6.187
  658    H    ARG  89           HN       ARG  89   5.697  -1.550 -10.960
  659    HA   ARG  89           HA       ARG  89   7.245  -3.169  -9.124
  660    HB2  ARG  89           2HB      ARG  89   7.818  -2.371 -12.022
  661    HB3  ARG  89           1HB      ARG  89   8.767  -3.534 -11.111
  662    HG2  ARG  89           2HG      ARG  89   5.835  -3.845 -11.707
  663    HG3  ARG  89           1HG      ARG  89   7.132  -4.537 -12.681
  664    HD2  ARG  89           2HD      ARG  89   7.863  -5.916 -10.863
  665    HD3  ARG  89           1HD      ARG  89   6.785  -5.090  -9.734
  666    HE   ARG  89           HE       ARG  89   5.052  -6.055 -11.545
  667   HH11  ARG  89          1HH1      ARG  89   7.728  -7.618  -9.892
  668   HH12  ARG  89          2HH1      ARG  89   6.927  -9.166  -9.810
  669   HH21  ARG  89          1HH2      ARG  89   4.028  -8.074 -11.468
  670   HH22  ARG  89          2HH2      ARG  89   4.829  -9.429 -10.726
  671    H    MET  90           HN       MET  90   7.720  -0.218 -10.975
  672    HA   MET  90           HA       MET  90   9.177   0.905  -8.705
  673    HB2  MET  90           2HB      MET  90  10.014   1.174 -11.609
  674    HB3  MET  90           1HB      MET  90  10.652   2.159 -10.297
  675    HG2  MET  90           2HG      MET  90  11.609   0.207  -9.248
  676    HG3  MET  90           1HG      MET  90  10.890  -0.837 -10.475
  677    HE1  MET  90           3HE      MET  90  14.283   2.197 -11.272
  678    HE2  MET  90           1HE      MET  90  13.628   1.848  -9.671
  679    HE3  MET  90           2HE      MET  90  12.635   2.683 -10.869
  680    H    ALA  91           HN       ALA  91   8.870   3.302  -8.640
  681    HA   ALA  91           HA       ALA  91   6.320   3.945  -9.994
  682    HB1  ALA  91           1HB      ALA  91   5.995   3.476  -7.623
  683    HB2  ALA  91           2HB      ALA  91   5.638   5.163  -7.997
  684    HB3  ALA  91           3HB      ALA  91   7.158   4.736  -7.208
  685    H    ARG  92           HN       ARG  92   6.017   5.933 -10.820
  686    HA   ARG  92           HA       ARG  92   8.355   7.697 -10.856
  687    HB2  ARG  92           2HB      ARG  92   7.675   8.488 -12.996
  688    HB3  ARG  92           1HB      ARG  92   7.553   6.740 -13.059
  689    HG2  ARG  92           2HG      ARG  92   5.174   8.474 -12.476
  690    HG3  ARG  92           1HG      ARG  92   5.681   8.103 -14.122
  691    HD2  ARG  92           2HD      ARG  92   5.069   6.006 -12.044
  692    HD3  ARG  92           1HD      ARG  92   3.878   6.623 -13.188
  693    HE   ARG  92           HE       ARG  92   6.322   5.137 -13.931
  694   HH11  ARG  92          1HH1      ARG  92   2.977   6.030 -14.482
  695   HH12  ARG  92          2HH1      ARG  92   2.851   5.131 -15.963
  696   HH21  ARG  92          1HH2      ARG  92   6.150   3.939 -15.884
  697   HH22  ARG  92          2HH2      ARG  92   4.636   3.929 -16.750
  698    H    VAL  93           HN       VAL  93   8.179   9.776 -10.198
  699    HA   VAL  93           HA       VAL  93   5.494  10.862  -9.667
  700    HB   VAL  93           HB       VAL  93   7.863  11.055  -7.788
  701   HG11  VAL  93          1HG1      VAL  93   6.640  13.150  -7.825
  702   HG12  VAL  93          2HG1      VAL  93   6.355  12.303  -6.304
  703   HG13  VAL  93          3HG1      VAL  93   5.122  12.293  -7.565
  704   HG21  VAL  93          3HG2      VAL  93   6.761   8.910  -7.620
  705   HG22  VAL  93          1HG2      VAL  93   5.189   9.696  -7.472
  706   HG23  VAL  93          2HG2      VAL  93   6.393   9.883  -6.196
  707    H    GLN  94           HN       GLN  94   5.239  12.977 -10.238
  708    HA   GLN  94           HA       GLN  94   7.510  14.247 -11.602
  709    HB2  GLN  94           2HB      GLN  94   5.423  13.957 -12.888
  710    HB3  GLN  94           1HB      GLN  94   4.549  14.885 -11.680
  711    HG2  GLN  94           2HG      GLN  94   4.899  16.388 -13.411
  712    HG3  GLN  94           1HG      GLN  94   6.151  16.792 -12.243
  713   HE21  GLN  94          1HE2      GLN  94   6.068  17.350 -15.053
  714   HE22  GLN  94          2HE2      GLN  94   7.453  16.584 -15.745
  715    H    LEU  95           HN       LEU  95   8.566  15.829 -10.590
  716    HA   LEU  95           HA       LEU  95   7.164  17.287  -8.456
  717    HB2  LEU  95           2HB      LEU  95  10.064  16.463  -8.581
  718    HB3  LEU  95           1HB      LEU  95   9.396  17.538  -7.369
  719    HG   LEU  95           HG       LEU  95   8.607  14.652  -7.775
  720   HD11  LEU  95          1HD1      LEU  95   9.744  14.264  -5.658
  721   HD12  LEU  95          2HD1      LEU  95  10.242  15.956  -5.604
  722   HD13  LEU  95          3HD1      LEU  95  10.856  14.893  -6.872
  723   HD21  LEU  95          3HD2      LEU  95   7.794  16.633  -5.652
  724   HD22  LEU  95          1HD2      LEU  95   7.361  14.924  -5.696
  725   HD23  LEU  95          2HD2      LEU  95   6.764  16.017  -6.943
  726    H    GLU  96           HN       GLU  96   7.320  19.451  -8.413
  727    HA   GLU  96           HA       GLU  96   9.000  20.746 -10.464
  728    HB2  GLU  96           2HB      GLU  96   6.673  21.017 -11.055
  729    HB3  GLU  96           1HB      GLU  96   6.266  21.525  -9.424
  730    HG2  GLU  96           2HG      GLU  96   6.290  23.440 -10.850
  731    HG3  GLU  96           1HG      GLU  96   7.655  23.539  -9.743
  732    H    GLU  97           HN       GLU  97  10.222  22.495  -9.817
  733    HA   GLU  97           HA       GLU  97  10.587  22.819  -6.961
  734    HB2  GLU  97           2HB      GLU  97  12.505  22.779  -8.586
  735    HB3  GLU  97           1HB      GLU  97  11.941  24.323  -9.212
  736    HG2  GLU  97           2HG      GLU  97  12.238  25.295  -6.950
  737    HG3  GLU  97           1HG      GLU  97  12.923  23.760  -6.422
  738    H    ARG  98           HN       ARG  98   8.232  23.504  -7.017
  739    HA   ARG  98           HA       ARG  98   6.640  25.036  -6.627
  740    HB2  ARG  98           2HB      ARG  98   8.182  26.069  -5.133
  741    HB3  ARG  98           1HB      ARG  98   9.037  26.841  -6.453
  742    HG2  ARG  98           2HG      ARG  98   7.157  28.294  -6.870
  743    HG3  ARG  98           1HG      ARG  98   6.190  27.436  -5.669
  744    HD2  ARG  98           2HD      ARG  98   7.002  29.477  -4.704
  745    HD3  ARG  98           1HD      ARG  98   7.822  28.116  -3.939
  746    HE   ARG  98           HE       ARG  98   9.061  29.771  -6.050
  747   HH11  ARG  98          1HH1      ARG  98   9.248  27.941  -3.064
  748   HH12  ARG  98          2HH1      ARG  98  10.906  28.392  -2.750
  749   HH21  ARG  98          1HH2      ARG  98  11.219  30.360  -5.640
  750   HH22  ARG  98          2HH2      ARG  98  12.016  29.786  -4.199
  751    H    GLN  99           HN       GLN  99   5.303  26.513  -7.649
  752    HA   GLN  99           HA       GLN  99   5.473  26.771 -10.436
  753    HB2  GLN  99           2HB      GLN  99   3.357  26.927  -9.231
  754    HB3  GLN  99           1HB      GLN  99   3.899  28.391  -8.422
  755    HG2  GLN  99           2HG      GLN  99   3.944  29.572 -10.522
  756    HG3  GLN  99           1HG      GLN  99   3.492  28.101 -11.383
  757   HE21  GLN  99          1HE2      GLN  99   1.632  29.013 -12.219
  758   HE22  GLN  99          2HE2      GLN  99   0.235  29.329 -11.239
  759    H    THR 100           HN       THR 100   6.458  28.217 -11.736
  760    HA   THR 100           HA       THR 100   8.433  29.945 -10.679
  761    HB   THR 100           HB       THR 100   7.273  29.848 -13.474
  762    HG1  THR 100           1HG      THR 100   8.431  27.932 -12.531
  763   HG21  THR 100          3HG2      THR 100   8.394  31.980 -13.046
  764   HG22  THR 100          1HG2      THR 100   9.341  30.987 -14.153
  765   HG23  THR 100          2HG2      THR 100   9.820  31.125 -12.461
  766    H    VAL 101           HN       VAL 101   7.879  31.658  -9.504
  767    HA   VAL 101           HA       VAL 101   5.768  33.433 -10.523
  768    HB   VAL 101           HB       VAL 101   5.352  32.574  -8.259
  769   HG11  VAL 101          1HG1      VAL 101   7.608  32.211  -7.495
  770   HG12  VAL 101          2HG1      VAL 101   6.773  33.286  -6.375
  771   HG13  VAL 101          3HG1      VAL 101   7.935  33.943  -7.529
  772   HG21  VAL 101          3HG2      VAL 101   4.492  34.769  -8.838
  773   HG22  VAL 101          1HG2      VAL 101   5.998  35.519  -8.309
  774   HG23  VAL 101          2HG2      VAL 101   4.954  34.717  -7.138
  775    H    SER 102           HN       SER 102   6.254  35.492 -11.080
  776    HA   SER 102           HA       SER 102   9.087  36.208 -11.086
  777    HB2  SER 102           2HB      SER 102   6.793  37.569 -12.516
  778    HB3  SER 102           1HB      SER 102   8.517  37.781 -12.823
  779    HG   SER 102           HG       SER 102   6.812  35.692 -13.539
  780    H    VAL 103           HN       VAL 103   6.813  36.533  -8.934
  781    HA   VAL 103           HA       VAL 103   7.490  39.316  -8.238
  782    HB   VAL 103           HB       VAL 103   5.008  37.792  -7.409
  783   HG11  VAL 103          1HG1      VAL 103   5.712  39.433  -5.757
  784   HG12  VAL 103          2HG1      VAL 103   4.232  39.956  -6.561
  785   HG13  VAL 103          3HG1      VAL 103   5.780  40.681  -7.002
  786   HG21  VAL 103          3HG2      VAL 103   5.302  40.010  -9.435
  787   HG22  VAL 103          1HG2      VAL 103   3.782  39.292  -8.903
  788   HG23  VAL 103          2HG2      VAL 103   4.954  38.318  -9.791
  789    HA   PRO 104           HA       PRO 104   9.617  37.307  -4.881
  790    HB2  PRO 104           2HB      PRO 104  10.374  39.538  -3.554
  791    HB3  PRO 104           1HB      PRO 104  11.145  38.994  -5.045
  792    HG2  PRO 104           2HG      PRO 104   9.068  41.110  -4.653
  793    HG3  PRO 104           1HG      PRO 104  10.517  41.143  -5.675
  794    HD2  PRO 104           2HD      PRO 104   8.039  40.641  -6.660
  795    HD3  PRO 104           1HD      PRO 104   9.512  39.939  -7.358
  796    H    VAL 105           HN       VAL 105   7.041  36.931  -4.479
  797    HA   VAL 105           HA       VAL 105   6.288  38.117  -1.919
  798    HB   VAL 105           HB       VAL 105   4.231  36.715  -2.123
  799   HG11  VAL 105          1HG1      VAL 105   4.843  38.478  -4.491
  800   HG12  VAL 105          2HG1      VAL 105   4.249  39.014  -2.920
  801   HG13  VAL 105          3HG1      VAL 105   3.233  38.005  -3.949
  802   HG21  VAL 105          3HG2      VAL 105   3.754  35.616  -4.269
  803   HG22  VAL 105          1HG2      VAL 105   5.143  34.889  -3.458
  804   HG23  VAL 105          2HG2      VAL 105   5.389  35.988  -4.816
  805    H    THR 106           HN       THR 106   7.745  35.285  -3.217
  806    HA   THR 106           HA       THR 106   7.521  33.864  -0.670
  807    HB   THR 106           HB       THR 106   8.736  32.912  -3.272
  808    HG1  THR 106           1HG      THR 106   6.116  32.707  -2.178
  809   HG21  THR 106          3HG2      THR 106   8.491  30.679  -2.273
  810   HG22  THR 106          1HG2      THR 106   7.908  31.419  -0.784
  811   HG23  THR 106          2HG2      THR 106   9.563  31.708  -1.321
  812    H    VAL 107           HN       VAL 107   9.026  34.314   0.771
  813    HA   VAL 107           HA       VAL 107  11.575  35.457  -0.073
  814    HB   VAL 107           HB       VAL 107  10.461  35.114   2.717
  815   HG11  VAL 107          1HG1      VAL 107  12.148  36.752   3.370
  816   HG12  VAL 107          2HG1      VAL 107  12.760  36.786   1.716
  817   HG13  VAL 107          3HG1      VAL 107  12.894  35.313   2.675
  818   HG21  VAL 107          3HG2      VAL 107   9.036  36.579   1.412
  819   HG22  VAL 107          1HG2      VAL 107  10.438  37.522   0.901
  820   HG23  VAL 107          2HG2      VAL 107   9.949  37.516   2.595
  821    H    GLU 108           HN       GLU 108  10.247  32.678   1.588
  822    HA   GLU 108           HA       GLU 108  11.042  30.613   2.045
  823    HB2  GLU 108           2HB      GLU 108  13.354  31.394   0.268
  824    HB3  GLU 108           1HB      GLU 108  13.008  29.765   0.835
  825    HG2  GLU 108           2HG      GLU 108  10.853  29.844  -0.341
  826    HG3  GLU 108           1HG      GLU 108  11.269  31.443  -0.956
  827    H    MET 109           HN       MET 109  11.498  30.434   4.122
  828    HA   MET 109           HA       MET 109  13.830  31.720   5.255
  829    HB2  MET 109           2HB      MET 109  11.583  31.380   6.459
  830    HB3  MET 109           1HB      MET 109  12.068  29.703   6.649
  831    HG2  MET 109           2HG      MET 109  13.658  32.056   7.649
  832    HG3  MET 109           1HG      MET 109  12.525  31.130   8.628
  833    HE1  MET 109           3HE      MET 109  16.236  30.213   9.811
  834    HE2  MET 109           1HE      MET 109  14.730  30.989  10.302
  835    HE3  MET 109           2HE      MET 109  15.750  31.739   9.074
  836    H    ILE 110           HN       ILE 110  15.647  30.834   4.484
  837    HA   ILE 110           HA       ILE 110  16.015  27.936   4.848
  838    HB   ILE 110           HB       ILE 110  17.706  28.038   3.039
  839   HG12  ILE 110          2HG1      ILE 110  16.671  30.852   2.598
  840   HG13  ILE 110          1HG1      ILE 110  18.252  30.449   3.257
  841   HG21  ILE 110          1HG2      ILE 110  14.940  28.966   2.288
  842   HG22  ILE 110          2HG2      ILE 110  15.489  27.298   2.469
  843   HG23  ILE 110          3HG2      ILE 110  16.115  28.297   1.156
  844   HD11  ILE 110          3HD1      ILE 110  18.404  31.056   0.914
  845   HD12  ILE 110          1HD1      ILE 110  17.267  29.776   0.495
  846   HD13  ILE 110          2HD1      ILE 110  18.851  29.367   1.153
  847    H    ASN 111           HN       ASN 111  18.236  27.295   5.393
  848    HA   ASN 111           HA       ASN 111  19.452  29.166   7.227
  849    HB2  ASN 111           2HB      ASN 111  19.302  26.712   7.715
  850    HB3  ASN 111           1HB      ASN 111  20.451  26.427   6.411
  851   HD21  ASN 111          1HD2      ASN 111  21.899  25.500   7.906
  852   HD22  ASN 111          2HD2      ASN 111  22.834  26.488   8.977
  853    H    LEU 112           HN       LEU 112  20.942  30.587   6.683
  854    HA   LEU 112           HA       LEU 112  21.755  30.707   3.929
  855    HB2  LEU 112           2HB      LEU 112  21.241  32.576   5.883
  856    HB3  LEU 112           1HB      LEU 112  22.987  32.640   5.743
  857    HG   LEU 112           HG       LEU 112  21.972  34.313   4.315
  858   HD11  LEU 112          1HD1      LEU 112  24.038  33.326   3.522
  859   HD12  LEU 112          2HD1      LEU 112  22.976  33.684   2.160
  860   HD13  LEU 112          3HD1      LEU 112  23.142  32.026   2.735
  861   HD21  LEU 112          3HD2      LEU 112  20.529  33.704   2.451
  862   HD22  LEU 112          1HD2      LEU 112  19.814  33.216   3.987
  863   HD23  LEU 112          2HD2      LEU 112  20.580  32.013   2.952
  864    H    GLU 113           HN       GLU 113  22.953  28.549   4.432
  865    HA   GLU 113           HA       GLU 113  25.726  29.014   5.211
  866    HB2  GLU 113           2HB      GLU 113  24.591  26.567   3.851
  867    HB3  GLU 113           1HB      GLU 113  26.066  26.682   4.797
  868    HG2  GLU 113           2HG      GLU 113  24.880  26.811   6.818
  869    HG3  GLU 113           1HG      GLU 113  23.352  27.126   5.993
  870    H    HIS 114           HN       HIS 114  23.846  28.125   2.372
  871    HA   HIS 114           HA       HIS 114  26.086  28.603   0.600
  872    HB2  HIS 114           2HB      HIS 114  24.564  27.826  -1.189
  873    HB3  HIS 114           1HB      HIS 114  24.684  26.670   0.129
  874    HD1  HIS 114           1HD      HIS 114  22.271  28.532  -1.868
  875    HD2  HIS 114           2HD      HIS 114  22.327  26.697   1.867
  876    HE1  HIS 114           1HE      HIS 114  19.855  28.246  -1.208
  877    HE2  HIS 114           2HE      HIS 114  19.914  27.019   0.996
  878    H    HIS 115           HN       HIS 115  26.496  30.477  -0.279
  879    HA   HIS 115           HA       HIS 115  24.312  32.437  -0.567
  880    HB2  HIS 115           2HB      HIS 115  26.110  34.180  -0.565
  881    HB3  HIS 115           1HB      HIS 115  25.961  33.315   0.957
  882    HD1  HIS 115           1HD      HIS 115  28.332  34.063  -1.789
  883    HD2  HIS 115           2HD      HIS 115  28.135  31.566   1.535
  884    HE1  HIS 115           1HE      HIS 115  30.680  33.227  -1.421
  885    HE2  HIS 115           2HE      HIS 115  30.515  31.627   0.526
  886    H    HIS 116           HN       HIS 116  23.841  33.132  -2.579
  887    HA   HIS 116           HA       HIS 116  25.163  31.706  -4.723
  888    HB2  HIS 116           2HB      HIS 116  23.393  32.532  -6.179
  889    HB3  HIS 116           1HB      HIS 116  22.709  31.831  -4.722
  890    HD1  HIS 116           1HD      HIS 116  22.595  34.812  -6.805
  891    HD2  HIS 116           2HD      HIS 116  21.804  33.878  -2.826
  892    HE1  HIS 116           1HE      HIS 116  21.170  36.694  -5.930
  893    HE2  HIS 116           2HE      HIS 116  20.729  36.129  -3.512
  894    H    HIS 117           HN       HIS 117  26.832  32.445  -5.772
  895    HA   HIS 117           HA       HIS 117  27.660  35.176  -5.583
  896    HB2  HIS 117           2HB      HIS 117  29.493  34.505  -7.111
  897    HB3  HIS 117           1HB      HIS 117  29.352  33.447  -5.715
  898    HD1  HIS 117           1HD      HIS 117  29.514  31.049  -6.249
  899    HD2  HIS 117           2HD      HIS 117  28.100  33.240  -9.491
  900    HE1  HIS 117           1HE      HIS 117  29.286  29.401  -8.136
  901    HE2  HIS 117           2HE      HIS 117  28.385  30.729 -10.077
  902    H    HIS 118           HN       HIS 118  28.289  36.388  -7.636
  903    HA   HIS 118           HA       HIS 118  26.024  36.207  -9.518
  904    HB2  HIS 118           2HB      HIS 118  26.281  38.240  -7.884
  905    HB3  HIS 118           1HB      HIS 118  27.526  38.760  -9.013
  906    HD1  HIS 118           1HD      HIS 118  23.990  39.029  -8.393
  907    HD2  HIS 118           2HD      HIS 118  26.413  38.971 -11.775
  908    HE1  HIS 118           1HE      HIS 118  22.616  40.051 -10.232
  909    HE2  HIS 118           2HE      HIS 118  24.119  40.063 -12.256
  910    H    HIS 119           HN       HIS 119  28.955  38.183  -9.704
  911    HA   HIS 119           HA       HIS 119  30.485  36.411 -11.245
  912    HB2  HIS 119           2HB      HIS 119  30.435  37.402 -13.443
  913    HB3  HIS 119           1HB      HIS 119  28.801  36.926 -13.014
  914    HD1  HIS 119           1HD      HIS 119  27.064  38.626 -13.438
  915    HD2  HIS 119           2HD      HIS 119  30.846  40.334 -13.092
  916    HE1  HIS 119           1HE      HIS 119  26.763  41.071 -13.960
  917    HE2  HIS 119           2HE      HIS 119  29.070  42.072 -13.812
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1  -5.143 -27.585  13.298
    2    H2   MET   1           H2       MET   1  -4.962 -29.157  13.907
    3    H3   MET   1           H3       MET   1  -6.497 -28.436  13.876
    4    HA   MET   1           HA       MET   1  -6.334 -30.032  12.120
    5    HB2  MET   1           2HB      MET   1  -6.898 -28.596  10.221
    6    HB3  MET   1           1HB      MET   1  -7.645 -27.994  11.693
    7    HG2  MET   1           2HG      MET   1  -5.828 -26.329  11.882
    8    HG3  MET   1           1HG      MET   1  -5.188 -26.900  10.342
    9    HE1  MET   1           2HE      MET   1  -9.334 -24.928  10.801
   10    HE2  MET   1           3HE      MET   1  -8.200 -25.101  12.139
   11    HE3  MET   1           1HE      MET   1  -8.937 -26.535  11.415
   12    HA   PRO   2           HA       PRO   2  -2.418 -30.856  10.333
   13    HB2  PRO   2           2HB      PRO   2  -3.079 -32.034   7.998
   14    HB3  PRO   2           1HB      PRO   2  -3.374 -32.800   9.563
   15    HG2  PRO   2           2HG      PRO   2  -5.272 -31.297   7.804
   16    HG3  PRO   2           1HG      PRO   2  -5.525 -32.820   8.673
   17    HD2  PRO   2           2HD      PRO   2  -6.427 -30.435   9.596
   18    HD3  PRO   2           1HD      PRO   2  -5.935 -31.758  10.672
   19    H    THR   3           HN       THR   3  -2.593 -28.255  10.073
   20    HA   THR   3           HA       THR   3  -1.967 -26.415   8.917
   21    HB   THR   3           HB       THR   3  -0.170 -26.728   7.221
   22    HG1  THR   3           1HG      THR   3  -1.154 -29.287   7.246
   23   HG21  THR   3          3HG2      THR   3   0.120 -28.303   9.778
   24   HG22  THR   3          1HG2      THR   3   0.425 -26.579   9.560
   25   HG23  THR   3          2HG2      THR   3   1.459 -27.765   8.764
   26    H    PHE   4           HN       PHE   4  -1.370 -25.888   6.282
   27    HA   PHE   4           HA       PHE   4  -3.379 -26.876   4.509
   28    HB2  PHE   4           2HB      PHE   4  -4.605 -25.156   5.885
   29    HB3  PHE   4           1HB      PHE   4  -3.490 -23.966   5.247
   30    HD1  PHE   4           1HD      PHE   4  -5.851 -26.582   4.064
   31    HD2  PHE   4           2HD      PHE   4  -4.109 -22.763   3.395
   32    HE1  PHE   4           1HE      PHE   4  -7.328 -26.250   2.130
   33    HE2  PHE   4           2HE      PHE   4  -5.582 -22.425   1.454
   34    HZ   PHE   4           HZ       PHE   4  -7.197 -24.171   0.817
   35    H    ASP   5           HN       ASP   5  -2.944 -26.143   2.315
   36    HA   ASP   5           HA       ASP   5  -0.096 -25.610   2.101
   37    HB2  ASP   5           2HB      ASP   5  -1.062 -27.658   1.011
   38    HB3  ASP   5           1HB      ASP   5  -1.910 -26.587  -0.100
   39    H    HIS   6           HN       HIS   6  -0.263 -23.480   2.499
   40    HA   HIS   6           HA       HIS   6   0.124 -21.345   1.804
   41    HB2  HIS   6           2HB      HIS   6  -0.909 -22.211  -0.912
   42    HB3  HIS   6           1HB      HIS   6  -0.172 -20.660  -0.548
   43    HD1  HIS   6           1HD      HIS   6   2.366 -20.539  -0.496
   44    HD2  HIS   6           2HD      HIS   6   0.885 -24.385  -1.057
   45    HE1  HIS   6           1HE      HIS   6   4.346 -21.941  -1.187
   46    HE2  HIS   6           2HE      HIS   6   3.371 -24.207  -1.719
   47    H    GLY   7           HN       GLY   7  -1.008 -19.428   1.646
   48    HA2  GLY   7           2HA      GLY   7  -3.823 -19.459   0.930
   49    HA3  GLY   7           1HA      GLY   7  -3.463 -19.040   2.606
   50    H    ASN   8           HN       ASN   8  -4.715 -17.172   1.028
   51    HA   ASN   8           HA       ASN   8  -2.527 -15.244   0.602
   52    HB2  ASN   8           2HB      ASN   8  -5.058 -15.491  -1.011
   53    HB3  ASN   8           1HB      ASN   8  -3.958 -14.132  -1.116
   54   HD21  ASN   8          1HD2      ASN   8  -2.062 -14.323  -2.218
   55   HD22  ASN   8          2HD2      ASN   8  -1.654 -15.718  -3.164
   56    H    LEU   9           HN       LEU   9  -2.945 -13.131   1.082
   57    HA   LEU   9           HA       LEU   9  -5.478 -12.478   2.397
   58    HB2  LEU   9           2HB      LEU   9  -3.567 -12.981   4.027
   59    HB3  LEU   9           1HB      LEU   9  -2.803 -11.527   3.418
   60    HG   LEU   9           HG       LEU   9  -4.036 -11.272   5.576
   61   HD11  LEU   9          1HD1      LEU   9  -5.038  -9.137   5.037
   62   HD12  LEU   9          2HD1      LEU   9  -5.055  -9.560   3.324
   63   HD13  LEU   9          3HD1      LEU   9  -3.519  -9.340   4.161
   64   HD21  LEU   9          3HD2      LEU   9  -5.925 -12.716   5.104
   65   HD22  LEU   9          1HD2      LEU   9  -6.455 -11.626   3.824
   66   HD23  LEU   9          2HD2      LEU   9  -6.474 -11.086   5.501
   67    H    SER  10           HN       SER  10  -6.319 -10.692   1.545
   68    HA   SER  10           HA       SER  10  -4.662  -9.280  -0.400
   69    HB2  SER  10           2HB      SER  10  -7.046  -8.450  -1.115
   70    HB3  SER  10           1HB      SER  10  -6.514 -10.080  -1.537
   71    HG   SER  10           HG       SER  10  -8.044 -10.851  -0.334
   72    H    LEU  11           HN       LEU  11  -3.679  -7.604   0.533
   73    HA   LEU  11           HA       LEU  11  -5.032  -5.851   2.382
   74    HB2  LEU  11           2HB      LEU  11  -2.426  -5.484   0.887
   75    HB3  LEU  11           1HB      LEU  11  -3.001  -4.465   2.192
   76    HG   LEU  11           HG       LEU  11  -2.328  -7.394   2.488
   77   HD11  LEU  11          1HD1      LEU  11  -0.752  -4.939   3.245
   78   HD12  LEU  11          2HD1      LEU  11  -0.335  -6.095   1.979
   79   HD13  LEU  11          3HD1      LEU  11  -0.333  -6.600   3.671
   80   HD21  LEU  11          3HD2      LEU  11  -2.430  -6.899   4.886
   81   HD22  LEU  11          1HD2      LEU  11  -3.983  -6.620   4.096
   82   HD23  LEU  11          2HD2      LEU  11  -2.950  -5.254   4.521
   83    H    GLY  12           HN       GLY  12  -4.505  -6.130  -1.012
   84    HA2  GLY  12           2HA      GLY  12  -5.716  -5.066  -2.699
   85    HA3  GLY  12           1HA      GLY  12  -6.310  -3.909  -1.514
   86    H    GLU  13           HN       GLU  13  -5.819  -2.167  -2.905
   87    HA   GLU  13           HA       GLU  13  -2.973  -1.705  -3.361
   88    HB2  GLU  13           2HB      GLU  13  -3.752   0.175  -4.802
   89    HB3  GLU  13           1HB      GLU  13  -4.304  -1.409  -5.330
   90    HG2  GLU  13           2HG      GLU  13  -6.464  -0.901  -4.099
   91    HG3  GLU  13           1HG      GLU  13  -5.880   0.759  -3.982
   92    H    LEU  14           HN       LEU  14  -1.873  -0.452  -2.049
   93    HA   LEU  14           HA       LEU  14  -3.354   1.111  -0.056
   94    HB2  LEU  14           2HB      LEU  14  -0.486   0.171  -0.070
   95    HB3  LEU  14           1HB      LEU  14  -1.248   1.079   1.223
   96    HG   LEU  14           HG       LEU  14  -2.003  -1.713   0.342
   97   HD11  LEU  14          1HD1      LEU  14  -0.636  -0.693   2.827
   98   HD12  LEU  14          2HD1      LEU  14   0.106  -1.647   1.544
   99   HD13  LEU  14          3HD1      LEU  14  -1.151  -2.356   2.557
  100   HD21  LEU  14          3HD2      LEU  14  -3.494  -1.679   2.309
  101   HD22  LEU  14          1HD2      LEU  14  -3.962  -0.481   1.098
  102   HD23  LEU  14          2HD2      LEU  14  -3.103   0.024   2.555
  103    H    GLU  15           HN       GLU  15  -2.651   3.214   0.517
  104    HA   GLU  15           HA       GLU  15  -2.070   4.805  -1.778
  105    HB2  GLU  15           2HB      GLU  15  -2.278   5.611   1.127
  106    HB3  GLU  15           1HB      GLU  15  -2.272   6.713  -0.243
  107    HG2  GLU  15           2HG      GLU  15  -4.361   5.758  -1.037
  108    HG3  GLU  15           1HG      GLU  15  -4.357   4.613   0.301
  109    H    LEU  16           HN       LEU  16  -0.243   5.763  -2.385
  110    HA   LEU  16           HA       LEU  16   2.230   5.034  -1.092
  111    HB2  LEU  16           2HB      LEU  16   1.987   5.079  -3.549
  112    HB3  LEU  16           1HB      LEU  16   1.688   6.804  -3.480
  113    HG   LEU  16           HG       LEU  16   3.998   7.070  -2.507
  114   HD11  LEU  16          1HD1      LEU  16   4.293   4.781  -1.717
  115   HD12  LEU  16          2HD1      LEU  16   5.578   5.241  -2.840
  116   HD13  LEU  16          3HD1      LEU  16   4.260   4.201  -3.382
  117   HD21  LEU  16          3HD2      LEU  16   3.569   7.591  -4.826
  118   HD22  LEU  16          1HD2      LEU  16   3.708   5.888  -5.266
  119   HD23  LEU  16          2HD2      LEU  16   5.123   6.767  -4.688
  120    H    THR  17           HN       THR  17   3.131   6.184   0.497
  121    HA   THR  17           HA       THR  17   2.402   9.013   0.807
  122    HB   THR  17           HB       THR  17   3.880   7.248   2.774
  123    HG1  THR  17           1HG      THR  17   1.606   6.639   2.184
  124   HG21  THR  17          3HG2      THR  17   4.199   9.629   3.155
  125   HG22  THR  17          1HG2      THR  17   3.155   8.951   4.404
  126   HG23  THR  17          2HG2      THR  17   2.456   9.893   3.086
  127    H    VAL  18           HN       VAL  18   3.770  10.438  -0.041
  128    HA   VAL  18           HA       VAL  18   6.596   9.660  -0.394
  129    HB   VAL  18           HB       VAL  18   5.090  11.874  -1.803
  130   HG11  VAL  18          1HG1      VAL  18   7.780  10.634  -2.358
  131   HG12  VAL  18          2HG1      VAL  18   7.486  12.245  -1.710
  132   HG13  VAL  18          3HG1      VAL  18   6.987  11.852  -3.354
  133   HG21  VAL  18          3HG2      VAL  18   4.141   9.714  -2.403
  134   HG22  VAL  18          1HG2      VAL  18   5.747   9.099  -2.789
  135   HG23  VAL  18          2HG2      VAL  18   5.044  10.396  -3.754
  136    H    LEU  19           HN       LEU  19   8.160  10.770   0.642
  137    HA   LEU  19           HA       LEU  19   7.345  13.064   2.282
  138    HB2  LEU  19           2HB      LEU  19   8.608  10.941   3.144
  139    HB3  LEU  19           1HB      LEU  19  10.017  11.713   2.448
  140    HG   LEU  19           HG       LEU  19   8.276  12.943   4.594
  141   HD11  LEU  19          1HD1      LEU  19  10.102  12.431   6.118
  142   HD12  LEU  19          2HD1      LEU  19  10.974  11.618   4.818
  143   HD13  LEU  19          3HD1      LEU  19   9.445  10.959   5.403
  144   HD21  LEU  19          3HD2      LEU  19  10.945  13.788   3.463
  145   HD22  LEU  19          1HD2      LEU  19  10.151  14.512   4.862
  146   HD23  LEU  19          2HD2      LEU  19   9.406  14.630   3.268
  147    H    TYR  20           HN       TYR  20   7.764  15.028   1.550
  148    HA   TYR  20           HA       TYR  20  10.386  15.703   0.600
  149    HB2  TYR  20           2HB      TYR  20   8.952  14.905  -1.444
  150    HB3  TYR  20           1HB      TYR  20   8.168  16.473  -1.275
  151    HD1  TYR  20           1HD      TYR  20  11.649  15.124  -1.271
  152    HD2  TYR  20           2HD      TYR  20   8.997  18.143  -2.651
  153    HE1  TYR  20           1HE      TYR  20  13.490  16.142  -2.540
  154    HE2  TYR  20           2HE      TYR  20  10.831  19.176  -3.929
  155    HH   TYR  20           HH       TYR  20  13.813  17.591  -4.472
  156    H    ASP  21           HN       ASP  21  10.089  18.250  -0.193
  157    HA   ASP  21           HA       ASP  21   8.531  19.479   1.983
  158    HB2  ASP  21           2HB      ASP  21  11.278  20.170   0.971
  159    HB3  ASP  21           1HB      ASP  21  10.308  21.317   1.886
  160    H    GLU  22           HN       GLU  22   7.065  20.862   1.420
  161    HA   GLU  22           HA       GLU  22   6.412  21.466  -1.257
  162    HB2  GLU  22           2HB      GLU  22   5.501  23.007   1.176
  163    HB3  GLU  22           1HB      GLU  22   4.640  22.781  -0.340
  164    HG2  GLU  22           2HG      GLU  22   4.018  20.626   0.177
  165    HG3  GLU  22           1HG      GLU  22   5.327  20.414   1.339
  166    H    GLU  23           HN       GLU  23   8.511  22.930   0.988
  167    HA   GLU  23           HA       GLU  23   8.482  25.620   0.226
  168    HB2  GLU  23           2HB      GLU  23  10.770  23.969   1.304
  169    HB3  GLU  23           1HB      GLU  23  10.684  25.725   1.296
  170    HG2  GLU  23           2HG      GLU  23   8.967  25.755   2.891
  171    HG3  GLU  23           1HG      GLU  23   8.643  24.031   2.694
  172    H    ARG  24           HN       ARG  24   9.900  22.848  -1.304
  173    HA   ARG  24           HA       ARG  24  11.511  24.595  -3.030
  174    HB2  ARG  24           2HB      ARG  24  11.901  21.711  -2.227
  175    HB3  ARG  24           1HB      ARG  24  12.864  22.525  -3.449
  176    HG2  ARG  24           2HG      ARG  24  13.753  24.049  -1.850
  177    HG3  ARG  24           1HG      ARG  24  12.634  23.483  -0.611
  178    HD2  ARG  24           2HD      ARG  24  13.711  21.305  -0.607
  179    HD3  ARG  24           1HD      ARG  24  14.793  21.824  -1.899
  180    HE   ARG  24           HE       ARG  24  15.810  23.369  -0.351
  181   HH11  ARG  24          1HH1      ARG  24  13.682  20.983   1.066
  182   HH12  ARG  24          2HH1      ARG  24  14.354  21.124   2.656
  183   HH21  ARG  24          1HH2      ARG  24  16.753  23.521   1.734
  184   HH22  ARG  24          2HH2      ARG  24  16.124  22.548   3.038
  185    H    TYR  25           HN       TYR  25   9.988  21.374  -3.212
  186    HA   TYR  25           HA       TYR  25   8.730  22.157  -5.733
  187    HB2  TYR  25           2HB      TYR  25  10.368  19.633  -5.354
  188    HB3  TYR  25           1HB      TYR  25   9.402  20.013  -6.773
  189    HD1  TYR  25           2HD      TYR  25  10.095  21.876  -8.270
  190    HD2  TYR  25           1HD      TYR  25  12.548  20.562  -5.053
  191    HE1  TYR  25           2HE      TYR  25  12.017  23.033  -9.271
  192    HE2  TYR  25           1HE      TYR  25  14.478  21.719  -6.044
  193    HH   TYR  25           HH       TYR  25  15.222  22.549  -8.208
  194    H    ASP  26           HN       ASP  26   6.868  20.907  -6.229
  195    HA   ASP  26           HA       ASP  26   5.847  19.416  -3.906
  196    HB2  ASP  26           2HB      ASP  26   4.822  21.752  -4.636
  197    HB3  ASP  26           1HB      ASP  26   3.962  20.751  -5.795
  198    H    ILE  27           HN       ILE  27   4.050  17.919  -4.515
  199    HA   ILE  27           HA       ILE  27   5.096  16.161  -6.553
  200    HB   ILE  27           HB       ILE  27   2.657  15.826  -4.795
  201   HG12  ILE  27          2HG1      ILE  27   5.456  14.725  -4.465
  202   HG13  ILE  27          1HG1      ILE  27   4.772  16.046  -3.523
  203   HG21  ILE  27          1HG2      ILE  27   4.189  13.804  -6.427
  204   HG22  ILE  27          2HG2      ILE  27   2.590  14.443  -6.807
  205   HG23  ILE  27          3HG2      ILE  27   2.825  13.458  -5.362
  206   HD11  ILE  27          3HD1      ILE  27   4.717  13.974  -2.275
  207   HD12  ILE  27          1HD1      ILE  27   3.790  13.202  -3.560
  208   HD13  ILE  27          2HD1      ILE  27   3.080  14.524  -2.630
  209    H    VAL  28           HN       VAL  28   4.653  16.701  -8.595
  210    HA   VAL  28           HA       VAL  28   2.060  17.823  -9.307
  211    HB   VAL  28           HB       VAL  28   4.450  17.252 -11.072
  212   HG11  VAL  28          1HG1      VAL  28   3.401  18.750 -12.674
  213   HG12  VAL  28          2HG1      VAL  28   2.030  18.978 -11.589
  214   HG13  VAL  28          3HG1      VAL  28   2.330  17.397 -12.307
  215   HG21  VAL  28          3HG2      VAL  28   3.583  19.824  -9.757
  216   HG22  VAL  28          1HG2      VAL  28   4.902  19.656 -10.916
  217   HG23  VAL  28          2HG2      VAL  28   5.007  18.868  -9.343
  218    H    GLU  29           HN       GLU  29   3.858  14.861  -9.570
  219    HA   GLU  29           HA       GLU  29   1.462  13.504 -10.524
  220    HB2  GLU  29           2HB      GLU  29   2.974  14.169 -12.497
  221    HB3  GLU  29           1HB      GLU  29   4.124  13.002 -11.868
  222    HG2  GLU  29           2HG      GLU  29   1.347  12.093 -12.353
  223    HG3  GLU  29           1HG      GLU  29   2.376  12.405 -13.747
  224    H    GLN  30           HN       GLN  30   1.585  11.165 -10.089
  225    HA   GLN  30           HA       GLN  30   3.643  10.067  -8.475
  226    HB2  GLN  30           2HB      GLN  30   2.860  11.685  -6.831
  227    HB3  GLN  30           1HB      GLN  30   1.199  11.166  -7.061
  228    HG2  GLN  30           2HG      GLN  30   1.894   8.908  -6.214
  229    HG3  GLN  30           1HG      GLN  30   3.446   9.626  -5.794
  230   HE21  GLN  30          1HE2      GLN  30   2.230  12.183  -5.055
  231   HE22  GLN  30          2HE2      GLN  30   1.481  11.919  -3.522
  232    H    THR  31           HN       THR  31   3.246   7.893  -7.995
  233    HA   THR  31           HA       THR  31   1.054   6.620  -9.326
  234    HB   THR  31           HB       THR  31   2.990   5.416  -7.330
  235    HG1  THR  31           1HG      THR  31   3.318   6.274  -9.906
  236   HG21  THR  31          3HG2      THR  31   1.033   4.019  -7.739
  237   HG22  THR  31          1HG2      THR  31   2.460   3.310  -8.494
  238   HG23  THR  31          2HG2      THR  31   1.274   4.163  -9.478
  239    H    GLU  32           HN       GLU  32  -0.926   6.512  -8.547
  240    HA   GLU  32           HA       GLU  32  -1.662   7.655  -6.100
  241    HB2  GLU  32           2HB      GLU  32  -3.211   5.822  -7.934
  242    HB3  GLU  32           1HB      GLU  32  -3.918   6.765  -6.627
  243    HG2  GLU  32           2HG      GLU  32  -3.883   8.662  -7.808
  244    HG3  GLU  32           1HG      GLU  32  -2.295   8.327  -8.493
  245    H    THR  33           HN       THR  33  -2.147   4.251  -7.030
  246    HA   THR  33           HA       THR  33  -1.496   3.449  -4.294
  247    HB   THR  33           HB       THR  33  -3.553   1.832  -4.561
  248    HG1  THR  33           1HG      THR  33  -4.875   2.319  -6.136
  249   HG21  THR  33          3HG2      THR  33  -3.903   4.755  -3.886
  250   HG22  THR  33          1HG2      THR  33  -3.335   3.498  -2.785
  251   HG23  THR  33          2HG2      THR  33  -4.988   3.447  -3.401
  252    H    VAL  34           HN       VAL  34  -0.642   1.384  -4.117
  253    HA   VAL  34           HA       VAL  34  -0.506  -0.191  -6.607
  254    HB   VAL  34           HB       VAL  34   1.691  -1.126  -5.676
  255   HG11  VAL  34          1HG1      VAL  34   1.596   0.258  -7.652
  256   HG12  VAL  34          2HG1      VAL  34   2.990   0.713  -6.671
  257   HG13  VAL  34          3HG1      VAL  34   1.541   1.718  -6.661
  258   HG21  VAL  34          3HG2      VAL  34   1.512   1.419  -4.070
  259   HG22  VAL  34          1HG2      VAL  34   2.977   0.456  -4.280
  260   HG23  VAL  34          2HG2      VAL  34   1.584  -0.228  -3.438
  261    H    GLN  35           HN       GLN  35  -0.470  -2.451  -6.386
  262    HA   GLN  35           HA       GLN  35  -2.218  -3.280  -4.211
  263    HB2  GLN  35           2HB      GLN  35  -2.878  -3.781  -6.510
  264    HB3  GLN  35           1HB      GLN  35  -1.385  -4.673  -6.764
  265    HG2  GLN  35           2HG      GLN  35  -2.200  -6.129  -4.792
  266    HG3  GLN  35           1HG      GLN  35  -3.777  -5.419  -5.138
  267   HE21  GLN  35          1HE2      GLN  35  -1.275  -7.521  -6.254
  268   HE22  GLN  35          2HE2      GLN  35  -2.157  -8.220  -7.569
  269    H    VAL  36           HN       VAL  36  -1.635  -4.556  -2.597
  270    HA   VAL  36           HA       VAL  36   0.758  -6.230  -2.917
  271    HB   VAL  36           HB       VAL  36   1.450  -4.447  -1.478
  272   HG11  VAL  36          1HG1      VAL  36   0.298  -3.868   0.592
  273   HG12  VAL  36          2HG1      VAL  36  -0.980  -5.018   0.203
  274   HG13  VAL  36          3HG1      VAL  36  -0.725  -3.603  -0.819
  275   HG21  VAL  36          3HG2      VAL  36   2.238  -6.645  -0.836
  276   HG22  VAL  36          1HG2      VAL  36   0.811  -6.887   0.171
  277   HG23  VAL  36          2HG2      VAL  36   1.988  -5.645   0.595
  278    H    ASP  37           HN       ASP  37   0.294  -8.280  -2.774
  279    HA   ASP  37           HA       ASP  37  -1.962  -9.157  -1.082
  280    HB2  ASP  37           2HB      ASP  37  -2.320  -9.477  -3.559
  281    HB3  ASP  37           1HB      ASP  37  -0.913 -10.533  -3.573
  282    H    LEU  38           HN       LEU  38  -1.572 -10.967   0.243
  283    HA   LEU  38           HA       LEU  38   1.292 -11.629   0.488
  284    HB2  LEU  38           2HB      LEU  38  -0.839 -11.542   2.624
  285    HB3  LEU  38           1HB      LEU  38   0.821 -12.039   2.882
  286    HG   LEU  38           HG       LEU  38  -0.077  -9.274   2.054
  287   HD11  LEU  38          1HD1      LEU  38   0.669  -8.618   4.289
  288   HD12  LEU  38          2HD1      LEU  38   1.020 -10.305   4.671
  289   HD13  LEU  38          3HD1      LEU  38  -0.642  -9.796   4.366
  290   HD21  LEU  38          3HD2      LEU  38   2.260  -8.646   2.407
  291   HD22  LEU  38          1HD2      LEU  38   2.102  -9.842   1.122
  292   HD23  LEU  38          2HD2      LEU  38   2.669 -10.333   2.719
  293    H    GLU  39           HN       GLU  39   1.828 -13.628   0.081
  294    HA   GLU  39           HA       GLU  39  -0.189 -15.747   0.413
  295    HB2  GLU  39           2HB      GLU  39   0.410 -15.311  -1.956
  296    HB3  GLU  39           1HB      GLU  39   2.096 -15.616  -1.579
  297    HG2  GLU  39           2HG      GLU  39   0.109 -17.749  -0.995
  298    HG3  GLU  39           1HG      GLU  39   0.559 -17.454  -2.671
  299    H    GLY  40           HN       GLY  40   0.394 -17.476   1.673
  300    HA2  GLY  40           2HA      GLY  40   2.848 -18.606   1.987
  301    HA3  GLY  40           1HA      GLY  40   2.869 -17.276   3.133
  302    HA   PRO  41           HA       PRO  41   1.411 -20.982   5.473
  303    HB2  PRO  41           2HB      PRO  41   2.262 -19.802   7.844
  304    HB3  PRO  41           1HB      PRO  41   3.191 -20.950   6.877
  305    HG2  PRO  41           2HG      PRO  41   3.348 -17.971   6.955
  306    HG3  PRO  41           1HG      PRO  41   4.652 -19.164   6.801
  307    HD2  PRO  41           2HD      PRO  41   3.779 -17.785   4.684
  308    HD3  PRO  41           1HD      PRO  41   4.260 -19.488   4.541
  309    H    ARG  42           HN       ARG  42  -0.701 -20.932   5.656
  310    HA   ARG  42           HA       ARG  42  -2.407 -18.850   6.094
  311    HB2  ARG  42           2HB      ARG  42  -4.007 -20.597   7.026
  312    HB3  ARG  42           1HB      ARG  42  -3.370 -20.868   5.415
  313    HG2  ARG  42           2HG      ARG  42  -3.279 -22.962   6.413
  314    HG3  ARG  42           1HG      ARG  42  -1.627 -22.361   6.554
  315    HD2  ARG  42           2HD      ARG  42  -2.342 -23.425   8.622
  316    HD3  ARG  42           1HD      ARG  42  -2.068 -21.703   8.873
  317    HE   ARG  42           HE       ARG  42  -4.809 -22.421   8.288
  318   HH11  ARG  42          1HH1      ARG  42  -2.404 -21.968  10.803
  319   HH12  ARG  42          2HH1      ARG  42  -3.573 -21.630  12.041
  320   HH21  ARG  42          1HH2      ARG  42  -6.351 -22.049   9.939
  321   HH22  ARG  42          2HH2      ARG  42  -5.809 -21.718  11.558
  322    H    GLY  43           HN       GLY  43  -0.514 -20.480   8.543
  323    HA2  GLY  43           2HA      GLY  43  -1.989 -19.793  10.829
  324    HA3  GLY  43           1HA      GLY  43  -0.256 -20.083  10.788
  325    H    VAL  44           HN       VAL  44   0.696 -18.049   9.280
  326    HA   VAL  44           HA       VAL  44   0.701 -15.886  11.101
  327    HB   VAL  44           HB       VAL  44   1.626 -15.886   8.219
  328   HG11  VAL  44          1HG1      VAL  44   3.101 -14.059   8.926
  329   HG12  VAL  44          2HG1      VAL  44   2.381 -14.100  10.534
  330   HG13  VAL  44          3HG1      VAL  44   1.402 -13.640   9.143
  331   HG21  VAL  44          3HG2      VAL  44   2.695 -17.678   9.454
  332   HG22  VAL  44          1HG2      VAL  44   3.138 -16.556  10.739
  333   HG23  VAL  44          2HG2      VAL  44   3.852 -16.385   9.137
  334    H    LEU  45           HN       LEU  45  -0.952 -16.465   8.051
  335    HA   LEU  45           HA       LEU  45  -2.012 -13.870   7.719
  336    HB2  LEU  45           2HB      LEU  45  -3.041 -16.517   6.698
  337    HB3  LEU  45           1HB      LEU  45  -3.552 -14.943   6.120
  338    HG   LEU  45           HG       LEU  45  -0.762 -16.067   5.888
  339   HD11  LEU  45          1HD1      LEU  45  -1.251 -16.220   3.509
  340   HD12  LEU  45          2HD1      LEU  45  -2.898 -15.666   3.804
  341   HD13  LEU  45          3HD1      LEU  45  -2.359 -17.214   4.452
  342   HD21  LEU  45          3HD2      LEU  45  -1.970 -13.510   4.843
  343   HD22  LEU  45          1HD2      LEU  45  -0.370 -14.123   4.426
  344   HD23  LEU  45          2HD2      LEU  45  -0.729 -13.653   6.087
  345    H    THR  46           HN       THR  46  -3.135 -16.701   9.465
  346    HA   THR  46           HA       THR  46  -5.759 -15.785   9.995
  347    HB   THR  46           HB       THR  46  -4.056 -17.659  11.665
  348    HG1  THR  46           1HG      THR  46  -4.333 -18.371   9.485
  349   HG21  THR  46          3HG2      THR  46  -6.209 -18.541  12.455
  350   HG22  THR  46          1HG2      THR  46  -7.056 -17.306  11.528
  351   HG23  THR  46          2HG2      THR  46  -6.019 -16.839  12.876
  352    H    VAL  47           HN       VAL  47  -2.716 -15.528  11.810
  353    HA   VAL  47           HA       VAL  47  -3.735 -14.128  14.027
  354    HB   VAL  47           HB       VAL  47  -0.964 -13.949  12.824
  355   HG11  VAL  47          1HG1      VAL  47  -1.400 -12.133  14.379
  356   HG12  VAL  47          2HG1      VAL  47  -0.262 -13.281  15.080
  357   HG13  VAL  47          3HG1      VAL  47  -1.949 -13.283  15.597
  358   HG21  VAL  47          3HG2      VAL  47  -0.356 -15.660  14.472
  359   HG22  VAL  47          1HG2      VAL  47  -1.567 -16.248  13.333
  360   HG23  VAL  47          2HG2      VAL  47  -2.045 -15.777  14.964
  361    H    PHE  48           HN       PHE  48  -2.381 -13.020  10.951
  362    HA   PHE  48           HA       PHE  48  -2.506 -10.254  11.526
  363    HB2  PHE  48           2HB      PHE  48  -1.111 -11.294   9.737
  364    HB3  PHE  48           1HB      PHE  48  -2.578 -11.601   8.818
  365    HD1  PHE  48           2HD      PHE  48  -0.450  -8.928  10.220
  366    HD2  PHE  48           1HD      PHE  48  -3.540  -9.937   7.473
  367    HE1  PHE  48           2HE      PHE  48  -0.272  -6.691   9.210
  368    HE2  PHE  48           1HE      PHE  48  -3.369  -7.704   6.455
  369    HZ   PHE  48           HZ       PHE  48  -1.736  -6.077   7.324
  370    H    ARG  49           HN       ARG  49  -4.854 -12.553  10.368
  371    HA   ARG  49           HA       ARG  49  -6.697 -10.703   9.279
  372    HB2  ARG  49           2HB      ARG  49  -6.522 -13.546   9.742
  373    HB3  ARG  49           1HB      ARG  49  -8.126 -12.947  10.116
  374    HG2  ARG  49           2HG      ARG  49  -6.651 -12.625   7.514
  375    HG3  ARG  49           1HG      ARG  49  -8.026 -13.683   7.827
  376    HD2  ARG  49           2HD      ARG  49  -7.975 -10.673   7.786
  377    HD3  ARG  49           1HD      ARG  49  -8.858 -11.751   6.706
  378    HE   ARG  49           HE       ARG  49  -9.507 -11.259   9.540
  379   HH11  ARG  49          1HH1      ARG  49 -10.417 -12.355   6.333
  380   HH12  ARG  49          2HH1      ARG  49 -12.113 -12.470   6.718
  381   HH21  ARG  49          1HH2      ARG  49 -11.729 -11.451  10.056
  382   HH22  ARG  49          2HH2      ARG  49 -12.853 -11.998   8.846
  383    H    PHE  50           HN       PHE  50  -5.898 -11.491  12.499
  384    HA   PHE  50           HA       PHE  50  -8.456 -10.550  13.543
  385    HB2  PHE  50           2HB      PHE  50  -6.065 -11.910  14.703
  386    HB3  PHE  50           1HB      PHE  50  -7.114 -10.983  15.756
  387    HD1  PHE  50           2HD      PHE  50  -9.542 -11.615  15.920
  388    HD2  PHE  50           1HD      PHE  50  -6.655 -14.059  13.967
  389    HE1  PHE  50           2HE      PHE  50 -11.068 -13.538  16.078
  390    HE2  PHE  50           1HE      PHE  50  -8.177 -15.986  14.120
  391    HZ   PHE  50           HZ       PHE  50 -10.390 -15.728  15.176
  392    H    ALA  51           HN       ALA  51  -5.376  -9.405  12.769
  393    HA   ALA  51           HA       ALA  51  -5.426  -7.230  14.690
  394    HB1  ALA  51           1HB      ALA  51  -3.309  -8.366  14.248
  395    HB2  ALA  51           2HB      ALA  51  -3.228  -6.660  13.807
  396    HB3  ALA  51           3HB      ALA  51  -3.405  -7.887  12.551
  397    H    ARG  52           HN       ARG  52  -6.130  -5.250  14.263
  398    HA   ARG  52           HA       ARG  52  -7.295  -4.563  11.779
  399    HB2  ARG  52           2HB      ARG  52  -6.689  -3.091  14.317
  400    HB3  ARG  52           1HB      ARG  52  -7.331  -2.256  12.920
  401    HG2  ARG  52           2HG      ARG  52  -9.323  -3.576  12.949
  402    HG3  ARG  52           1HG      ARG  52  -8.652  -4.632  14.197
  403    HD2  ARG  52           2HD      ARG  52  -9.191  -1.685  14.543
  404    HD3  ARG  52           1HD      ARG  52 -10.275  -2.972  15.073
  405    HE   ARG  52           HE       ARG  52  -7.976  -3.651  16.281
  406   HH11  ARG  52          1HH1      ARG  52  -9.662  -0.581  16.069
  407   HH12  ARG  52          2HH1      ARG  52  -9.136  -0.048  17.636
  408   HH21  ARG  52          1HH2      ARG  52  -7.302  -2.953  18.354
  409   HH22  ARG  52          2HH2      ARG  52  -7.820  -1.396  18.943
  410    HA   PRO  53           HA       PRO  53  -4.127  -3.040   9.244
  411    HB2  PRO  53           2HB      PRO  53  -5.453  -0.393   9.138
  412    HB3  PRO  53           1HB      PRO  53  -4.985  -1.468   7.821
  413    HG2  PRO  53           2HG      PRO  53  -7.539  -1.231   8.559
  414    HG3  PRO  53           1HG      PRO  53  -6.868  -2.786   8.036
  415    HD2  PRO  53           2HD      PRO  53  -7.542  -1.836  10.778
  416    HD3  PRO  53           1HD      PRO  53  -7.636  -3.470  10.092
  417    H    SER  54           HN       SER  54  -2.182  -2.458   9.742
  418    HA   SER  54           HA       SER  54  -1.643   0.048  11.133
  419    HB2  SER  54           2HB      SER  54  -1.698  -1.820  12.815
  420    HB3  SER  54           1HB      SER  54  -0.351  -2.545  11.954
  421    HG   SER  54           HG       SER  54   0.857  -0.648  12.388
  422    H    TYR  55           HN       TYR  55  -1.403  -1.420   8.486
  423    HA   TYR  55           HA       TYR  55   1.483  -1.343   8.031
  424    HB2  TYR  55           2HB      TYR  55   0.777  -2.379   5.786
  425    HB3  TYR  55           1HB      TYR  55   0.579  -3.372   7.227
  426    HD1  TYR  55           2HD      TYR  55  -1.263  -1.221   4.822
  427    HD2  TYR  55           1HD      TYR  55  -1.536  -4.202   7.845
  428    HE1  TYR  55           2HE      TYR  55  -3.641  -1.536   4.289
  429    HE2  TYR  55           1HE      TYR  55  -3.916  -4.522   7.321
  430    HH   TYR  55           HH       TYR  55  -5.408  -3.013   4.538
  431    H    GLU  56           HN       GLU  56   2.402  -0.049   6.433
  432    HA   GLU  56           HA       GLU  56   0.664   1.842   5.033
  433    HB2  GLU  56           2HB      GLU  56   2.950   2.646   6.836
  434    HB3  GLU  56           1HB      GLU  56   2.227   3.722   5.651
  435    HG2  GLU  56           2HG      GLU  56   0.074   3.536   6.789
  436    HG3  GLU  56           1HG      GLU  56   0.796   2.453   7.976
  437    H    VAL  57           HN       VAL  57   1.723   2.985   3.311
  438    HA   VAL  57           HA       VAL  57   4.133   1.632   2.281
  439    HB   VAL  57           HB       VAL  57   1.806   2.791   0.728
  440   HG11  VAL  57          1HG1      VAL  57   2.968   2.056  -1.285
  441   HG12  VAL  57          2HG1      VAL  57   4.343   1.535  -0.311
  442   HG13  VAL  57          3HG1      VAL  57   3.928   3.247  -0.405
  443   HG21  VAL  57          3HG2      VAL  57   1.484   0.500  -0.055
  444   HG22  VAL  57          1HG2      VAL  57   1.347   0.601   1.700
  445   HG23  VAL  57          2HG2      VAL  57   2.817  -0.039   0.964
  446    H    PHE  58           HN       PHE  58   5.858   2.947   1.945
  447    HA   PHE  58           HA       PHE  58   5.412   5.834   1.805
  448    HB2  PHE  58           2HB      PHE  58   5.597   5.363   4.176
  449    HB3  PHE  58           1HB      PHE  58   7.060   4.425   3.915
  450    HD1  PHE  58           2HD      PHE  58   5.645   7.834   3.781
  451    HD2  PHE  58           1HD      PHE  58   9.165   5.445   3.876
  452    HE1  PHE  58           2HE      PHE  58   7.000   9.850   4.157
  453    HE2  PHE  58           1HE      PHE  58  10.525   7.459   4.254
  454    HZ   PHE  58           HZ       PHE  58   9.442   9.662   4.394
  455    H    VAL  59           HN       VAL  59   7.045   6.996   0.851
  456    HA   VAL  59           HA       VAL  59   9.561   5.669   0.183
  457    HB   VAL  59           HB       VAL  59   9.495   6.681  -2.124
  458   HG11  VAL  59          1HG1      VAL  59   7.415   4.572  -1.560
  459   HG12  VAL  59          2HG1      VAL  59   9.145   4.288  -1.762
  460   HG13  VAL  59          3HG1      VAL  59   8.185   4.888  -3.116
  461   HG21  VAL  59          3HG2      VAL  59   6.562   6.991  -1.495
  462   HG22  VAL  59          1HG2      VAL  59   7.289   7.176  -3.092
  463   HG23  VAL  59          2HG2      VAL  59   7.715   8.293  -1.791
  464    H    ASP  60           HN       ASP  60  11.278   6.991   0.411
  465    HA   ASP  60           HA       ASP  60  10.723   9.820   0.984
  466    HB2  ASP  60           2HB      ASP  60  11.885   8.588   2.793
  467    HB3  ASP  60           1HB      ASP  60  13.191   8.201   1.675
  468    H    LEU  61           HN       LEU  61  11.211  11.230  -0.530
  469    HA   LEU  61           HA       LEU  61  13.305  10.546  -2.483
  470    HB2  LEU  61           2HB      LEU  61  10.598  11.776  -3.003
  471    HB3  LEU  61           1HB      LEU  61  11.882  11.688  -4.197
  472    HG   LEU  61           HG       LEU  61  10.682   9.263  -2.867
  473   HD11  LEU  61          1HD1      LEU  61   8.975  10.438  -4.162
  474   HD12  LEU  61          2HD1      LEU  61   9.428   8.907  -4.912
  475   HD13  LEU  61          3HD1      LEU  61  10.037  10.427  -5.570
  476   HD21  LEU  61          3HD2      LEU  61  12.414   9.577  -5.313
  477   HD22  LEU  61          1HD2      LEU  61  11.740   8.062  -4.710
  478   HD23  LEU  61          2HD2      LEU  61  12.929   8.944  -3.750
  479    H    THR  62           HN       THR  62  13.674  12.049  -0.164
  480    HA   THR  62           HA       THR  62  13.315  14.835  -0.580
  481    HB   THR  62           HB       THR  62  14.959  15.043   1.343
  482    HG1  THR  62           1HG      THR  62  14.637  12.210   1.543
  483   HG21  THR  62          3HG2      THR  62  12.565  13.250   1.736
  484   HG22  THR  62          1HG2      THR  62  12.527  15.009   1.654
  485   HG23  THR  62          2HG2      THR  62  13.357  14.208   2.985
  486    H    GLU  63           HN       GLU  63  15.679  12.603  -1.689
  487    HA   GLU  63           HA       GLU  63  17.545  14.770  -2.317
  488    HB2  GLU  63           2HB      GLU  63  17.894  11.792  -2.615
  489    HB3  GLU  63           1HB      GLU  63  19.133  12.997  -2.879
  490    HG2  GLU  63           2HG      GLU  63  18.459  13.615  -0.396
  491    HG3  GLU  63           1HG      GLU  63  18.028  11.916  -0.390
  492    H    ALA  64           HN       ALA  64  14.886  13.603  -3.649
  493    HA   ALA  64           HA       ALA  64  15.828  13.347  -6.382
  494    HB1  ALA  64           1HB      ALA  64  13.008  13.416  -5.312
  495    HB2  ALA  64           2HB      ALA  64  13.957  11.960  -5.609
  496    HB3  ALA  64           3HB      ALA  64  13.491  12.998  -6.956
  497    H    GLY  65           HN       GLY  65  14.935  14.762  -8.091
  498    HA2  GLY  65           2HA      GLY  65  14.605  17.509  -7.077
  499    HA3  GLY  65           1HA      GLY  65  15.694  17.135  -8.398
  500    H    GLU  66           HN       GLU  66  14.836  18.110 -10.085
  501    HA   GLU  66           HA       GLU  66  12.006  18.476 -10.389
  502    HB2  GLU  66           2HB      GLU  66  13.752  18.946 -12.731
  503    HB3  GLU  66           1HB      GLU  66  12.531  19.984 -12.017
  504    HG2  GLU  66           2HG      GLU  66  14.441  21.184 -11.620
  505    HG3  GLU  66           1HG      GLU  66  14.283  20.282 -10.114
  506    H    GLY  67           HN       GLY  67  10.631  17.525 -11.853
  507    HA2  GLY  67           2HA      GLY  67  10.062  16.188 -13.702
  508    HA3  GLY  67           1HA      GLY  67  11.696  15.538 -13.708
  509    H    SER  68           HN       SER  68   9.772  13.759 -14.003
  510    HA   SER  68           HA       SER  68   8.940  12.673 -11.473
  511    HB2  SER  68           2HB      SER  68   7.591  12.411 -13.536
  512    HB3  SER  68           1HB      SER  68   8.846  11.367 -14.200
  513    HG   SER  68           HG       SER  68   6.824  10.657 -12.700
  514    H    HIS  69           HN       HIS  69   9.751  11.044 -10.380
  515    HA   HIS  69           HA       HIS  69  12.267   9.829 -11.320
  516    HB2  HIS  69           2HB      HIS  69  12.620  11.632  -9.591
  517    HB3  HIS  69           1HB      HIS  69  11.675  10.666  -8.467
  518    HD1  HIS  69           1HD      HIS  69  15.048  10.941 -10.020
  519    HD2  HIS  69           2HD      HIS  69  12.981   8.363  -7.491
  520    HE1  HIS  69           1HE      HIS  69  16.786   9.443  -9.005
  521    HE2  HIS  69           2HE      HIS  69  15.546   8.062  -7.303
  522    H    THR  70           HN       THR  70  12.445   7.635 -10.982
  523    HA   THR  70           HA       THR  70  10.032   6.362  -9.854
  524    HB   THR  70           HB       THR  70  11.829   5.139 -11.943
  525    HG1  THR  70           1HG      THR  70  10.320   7.288 -12.256
  526   HG21  THR  70          3HG2      THR  70   9.817   3.820 -12.452
  527   HG22  THR  70          1HG2      THR  70   8.953   4.651 -11.157
  528   HG23  THR  70          2HG2      THR  70  10.328   3.610 -10.777
  529    H    VAL  71           HN       VAL  71  10.314   5.032  -8.174
  530    HA   VAL  71           HA       VAL  71  12.908   3.727  -7.763
  531    HB   VAL  71           HB       VAL  71  12.734   4.180  -5.296
  532   HG11  VAL  71          1HG1      VAL  71  13.682   6.438  -5.425
  533   HG12  VAL  71          2HG1      VAL  71  13.108   6.573  -7.088
  534   HG13  VAL  71          3HG1      VAL  71  14.332   5.373  -6.673
  535   HG21  VAL  71          3HG2      VAL  71  11.403   6.129  -4.589
  536   HG22  VAL  71          1HG2      VAL  71  10.396   4.807  -5.180
  537   HG23  VAL  71          2HG2      VAL  71  10.696   6.211  -6.205
  538    H    ASP  72           HN       ASP  72  12.752   2.030  -6.028
  539    HA   ASP  72           HA       ASP  72  10.454   0.368  -6.487
  540    HB2  ASP  72           2HB      ASP  72  12.865   0.073  -4.694
  541    HB3  ASP  72           1HB      ASP  72  11.596  -1.141  -4.799
  542    H    VAL  73           HN       VAL  73   8.880  -0.245  -5.010
  543    HA   VAL  73           HA       VAL  73   8.481   1.694  -2.843
  544    HB   VAL  73           HB       VAL  73   6.509  -0.156  -4.194
  545   HG11  VAL  73          1HG1      VAL  73   5.917   0.272  -1.861
  546   HG12  VAL  73          2HG1      VAL  73   4.785   1.040  -2.977
  547   HG13  VAL  73          3HG1      VAL  73   6.012   2.009  -2.160
  548   HG21  VAL  73          3HG2      VAL  73   7.226   1.611  -5.666
  549   HG22  VAL  73          1HG2      VAL  73   6.930   2.820  -4.416
  550   HG23  VAL  73          2HG2      VAL  73   5.579   1.930  -5.124
  551    H    GLU  74           HN       GLU  74   9.047   1.040  -0.894
  552    HA   GLU  74           HA       GLU  74   8.915  -1.779  -0.170
  553    HB2  GLU  74           2HB      GLU  74  10.258   0.632   0.940
  554    HB3  GLU  74           1HB      GLU  74   9.827  -0.647   2.066
  555    HG2  GLU  74           2HG      GLU  74  11.381  -1.189  -0.439
  556    HG3  GLU  74           1HG      GLU  74  12.159  -0.695   1.063
  557    H    HIS  75           HN       HIS  75   7.804  -2.503   1.695
  558    HA   HIS  75           HA       HIS  75   5.550  -0.763   2.480
  559    HB2  HIS  75           2HB      HIS  75   5.536  -3.784   2.210
  560    HB3  HIS  75           1HB      HIS  75   4.165  -2.777   2.661
  561    HD1  HIS  75           1HD      HIS  75   2.692  -2.041   0.793
  562    HD2  HIS  75           2HD      HIS  75   6.417  -3.287  -0.562
  563    HE1  HIS  75           1HE      HIS  75   2.543  -2.011  -1.718
  564    HE2  HIS  75           2HE      HIS  75   4.860  -2.605  -2.505
  565    H    ARG  76           HN       ARG  76   4.857  -0.946   4.687
  566    HA   ARG  76           HA       ARG  76   6.685  -2.442   6.428
  567    HB2  ARG  76           2HB      ARG  76   7.224   0.108   6.111
  568    HB3  ARG  76           1HB      ARG  76   5.868   0.335   7.207
  569    HG2  ARG  76           2HG      ARG  76   7.602   0.292   8.689
  570    HG3  ARG  76           1HG      ARG  76   7.166  -1.416   8.671
  571    HD2  ARG  76           2HD      ARG  76   9.461  -0.054   7.285
  572    HD3  ARG  76           1HD      ARG  76   9.524  -1.338   8.490
  573    HE   ARG  76           HE       ARG  76   8.210  -2.023   5.994
  574   HH11  ARG  76          1HH1      ARG  76  11.177  -2.089   7.851
  575   HH12  ARG  76          2HH1      ARG  76  11.922  -3.304   6.859
  576   HH21  ARG  76          1HH2      ARG  76   9.181  -3.592   4.675
  577   HH22  ARG  76          2HH2      ARG  76  10.785  -4.156   5.036
  578    H    GLY  77           HN       GLY  77   5.806  -3.176   8.325
  579    HA2  GLY  77           2HA      GLY  77   3.910  -2.689   9.977
  580    HA3  GLY  77           1HA      GLY  77   2.878  -2.878   8.562
  581    H    PHE  78           HN       PHE  78   3.711  -4.962   7.271
  582    HA   PHE  78           HA       PHE  78   3.551  -7.186   9.163
  583    HB2  PHE  78           2HB      PHE  78   3.015  -8.542   7.125
  584    HB3  PHE  78           1HB      PHE  78   1.864  -7.244   7.427
  585    HD1  PHE  78           2HD      PHE  78   1.779  -5.299   5.966
  586    HD2  PHE  78           1HD      PHE  78   4.464  -8.511   5.197
  587    HE1  PHE  78           2HE      PHE  78   2.122  -4.459   3.679
  588    HE2  PHE  78           1HE      PHE  78   4.813  -7.672   2.910
  589    HZ   PHE  78           HZ       PHE  78   3.644  -5.645   2.146
  590    HA   PRO  79           HA       PRO  79   7.799  -8.262   8.405
  591    HB2  PRO  79           2HB      PRO  79   7.122 -11.089   8.745
  592    HB3  PRO  79           1HB      PRO  79   8.098 -10.045   9.782
  593    HG2  PRO  79           2HG      PRO  79   5.656 -10.946  10.515
  594    HG3  PRO  79           1HG      PRO  79   6.288  -9.373  11.035
  595    HD2  PRO  79           2HD      PRO  79   4.321 -10.005   8.862
  596    HD3  PRO  79           1HD      PRO  79   4.308  -8.678  10.045
  597    H    GLY  80           HN       GLY  80   8.927  -8.632   6.581
  598    HA2  GLY  80           2HA      GLY  80   7.525  -9.559   4.238
  599    HA3  GLY  80           1HA      GLY  80   9.181  -8.976   4.306
  600    H    ASP  81           HN       ASP  81   7.598 -11.643   6.021
  601    HA   ASP  81           HA       ASP  81   9.721 -13.422   5.054
  602    HB2  ASP  81           2HB      ASP  81   9.206 -13.145   7.542
  603    HB3  ASP  81           1HB      ASP  81   7.723 -14.029   7.219
  604    H    LEU  82           HN       LEU  82   6.509 -12.616   4.604
  605    HA   LEU  82           HA       LEU  82   5.674 -15.193   3.548
  606    HB2  LEU  82           2HB      LEU  82   4.253 -12.525   3.515
  607    HB3  LEU  82           1HB      LEU  82   3.545 -14.077   3.120
  608    HG   LEU  82           HG       LEU  82   4.569 -13.287   5.852
  609   HD11  LEU  82          1HD1      LEU  82   2.211 -13.216   6.483
  610   HD12  LEU  82          2HD1      LEU  82   1.753 -13.518   4.808
  611   HD13  LEU  82          3HD1      LEU  82   2.584 -12.024   5.240
  612   HD21  LEU  82          3HD2      LEU  82   3.006 -15.708   4.964
  613   HD22  LEU  82          1HD2      LEU  82   3.498 -15.328   6.613
  614   HD23  LEU  82          2HD2      LEU  82   4.717 -15.696   5.392
  615    H    ALA  83           HN       ALA  83   4.515 -14.992   1.294
  616    HA   ALA  83           HA       ALA  83   6.429 -13.834  -0.561
  617    HB1  ALA  83           1HB      ALA  83   5.565 -16.086  -0.995
  618    HB2  ALA  83           2HB      ALA  83   5.135 -14.974  -2.295
  619    HB3  ALA  83           3HB      ALA  83   3.927 -15.439  -1.098
  620    H    VAL  84           HN       VAL  84   6.229 -11.763  -1.055
  621    HA   VAL  84           HA       VAL  84   3.626 -10.481  -0.771
  622    HB   VAL  84           HB       VAL  84   6.317  -9.210  -1.298
  623   HG11  VAL  84          1HG1      VAL  84   3.683  -8.014  -0.437
  624   HG12  VAL  84          2HG1      VAL  84   4.479  -7.798  -1.997
  625   HG13  VAL  84          3HG1      VAL  84   5.217  -7.144  -0.533
  626   HG21  VAL  84          3HG2      VAL  84   6.330  -8.629   1.077
  627   HG22  VAL  84          1HG2      VAL  84   6.297 -10.379   0.848
  628   HG23  VAL  84          2HG2      VAL  84   4.826  -9.521   1.308
  629    H    THR  85           HN       THR  85   2.373 -10.521  -2.506
  630    HA   THR  85           HA       THR  85   3.544 -10.399  -5.183
  631    HB   THR  85           HB       THR  85   0.612 -10.565  -4.519
  632    HG1  THR  85           1HG      THR  85   0.998 -12.511  -3.767
  633   HG21  THR  85          3HG2      THR  85   2.236 -11.455  -6.904
  634   HG22  THR  85          1HG2      THR  85   1.156 -10.062  -6.838
  635   HG23  THR  85          2HG2      THR  85   0.500 -11.696  -6.710
  636    H    VAL  86           HN       VAL  86   3.395  -8.600  -6.446
  637    HA   VAL  86           HA       VAL  86   2.039  -6.269  -5.296
  638    HB   VAL  86           HB       VAL  86   4.854  -6.159  -6.360
  639   HG11  VAL  86          1HG1      VAL  86   4.897  -3.933  -5.370
  640   HG12  VAL  86          2HG1      VAL  86   3.225  -4.136  -4.840
  641   HG13  VAL  86          3HG1      VAL  86   3.605  -4.083  -6.561
  642   HG21  VAL  86          3HG2      VAL  86   5.597  -5.870  -4.041
  643   HG22  VAL  86          1HG2      VAL  86   4.862  -7.453  -4.305
  644   HG23  VAL  86          2HG2      VAL  86   3.953  -6.183  -3.483
  645    H    GLU  87           HN       GLU  87   1.171  -4.891  -6.711
  646    HA   GLU  87           HA       GLU  87   1.674  -5.279  -9.596
  647    HB2  GLU  87           2HB      GLU  87  -0.741  -5.141  -8.344
  648    HB3  GLU  87           1HB      GLU  87  -0.450  -3.425  -8.588
  649    HG2  GLU  87           2HG      GLU  87  -1.792  -4.334 -10.377
  650    HG3  GLU  87           1HG      GLU  87  -0.229  -3.798 -10.985
  651    HA   PRO  88           HA       PRO  88   4.468  -3.031 -10.737
  652    HB2  PRO  88           2HB      PRO  88   3.612  -0.226 -10.441
  653    HB3  PRO  88           1HB      PRO  88   4.285  -1.054 -11.846
  654    HG2  PRO  88           2HG      PRO  88   1.490  -0.642 -11.134
  655    HG3  PRO  88           1HG      PRO  88   2.170  -1.237 -12.661
  656    HD2  PRO  88           2HD      PRO  88   0.728  -2.835 -11.024
  657    HD3  PRO  88           1HD      PRO  88   2.111  -3.462 -11.954
  658    H    ARG  89           HN       ARG  89   6.238  -2.859  -9.612
  659    HA   ARG  89           HA       ARG  89   5.951  -2.371  -6.759
  660    HB2  ARG  89           2HB      ARG  89   8.464  -3.328  -8.066
  661    HB3  ARG  89           1HB      ARG  89   7.852  -3.681  -6.455
  662    HG2  ARG  89           2HG      ARG  89   6.012  -4.972  -7.533
  663    HG3  ARG  89           1HG      ARG  89   6.855  -4.761  -9.069
  664    HD2  ARG  89           2HD      ARG  89   8.893  -5.666  -7.693
  665    HD3  ARG  89           1HD      ARG  89   7.625  -6.365  -6.688
  666    HE   ARG  89           HE       ARG  89   6.811  -7.185  -9.055
  667   HH11  ARG  89          1HH1      ARG  89  10.049  -7.093  -7.738
  668   HH12  ARG  89          2HH1      ARG  89  10.608  -8.449  -8.660
  669   HH21  ARG  89          1HH2      ARG  89   7.555  -8.970 -10.303
  670   HH22  ARG  89          2HH2      ARG  89   9.199  -9.503 -10.136
  671    H    MET  90           HN       MET  90   7.054  -0.802  -9.489
  672    HA   MET  90           HA       MET  90   8.721   1.001  -7.877
  673    HB2  MET  90           2HB      MET  90   8.716   0.502 -10.859
  674    HB3  MET  90           1HB      MET  90   9.665   1.753 -10.064
  675    HG2  MET  90           2HG      MET  90  10.855   0.048  -8.789
  676    HG3  MET  90           1HG      MET  90   9.904  -1.207  -9.582
  677    HE1  MET  90           3HE      MET  90  12.891   1.538 -11.785
  678    HE2  MET  90           1HE      MET  90  12.536   1.648 -10.060
  679    HE3  MET  90           2HE      MET  90  11.303   2.083 -11.243
  680    H    ALA  91           HN       ALA  91   8.186   3.113  -7.734
  681    HA   ALA  91           HA       ALA  91   5.680   3.898  -9.079
  682    HB1  ALA  91           1HB      ALA  91   6.618   4.693  -6.324
  683    HB2  ALA  91           2HB      ALA  91   5.362   3.506  -6.676
  684    HB3  ALA  91           3HB      ALA  91   5.119   5.202  -7.098
  685    H    ARG  92           HN       ARG  92   5.560   5.915  -9.933
  686    HA   ARG  92           HA       ARG  92   8.100   7.371 -10.016
  687    HB2  ARG  92           2HB      ARG  92   7.771   7.838 -12.224
  688    HB3  ARG  92           1HB      ARG  92   6.855   6.348 -12.137
  689    HG2  ARG  92           2HG      ARG  92   5.684   9.121 -12.000
  690    HG3  ARG  92           1HG      ARG  92   5.721   8.094 -13.429
  691    HD2  ARG  92           2HD      ARG  92   4.336   7.403 -10.842
  692    HD3  ARG  92           1HD      ARG  92   3.541   8.105 -12.247
  693    HE   ARG  92           HE       ARG  92   4.944   5.579 -12.638
  694   HH11  ARG  92          1HH1      ARG  92   1.923   7.285 -12.176
  695   HH12  ARG  92          2HH1      ARG  92   0.939   5.950 -12.707
  696   HH21  ARG  92          1HH2      ARG  92   3.658   3.824 -13.350
  697   HH22  ARG  92          2HH2      ARG  92   1.928   3.993 -13.376
  698    H    VAL  93           HN       VAL  93   8.189   9.462  -9.431
  699    HA   VAL  93           HA       VAL  93   5.683  10.870  -8.805
  700    HB   VAL  93           HB       VAL  93   8.099  10.769  -6.977
  701   HG11  VAL  93          1HG1      VAL  93   5.469  12.209  -6.648
  702   HG12  VAL  93          2HG1      VAL  93   7.027  12.966  -6.995
  703   HG13  VAL  93          3HG1      VAL  93   6.767  12.139  -5.456
  704   HG21  VAL  93          3HG2      VAL  93   6.731   8.726  -6.888
  705   HG22  VAL  93          1HG2      VAL  93   5.311   9.707  -6.534
  706   HG23  VAL  93          2HG2      VAL  93   6.646   9.647  -5.387
  707    H    GLN  94           HN       GLN  94   5.658  12.806  -9.736
  708    HA   GLN  94           HA       GLN  94   8.185  13.870 -10.774
  709    HB2  GLN  94           2HB      GLN  94   6.301  13.577 -12.355
  710    HB3  GLN  94           1HB      GLN  94   5.338  14.691 -11.395
  711    HG2  GLN  94           2HG      GLN  94   6.989  16.466 -11.853
  712    HG3  GLN  94           1HG      GLN  94   7.870  15.346 -12.886
  713   HE21  GLN  94          1HE2      GLN  94   6.709  17.852 -13.601
  714   HE22  GLN  94          2HE2      GLN  94   5.533  17.531 -14.827
  715    H    LEU  95           HN       LEU  95   9.164  15.449  -9.723
  716    HA   LEU  95           HA       LEU  95   7.580  17.049  -7.829
  717    HB2  LEU  95           2HB      LEU  95  10.561  16.569  -7.938
  718    HB3  LEU  95           1HB      LEU  95   9.737  17.559  -6.749
  719    HG   LEU  95           HG       LEU  95   9.302  14.593  -7.104
  720   HD11  LEU  95          1HD1      LEU  95  10.872  16.089  -5.015
  721   HD12  LEU  95          2HD1      LEU  95  11.548  15.081  -6.295
  722   HD13  LEU  95          3HD1      LEU  95  10.555  14.354  -5.031
  723   HD21  LEU  95          3HD2      LEU  95   8.351  16.517  -4.982
  724   HD22  LEU  95          1HD2      LEU  95   8.130  14.766  -4.956
  725   HD23  LEU  95          2HD2      LEU  95   7.351  15.734  -6.206
  726    H    GLU  96           HN       GLU  96   7.159  19.061  -8.345
  727    HA   GLU  96           HA       GLU  96   9.139  20.703  -9.674
  728    HB2  GLU  96           2HB      GLU  96   7.827  19.756 -11.560
  729    HB3  GLU  96           1HB      GLU  96   6.361  20.422 -10.848
  730    HG2  GLU  96           2HG      GLU  96   7.213  22.672 -11.135
  731    HG3  GLU  96           1HG      GLU  96   8.733  22.035 -11.757
  732    H    GLU  97           HN       GLU  97   8.906  22.865  -9.186
  733    HA   GLU  97           HA       GLU  97   7.690  23.558  -6.791
  734    HB2  GLU  97           2HB      GLU  97   9.518  24.828  -7.798
  735    HB3  GLU  97           1HB      GLU  97   8.466  25.330  -9.109
  736    HG2  GLU  97           2HG      GLU  97   7.119  26.631  -7.602
  737    HG3  GLU  97           1HG      GLU  97   8.031  26.029  -6.219
  738    H    ARG  98           HN       ARG  98   5.734  24.224  -6.213
  739    HA   ARG  98           HA       ARG  98   3.572  24.880  -6.243
  740    HB2  ARG  98           2HB      ARG  98   3.994  26.649  -7.684
  741    HB3  ARG  98           1HB      ARG  98   4.307  25.603  -9.045
  742    HG2  ARG  98           2HG      ARG  98   1.894  25.024  -9.073
  743    HG3  ARG  98           1HG      ARG  98   1.643  26.221  -7.797
  744    HD2  ARG  98           2HD      ARG  98   1.174  27.105 -10.067
  745    HD3  ARG  98           1HD      ARG  98   2.447  27.987  -9.222
  746    HE   ARG  98           HE       ARG  98   3.350  25.857 -10.972
  747   HH11  ARG  98          1HH1      ARG  98   2.689  29.290 -10.648
  748   HH12  ARG  98          2HH1      ARG  98   3.726  29.728 -11.979
  749   HH21  ARG  98          1HH2      ARG  98   4.705  26.445 -12.699
  750   HH22  ARG  98          2HH2      ARG  98   4.850  28.121 -13.147
  751    H    GLN  99           HN       GLN  99   1.597  23.921  -6.542
  752    HA   GLN  99           HA       GLN  99   1.870  21.215  -7.658
  753    HB2  GLN  99           2HB      GLN  99   1.677  21.613  -5.118
  754    HB3  GLN  99           1HB      GLN  99  -0.012  21.981  -5.449
  755    HG2  GLN  99           2HG      GLN  99  -0.067  19.728  -6.642
  756    HG3  GLN  99           1HG      GLN  99   1.453  19.410  -5.809
  757   HE21  GLN  99          1HE2      GLN  99   1.472  19.193  -3.559
  758   HE22  GLN  99          2HE2      GLN  99   0.009  18.913  -2.667
  759    H    THR 100           HN       THR 100   0.042  20.186  -8.533
  760    HA   THR 100           HA       THR 100  -2.499  21.503  -8.650
  761    HB   THR 100           HB       THR 100  -1.552  22.611 -10.559
  762    HG1  THR 100           1HG      THR 100  -3.486  22.246 -11.312
  763   HG21  THR 100          3HG2      THR 100   0.317  21.111 -11.039
  764   HG22  THR 100          1HG2      THR 100  -0.633  21.428 -12.492
  765   HG23  THR 100          2HG2      THR 100  -0.808  19.893 -11.642
  766    H    VAL 101           HN       VAL 101  -3.398  19.761  -7.643
  767    HA   VAL 101           HA       VAL 101  -3.220  17.180  -9.052
  768    HB   VAL 101           HB       VAL 101  -2.904  17.583  -6.073
  769   HG11  VAL 101          1HG1      VAL 101  -3.091  15.029  -7.669
  770   HG12  VAL 101          2HG1      VAL 101  -4.256  15.618  -6.482
  771   HG13  VAL 101          3HG1      VAL 101  -2.640  15.135  -5.966
  772   HG21  VAL 101          3HG2      VAL 101  -0.999  16.456  -8.126
  773   HG22  VAL 101          1HG2      VAL 101  -0.707  16.565  -6.388
  774   HG23  VAL 101          2HG2      VAL 101  -0.869  18.036  -7.349
  775    H    SER 102           HN       SER 102  -5.243  17.024  -9.801
  776    HA   SER 102           HA       SER 102  -7.396  17.011  -7.784
  777    HB2  SER 102           2HB      SER 102  -8.926  17.349  -9.810
  778    HB3  SER 102           1HB      SER 102  -7.939  18.732  -9.341
  779    HG   SER 102           HG       SER 102  -7.638  18.586 -11.484
  780    H    VAL 103           HN       VAL 103  -5.409  14.954  -8.778
  781    HA   VAL 103           HA       VAL 103  -7.003  12.983 -10.147
  782    HB   VAL 103           HB       VAL 103  -5.089  11.501  -9.920
  783   HG11  VAL 103          1HG1      VAL 103  -5.054  13.116 -11.731
  784   HG12  VAL 103          2HG1      VAL 103  -3.418  12.821 -11.136
  785   HG13  VAL 103          3HG1      VAL 103  -4.271  14.298 -10.681
  786   HG21  VAL 103          3HG2      VAL 103  -3.028  12.221  -8.790
  787   HG22  VAL 103          1HG2      VAL 103  -4.379  12.070  -7.665
  788   HG23  VAL 103          2HG2      VAL 103  -3.863  13.664  -8.213
  789    HA   PRO 104           HA       PRO 104  -8.607  11.118  -6.465
  790    HB2  PRO 104           2HB      PRO 104  -9.618   8.876  -7.501
  791    HB3  PRO 104           1HB      PRO 104 -10.283  10.457  -7.926
  792    HG2  PRO 104           2HG      PRO 104  -8.429   8.705  -9.478
  793    HG3  PRO 104           1HG      PRO 104  -9.794   9.678 -10.050
  794    HD2  PRO 104           2HD      PRO 104  -7.132  10.439 -10.189
  795    HD3  PRO 104           1HD      PRO 104  -8.516  11.547 -10.259
  796    H    VAL 105           HN       VAL 105  -8.419   9.169  -5.139
  797    HA   VAL 105           HA       VAL 105  -5.865   7.773  -5.552
  798    HB   VAL 105           HB       VAL 105  -7.562   7.844  -3.047
  799   HG11  VAL 105          1HG1      VAL 105  -4.708   6.976  -3.489
  800   HG12  VAL 105          2HG1      VAL 105  -6.082   5.907  -3.213
  801   HG13  VAL 105          3HG1      VAL 105  -5.550   7.006  -1.941
  802   HG21  VAL 105          3HG2      VAL 105  -5.129   9.484  -3.751
  803   HG22  VAL 105          1HG2      VAL 105  -5.923   9.453  -2.178
  804   HG23  VAL 105          2HG2      VAL 105  -6.780  10.085  -3.581
  805    H    THR 106           HN       THR 106  -5.799   5.534  -5.636
  806    HA   THR 106           HA       THR 106  -6.501   3.379  -5.787
  807    HB   THR 106           HB       THR 106  -9.224   4.430  -4.996
  808    HG1  THR 106           1HG      THR 106  -6.992   3.470  -3.601
  809   HG21  THR 106          3HG2      THR 106  -9.797   2.092  -4.549
  810   HG22  THR 106          1HG2      THR 106  -8.239   1.579  -5.198
  811   HG23  THR 106          2HG2      THR 106  -9.429   2.344  -6.254
  812    H    VAL 107           HN       VAL 107  -6.643   2.402  -7.659
  813    HA   VAL 107           HA       VAL 107  -8.271   3.651  -9.788
  814    HB   VAL 107           HB       VAL 107  -5.806   3.584 -10.189
  815   HG11  VAL 107          1HG1      VAL 107  -5.287   1.509  -9.034
  816   HG12  VAL 107          2HG1      VAL 107  -4.731   1.449 -10.707
  817   HG13  VAL 107          3HG1      VAL 107  -6.200   0.595 -10.234
  818   HG21  VAL 107          3HG2      VAL 107  -7.466   1.917 -12.075
  819   HG22  VAL 107          1HG2      VAL 107  -5.921   2.670 -12.467
  820   HG23  VAL 107          2HG2      VAL 107  -7.318   3.673 -12.084
  821    H    GLU 108           HN       GLU 108  -7.875   0.997  -7.789
  822    HA   GLU 108           HA       GLU 108  -9.134  -0.806  -7.365
  823    HB2  GLU 108           2HB      GLU 108 -11.066   0.554  -8.236
  824    HB3  GLU 108           1HB      GLU 108 -10.807  -0.216  -9.797
  825    HG2  GLU 108           2HG      GLU 108 -11.470  -2.296  -9.034
  826    HG3  GLU 108           1HG      GLU 108 -11.195  -1.874  -7.343
  827    H    MET 109           HN       MET 109  -7.466  -2.114  -7.676
  828    HA   MET 109           HA       MET 109  -6.977  -3.292 -10.289
  829    HB2  MET 109           2HB      MET 109  -5.207  -4.577  -8.925
  830    HB3  MET 109           1HB      MET 109  -4.967  -2.861  -9.204
  831    HG2  MET 109           2HG      MET 109  -4.368  -3.354  -6.952
  832    HG3  MET 109           1HG      MET 109  -5.852  -2.410  -6.935
  833    HE1  MET 109           3HE      MET 109  -8.268  -4.450  -4.981
  834    HE2  MET 109           1HE      MET 109  -8.297  -3.556  -6.501
  835    HE3  MET 109           2HE      MET 109  -7.444  -2.893  -5.107
  836    H    ILE 110           HN       ILE 110  -6.342  -5.800  -9.934
  837    HA   ILE 110           HA       ILE 110  -8.380  -7.174  -8.360
  838    HB   ILE 110           HB       ILE 110  -8.817  -8.746 -10.291
  839   HG12  ILE 110          2HG1      ILE 110  -7.692  -6.473 -11.941
  840   HG13  ILE 110          1HG1      ILE 110  -6.886  -8.015 -11.678
  841   HG21  ILE 110          1HG2      ILE 110 -10.493  -7.158  -9.578
  842   HG22  ILE 110          2HG2      ILE 110 -10.505  -7.291 -11.337
  843   HG23  ILE 110          3HG2      ILE 110  -9.756  -5.895 -10.563
  844   HD11  ILE 110          3HD1      ILE 110  -8.744  -9.160 -12.797
  845   HD12  ILE 110          1HD1      ILE 110  -7.972  -7.967 -13.843
  846   HD13  ILE 110          2HD1      ILE 110  -9.518  -7.601 -13.083
  847    H    ASN 111           HN       ASN 111  -7.616  -8.968  -7.422
  848    HA   ASN 111           HA       ASN 111  -5.029 -10.011  -8.344
  849    HB2  ASN 111           2HB      ASN 111  -4.728 -10.929  -6.080
  850    HB3  ASN 111           1HB      ASN 111  -4.955  -9.187  -6.037
  851   HD21  ASN 111          1HD2      ASN 111  -5.322 -11.099  -3.897
  852   HD22  ASN 111          2HD2      ASN 111  -6.980 -10.985  -3.420
  853    H    LEU 112           HN       LEU 112  -4.905 -12.066  -9.082
  854    HA   LEU 112           HA       LEU 112  -7.108 -13.904  -8.605
  855    HB2  LEU 112           2HB      LEU 112  -7.905 -12.541 -10.473
  856    HB3  LEU 112           1HB      LEU 112  -6.448 -12.905 -11.376
  857    HG   LEU 112           HG       LEU 112  -7.103 -15.306 -11.382
  858   HD11  LEU 112          1HD1      LEU 112  -8.516 -15.312  -9.402
  859   HD12  LEU 112          2HD1      LEU 112  -9.404 -15.899 -10.808
  860   HD13  LEU 112          3HD1      LEU 112  -9.677 -14.262 -10.211
  861   HD21  LEU 112          3HD2      LEU 112  -9.116 -13.389 -12.552
  862   HD22  LEU 112          1HD2      LEU 112  -8.854 -15.057 -13.067
  863   HD23  LEU 112          2HD2      LEU 112  -7.579 -13.856 -13.285
  864    H    GLU 113           HN       GLU 113  -6.192 -15.753  -8.154
  865    HA   GLU 113           HA       GLU 113  -4.156 -16.795 -10.002
  866    HB2  GLU 113           2HB      GLU 113  -2.955 -16.257  -7.967
  867    HB3  GLU 113           1HB      GLU 113  -4.176 -17.054  -6.985
  868    HG2  GLU 113           2HG      GLU 113  -2.139 -18.383  -7.186
  869    HG3  GLU 113           1HG      GLU 113  -3.537 -19.208  -7.865
  870    H    HIS 114           HN       HIS 114  -5.464 -18.101 -11.157
  871    HA   HIS 114           HA       HIS 114  -7.074 -20.069  -9.680
  872    HB2  HIS 114           2HB      HIS 114  -8.472 -18.134 -10.458
  873    HB3  HIS 114           1HB      HIS 114  -8.047 -18.551 -12.113
  874    HD1  HIS 114           1HD      HIS 114  -9.569 -20.359  -9.121
  875    HD2  HIS 114           2HD      HIS 114  -9.954 -20.085 -13.252
  876    HE1  HIS 114           1HE      HIS 114 -11.510 -21.839  -9.721
  877    HE2  HIS 114           2HE      HIS 114 -11.672 -21.734 -12.237
  878    H    HIS 115           HN       HIS 115  -4.811 -20.995 -10.423
  879    HA   HIS 115           HA       HIS 115  -5.175 -22.258 -13.051
  880    HB2  HIS 115           2HB      HIS 115  -2.728 -21.872 -11.328
  881    HB3  HIS 115           1HB      HIS 115  -2.751 -22.982 -12.694
  882    HD1  HIS 115           1HD      HIS 115  -2.540 -19.383 -11.812
  883    HD2  HIS 115           2HD      HIS 115  -2.899 -21.728 -15.236
  884    HE1  HIS 115           1HE      HIS 115  -2.032 -17.853 -13.751
  885    HE2  HIS 115           2HE      HIS 115  -2.450 -19.246 -15.809
  886    H    HIS 116           HN       HIS 116  -4.812 -24.543 -13.246
  887    HA   HIS 116           HA       HIS 116  -5.069 -26.051 -10.726
  888    HB2  HIS 116           2HB      HIS 116  -6.699 -26.527 -13.236
  889    HB3  HIS 116           1HB      HIS 116  -6.697 -27.567 -11.819
  890    HD1  HIS 116           1HD      HIS 116  -8.643 -25.029 -13.330
  891    HD2  HIS 116           2HD      HIS 116  -7.549 -25.903  -9.412
  892    HE1  HIS 116           1HE      HIS 116 -10.321 -23.849 -11.874
  893    HE2  HIS 116           2HE      HIS 116  -9.549 -24.260  -9.508
  894    H    HIS 117           HN       HIS 117  -3.500 -27.536 -10.605
  895    HA   HIS 117           HA       HIS 117  -1.737 -27.973 -12.791
  896    HB2  HIS 117           2HB      HIS 117  -1.044 -28.075 -10.390
  897    HB3  HIS 117           1HB      HIS 117  -1.942 -29.580 -10.233
  898    HD1  HIS 117           1HD      HIS 117  -0.975 -31.681 -11.459
  899    HD2  HIS 117           2HD      HIS 117   1.437 -28.295 -11.620
  900    HE1  HIS 117           1HE      HIS 117   1.276 -32.486 -12.239
  901    HE2  HIS 117           2HE      HIS 117   2.642 -30.389 -12.554
  902    H    HIS 118           HN       HIS 118  -2.449 -29.028 -14.527
  903    HA   HIS 118           HA       HIS 118  -3.254 -31.804 -14.108
  904    HB2  HIS 118           2HB      HIS 118  -4.886 -31.669 -15.978
  905    HB3  HIS 118           1HB      HIS 118  -5.350 -30.695 -14.593
  906    HD1  HIS 118           1HD      HIS 118  -6.017 -28.361 -15.089
  907    HD2  HIS 118           2HD      HIS 118  -3.738 -30.010 -18.151
  908    HE1  HIS 118           1HE      HIS 118  -6.038 -26.661 -16.945
  909    HE2  HIS 118           2HE      HIS 118  -4.537 -27.615 -18.733
  910    H    HIS 119           HN       HIS 119  -2.701 -33.200 -15.852
  911    HA   HIS 119           HA       HIS 119  -0.198 -32.424 -17.045
  912    HB2  HIS 119           2HB      HIS 119  -0.551 -34.674 -16.062
  913    HB3  HIS 119           1HB      HIS 119  -1.756 -35.008 -17.302
  914    HD1  HIS 119           1HD      HIS 119  -0.819 -35.197 -19.802
  915    HD2  HIS 119           2HD      HIS 119   2.049 -35.140 -16.792
  916    HE1  HIS 119           1HE      HIS 119   1.286 -36.064 -20.858
  917    HE2  HIS 119           2HE      HIS 119   2.927 -36.244 -18.962
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1  -7.488 -31.732  10.818
    2    H2   MET   1           H2       MET   1  -5.991 -32.525  10.736
    3    H3   MET   1           H3       MET   1  -7.114 -32.707   9.479
    4    HA   MET   1           HA       MET   1  -6.904 -30.413   8.878
    5    HB2  MET   1           2HB      MET   1  -6.430 -29.588  11.176
    6    HB3  MET   1           1HB      MET   1  -4.824 -30.297  11.080
    7    HG2  MET   1           2HG      MET   1  -4.274 -28.814   9.226
    8    HG3  MET   1           1HG      MET   1  -5.888 -28.108   9.308
    9    HE1  MET   1           2HE      MET   1  -3.426 -26.242   9.317
   10    HE2  MET   1           3HE      MET   1  -3.768 -25.158  10.666
   11    HE3  MET   1           1HE      MET   1  -5.065 -25.644   9.575
   12    HA   PRO   2           HA       PRO   2  -3.787 -32.299   6.286
   13    HB2  PRO   2           2HB      PRO   2  -3.989 -29.820   4.716
   14    HB3  PRO   2           1HB      PRO   2  -4.373 -31.477   4.243
   15    HG2  PRO   2           2HG      PRO   2  -6.288 -29.634   4.626
   16    HG3  PRO   2           1HG      PRO   2  -6.534 -31.342   5.040
   17    HD2  PRO   2           2HD      PRO   2  -5.867 -29.033   6.835
   18    HD3  PRO   2           1HD      PRO   2  -7.032 -30.352   7.085
   19    H    THR   3           HN       THR   3  -1.820 -31.192   4.962
   20    HA   THR   3           HA       THR   3  -0.075 -30.168   6.992
   21    HB   THR   3           HB       THR   3   1.602 -30.084   5.091
   22    HG1  THR   3           1HG      THR   3  -0.530 -30.245   3.590
   23   HG21  THR   3          3HG2      THR   3   0.192 -32.707   5.577
   24   HG22  THR   3          1HG2      THR   3   1.422 -31.988   6.616
   25   HG23  THR   3          2HG2      THR   3   1.842 -32.508   4.985
   26    H    PHE   4           HN       PHE   4   1.564 -28.388   5.637
   27    HA   PHE   4           HA       PHE   4   0.260 -25.962   6.064
   28    HB2  PHE   4           2HB      PHE   4   2.836 -26.708   4.778
   29    HB3  PHE   4           1HB      PHE   4   2.301 -25.041   4.805
   30    HD1  PHE   4           2HD      PHE   4   1.992 -23.883   6.974
   31    HD2  PHE   4           1HD      PHE   4   3.719 -27.762   6.706
   32    HE1  PHE   4           2HE      PHE   4   2.916 -23.626   9.243
   33    HE2  PHE   4           1HE      PHE   4   4.645 -27.515   8.969
   34    HZ   PHE   4           HZ       PHE   4   4.243 -25.445  10.241
   35    H    ASP   5           HN       ASP   5  -0.438 -24.366   4.681
   36    HA   ASP   5           HA       ASP   5  -0.795 -25.008   1.874
   37    HB2  ASP   5           2HB      ASP   5  -2.817 -25.887   2.943
   38    HB3  ASP   5           1HB      ASP   5  -3.082 -24.341   3.745
   39    H    HIS   6           HN       HIS   6   0.395 -23.366   1.214
   40    HA   HIS   6           HA       HIS   6   0.434 -20.772   2.251
   41    HB2  HIS   6           2HB      HIS   6   1.535 -20.086   0.191
   42    HB3  HIS   6           1HB      HIS   6   2.164 -21.649   0.690
   43    HD1  HIS   6           1HD      HIS   6   1.125 -19.921  -2.234
   44    HD2  HIS   6           2HD      HIS   6   0.687 -23.827  -0.850
   45    HE1  HIS   6           1HE      HIS   6   0.565 -21.305  -4.254
   46    HE2  HIS   6           2HE      HIS   6   0.106 -23.617  -3.367
   47    H    GLY   7           HN       GLY   7  -1.209 -19.459   2.444
   48    HA2  GLY   7           2HA      GLY   7  -3.311 -19.497   0.382
   49    HA3  GLY   7           1HA      GLY   7  -3.535 -18.961   2.045
   50    H    ASN   8           HN       ASN   8  -4.458 -17.236   0.338
   51    HA   ASN   8           HA       ASN   8  -2.350 -15.194   0.107
   52    HB2  ASN   8           2HB      ASN   8  -4.843 -15.434  -1.573
   53    HB3  ASN   8           1HB      ASN   8  -3.647 -14.162  -1.705
   54   HD21  ASN   8          1HD2      ASN   8  -1.688 -14.575  -2.675
   55   HD22  ASN   8          2HD2      ASN   8  -1.397 -16.002  -3.610
   56    H    LEU   9           HN       LEU   9  -2.827 -13.149   0.727
   57    HA   LEU   9           HA       LEU   9  -5.443 -12.600   1.920
   58    HB2  LEU   9           2HB      LEU   9  -3.973 -13.332   3.758
   59    HB3  LEU   9           1HB      LEU   9  -2.797 -12.113   3.302
   60    HG   LEU   9           HG       LEU   9  -4.463 -10.353   3.838
   61   HD11  LEU   9          1HD1      LEU   9  -6.496 -11.620   3.498
   62   HD12  LEU   9          2HD1      LEU   9  -6.445 -10.984   5.143
   63   HD13  LEU   9          3HD1      LEU   9  -6.086 -12.684   4.842
   64   HD21  LEU   9          3HD2      LEU   9  -4.341 -10.638   6.285
   65   HD22  LEU   9          1HD2      LEU   9  -2.801 -10.953   5.481
   66   HD23  LEU   9          2HD2      LEU   9  -3.795 -12.297   6.042
   67    H    SER  10           HN       SER  10  -6.157 -10.700   1.169
   68    HA   SER  10           HA       SER  10  -4.220  -9.006  -0.226
   69    HB2  SER  10           2HB      SER  10  -7.238  -9.017  -0.438
   70    HB3  SER  10           1HB      SER  10  -6.113  -8.152  -1.485
   71    HG   SER  10           HG       SER  10  -5.285 -10.605  -1.598
   72    H    LEU  11           HN       LEU  11  -3.668  -7.099   0.535
   73    HA   LEU  11           HA       LEU  11  -5.068  -5.935   2.794
   74    HB2  LEU  11           2HB      LEU  11  -2.751  -4.838   1.188
   75    HB3  LEU  11           1HB      LEU  11  -3.322  -4.226   2.727
   76    HG   LEU  11           HG       LEU  11  -2.102  -6.961   2.322
   77   HD11  LEU  11          1HD1      LEU  11  -0.889  -4.432   3.431
   78   HD12  LEU  11          2HD1      LEU  11  -0.467  -5.214   1.907
   79   HD13  LEU  11          3HD1      LEU  11  -0.132  -6.026   3.436
   80   HD21  LEU  11          3HD2      LEU  11  -2.814  -5.430   4.822
   81   HD22  LEU  11          1HD2      LEU  11  -1.925  -6.953   4.776
   82   HD23  LEU  11          2HD2      LEU  11  -3.600  -6.892   4.226
   83    H    GLY  12           HN       GLY  12  -5.248  -5.908  -0.552
   84    HA2  GLY  12           2HA      GLY  12  -6.895  -4.825  -1.834
   85    HA3  GLY  12           1HA      GLY  12  -7.101  -3.654  -0.535
   86    H    GLU  13           HN       GLU  13  -7.013  -2.134  -2.419
   87    HA   GLU  13           HA       GLU  13  -4.243  -1.560  -3.132
   88    HB2  GLU  13           2HB      GLU  13  -5.198   0.093  -4.731
   89    HB3  GLU  13           1HB      GLU  13  -5.638  -1.573  -5.060
   90    HG2  GLU  13           2HG      GLU  13  -7.831  -1.147  -3.992
   91    HG3  GLU  13           1HG      GLU  13  -7.372   0.549  -3.822
   92    H    LEU  14           HN       LEU  14  -3.197  -0.324  -1.823
   93    HA   LEU  14           HA       LEU  14  -4.667   1.404   0.020
   94    HB2  LEU  14           2HB      LEU  14  -1.805   0.440   0.058
   95    HB3  LEU  14           1HB      LEU  14  -2.553   1.424   1.301
   96    HG   LEU  14           HG       LEU  14  -3.446  -1.365   0.568
   97   HD11  LEU  14          1HD1      LEU  14  -2.390  -2.052   2.660
   98   HD12  LEU  14          2HD1      LEU  14  -1.782  -0.415   2.899
   99   HD13  LEU  14          3HD1      LEU  14  -1.204  -1.380   1.540
  100   HD21  LEU  14          3HD2      LEU  14  -5.223   0.011   1.498
  101   HD22  LEU  14          1HD2      LEU  14  -4.188   0.458   2.855
  102   HD23  LEU  14          2HD2      LEU  14  -4.718  -1.213   2.663
  103    H    GLU  15           HN       GLU  15  -4.145   3.548   0.349
  104    HA   GLU  15           HA       GLU  15  -3.007   4.986  -1.854
  105    HB2  GLU  15           2HB      GLU  15  -3.753   5.964   0.913
  106    HB3  GLU  15           1HB      GLU  15  -3.407   6.979  -0.477
  107    HG2  GLU  15           2HG      GLU  15  -5.377   6.181  -1.610
  108    HG3  GLU  15           1HG      GLU  15  -5.694   5.029  -0.313
  109    H    LEU  16           HN       LEU  16  -0.937   5.669  -2.070
  110    HA   LEU  16           HA       LEU  16   0.845   5.245   0.221
  111    HB2  LEU  16           2HB      LEU  16   2.675   4.897  -1.318
  112    HB3  LEU  16           1HB      LEU  16   1.388   3.747  -1.603
  113    HG   LEU  16           HG       LEU  16   1.528   6.218  -3.278
  114   HD11  LEU  16          1HD1      LEU  16   3.789   5.346  -3.280
  115   HD12  LEU  16          2HD1      LEU  16   3.006   5.027  -4.830
  116   HD13  LEU  16          3HD1      LEU  16   3.185   3.731  -3.645
  117   HD21  LEU  16          3HD2      LEU  16   0.605   4.682  -4.961
  118   HD22  LEU  16          1HD2      LEU  16  -0.400   4.753  -3.517
  119   HD23  LEU  16          2HD2      LEU  16   0.662   3.371  -3.783
  120    H    THR  17           HN       THR  17   2.381   6.792   0.715
  121    HA   THR  17           HA       THR  17   1.875   9.428  -0.500
  122    HB   THR  17           HB       THR  17   2.819   8.853   2.317
  123    HG1  THR  17           1HG      THR  17   0.329   8.830   1.215
  124   HG21  THR  17          3HG2      THR  17   3.523  11.040   1.468
  125   HG22  THR  17          1HG2      THR  17   2.300  11.211   2.728
  126   HG23  THR  17          2HG2      THR  17   1.855  11.410   1.032
  127    H    VAL  18           HN       VAL  18   3.614  10.592  -1.241
  128    HA   VAL  18           HA       VAL  18   6.269   9.375  -0.879
  129    HB   VAL  18           HB       VAL  18   5.310  11.369  -2.947
  130   HG11  VAL  18          1HG1      VAL  18   8.047  10.146  -2.602
  131   HG12  VAL  18          2HG1      VAL  18   7.624  11.840  -2.343
  132   HG13  VAL  18          3HG1      VAL  18   7.531  11.143  -3.962
  133   HG21  VAL  18          3HG2      VAL  18   5.797   9.543  -4.532
  134   HG22  VAL  18          1HG2      VAL  18   4.527   9.122  -3.384
  135   HG23  VAL  18          2HG2      VAL  18   6.157   8.482  -3.170
  136    H    LEU  19           HN       LEU  19   7.763  10.378   0.273
  137    HA   LEU  19           HA       LEU  19   6.990  12.793   1.683
  138    HB2  LEU  19           2HB      LEU  19   9.394  11.001   2.017
  139    HB3  LEU  19           1HB      LEU  19   8.949  12.319   3.085
  140    HG   LEU  19           HG       LEU  19   7.335   9.807   2.632
  141   HD11  LEU  19          1HD1      LEU  19   7.959   9.283   4.944
  142   HD12  LEU  19          2HD1      LEU  19   9.001  10.706   4.977
  143   HD13  LEU  19          3HD1      LEU  19   9.365   9.371   3.883
  144   HD21  LEU  19          3HD2      LEU  19   5.948  11.781   3.115
  145   HD22  LEU  19          1HD2      LEU  19   6.898  12.076   4.573
  146   HD23  LEU  19          2HD2      LEU  19   5.924  10.611   4.435
  147    H    TYR  20           HN       TYR  20   7.870  14.720   1.454
  148    HA   TYR  20           HA       TYR  20  10.249  15.167  -0.133
  149    HB2  TYR  20           2HB      TYR  20   9.116  16.587  -1.782
  150    HB3  TYR  20           1HB      TYR  20   8.472  14.949  -1.851
  151    HD1  TYR  20           2HD      TYR  20   6.314  14.543  -0.400
  152    HD2  TYR  20           1HD      TYR  20   7.630  18.375  -1.697
  153    HE1  TYR  20           2HE      TYR  20   4.041  15.419  -0.085
  154    HE2  TYR  20           1HE      TYR  20   5.356  19.268  -1.382
  155    HH   TYR  20           HH       TYR  20   2.992  17.679   0.373
  156    H    ASP  21           HN       ASP  21  11.020  17.342   0.086
  157    HA   ASP  21           HA       ASP  21  10.088  18.801   2.366
  158    HB2  ASP  21           2HB      ASP  21  12.458  18.873   1.671
  159    HB3  ASP  21           1HB      ASP  21  11.990  19.665   0.168
  160    H    GLU  22           HN       GLU  22   8.407  20.142   2.406
  161    HA   GLU  22           HA       GLU  22   6.877  20.407  -0.002
  162    HB2  GLU  22           2HB      GLU  22   6.268  21.476   2.757
  163    HB3  GLU  22           1HB      GLU  22   5.127  21.282   1.433
  164    HG2  GLU  22           2HG      GLU  22   5.553  18.841   1.489
  165    HG3  GLU  22           1HG      GLU  22   6.564  19.088   2.908
  166    H    GLU  23           HN       GLU  23   9.363  22.238   1.133
  167    HA   GLU  23           HA       GLU  23   8.258  24.763   0.167
  168    HB2  GLU  23           2HB      GLU  23  10.976  24.108   1.315
  169    HB3  GLU  23           1HB      GLU  23  10.398  25.712   0.910
  170    HG2  GLU  23           2HG      GLU  23   8.606  25.432   2.591
  171    HG3  GLU  23           1HG      GLU  23   9.338  23.894   3.042
  172    H    ARG  24           HN       ARG  24  10.507  22.225  -0.665
  173    HA   ARG  24           HA       ARG  24  11.782  23.720  -2.765
  174    HB2  ARG  24           2HB      ARG  24  11.947  20.764  -2.189
  175    HB3  ARG  24           1HB      ARG  24  13.047  21.698  -3.186
  176    HG2  ARG  24           2HG      ARG  24  12.674  21.951  -0.214
  177    HG3  ARG  24           1HG      ARG  24  14.047  21.226  -1.047
  178    HD2  ARG  24           2HD      ARG  24  14.562  23.407  -2.061
  179    HD3  ARG  24           1HD      ARG  24  13.208  24.120  -1.185
  180    HE   ARG  24           HE       ARG  24  15.100  22.785   0.516
  181   HH11  ARG  24          1HH1      ARG  24  14.358  25.802  -1.099
  182   HH12  ARG  24          2HH1      ARG  24  15.265  26.767   0.022
  183   HH21  ARG  24          1HH2      ARG  24  16.298  24.039   1.978
  184   HH22  ARG  24          2HH2      ARG  24  16.347  25.771   1.791
  185    H    TYR  25           HN       TYR  25   9.532  20.948  -2.649
  186    HA   TYR  25           HA       TYR  25   8.904  21.447  -5.487
  187    HB2  TYR  25           2HB      TYR  25   9.146  18.668  -4.335
  188    HB3  TYR  25           1HB      TYR  25   9.001  19.135  -6.021
  189    HD1  TYR  25           2HD      TYR  25  10.977  20.319  -7.112
  190    HD2  TYR  25           1HD      TYR  25  11.233  18.374  -3.335
  191    HE1  TYR  25           2HE      TYR  25  13.420  20.210  -7.337
  192    HE2  TYR  25           1HE      TYR  25  13.678  18.264  -3.553
  193    HH   TYR  25           HH       TYR  25  15.352  18.270  -5.371
  194    H    ASP  26           HN       ASP  26   6.897  20.361  -6.155
  195    HA   ASP  26           HA       ASP  26   5.130  19.536  -3.969
  196    HB2  ASP  26           2HB      ASP  26   4.712  21.947  -4.894
  197    HB3  ASP  26           1HB      ASP  26   4.028  21.114  -6.278
  198    H    ILE  27           HN       ILE  27   3.227  18.321  -4.902
  199    HA   ILE  27           HA       ILE  27   4.410  16.341  -6.703
  200    HB   ILE  27           HB       ILE  27   1.886  16.163  -5.045
  201   HG12  ILE  27          2HG1      ILE  27   4.651  15.021  -4.557
  202   HG13  ILE  27          1HG1      ILE  27   3.919  16.356  -3.669
  203   HG21  ILE  27          1HG2      ILE  27   1.860  14.702  -7.012
  204   HG22  ILE  27          2HG2      ILE  27   1.982  13.772  -5.518
  205   HG23  ILE  27          3HG2      ILE  27   3.410  14.018  -6.524
  206   HD11  ILE  27          3HD1      ILE  27   2.881  13.531  -3.740
  207   HD12  ILE  27          1HD1      ILE  27   2.222  14.867  -2.796
  208   HD13  ILE  27          2HD1      ILE  27   3.832  14.244  -2.436
  209    H    VAL  28           HN       VAL  28   4.040  16.597  -8.791
  210    HA   VAL  28           HA       VAL  28   1.593  17.816  -9.770
  211    HB   VAL  28           HB       VAL  28   3.885  16.598 -11.329
  212   HG11  VAL  28          1HG1      VAL  28   1.687  18.466 -12.212
  213   HG12  VAL  28          2HG1      VAL  28   1.798  16.750 -12.602
  214   HG13  VAL  28          3HG1      VAL  28   3.011  17.875 -13.214
  215   HG21  VAL  28          3HG2      VAL  28   4.677  18.445  -9.967
  216   HG22  VAL  28          1HG2      VAL  28   3.369  19.470 -10.559
  217   HG23  VAL  28          2HG2      VAL  28   4.630  18.923 -11.664
  218    H    GLU  29           HN       GLU  29   3.270  14.697 -10.040
  219    HA   GLU  29           HA       GLU  29   0.672  13.366 -10.212
  220    HB2  GLU  29           2HB      GLU  29   2.960  12.980 -12.134
  221    HB3  GLU  29           1HB      GLU  29   1.769  11.718 -11.856
  222    HG2  GLU  29           2HG      GLU  29   0.021  13.448 -12.479
  223    HG3  GLU  29           1HG      GLU  29   1.369  14.430 -13.058
  224    H    GLN  30           HN       GLN  30   0.730  11.171  -9.545
  225    HA   GLN  30           HA       GLN  30   3.097   9.980  -8.478
  226    HB2  GLN  30           2HB      GLN  30   2.529  11.667  -6.703
  227    HB3  GLN  30           1HB      GLN  30   0.975  10.869  -6.505
  228    HG2  GLN  30           2HG      GLN  30   2.411   8.750  -6.084
  229    HG3  GLN  30           1HG      GLN  30   3.702   9.908  -5.770
  230   HE21  GLN  30          1HE2      GLN  30   0.673   8.622  -4.692
  231   HE22  GLN  30          2HE2      GLN  30   0.699   9.336  -3.113
  232    H    THR  31           HN       THR  31   2.712   7.778  -7.909
  233    HA   THR  31           HA       THR  31   0.450   6.483  -8.960
  234    HB   THR  31           HB       THR  31   2.208   5.444  -6.727
  235    HG1  THR  31           1HG      THR  31   2.652   5.648  -9.534
  236   HG21  THR  31          3HG2      THR  31   0.667   4.045  -8.917
  237   HG22  THR  31          1HG2      THR  31   0.251   4.063  -7.201
  238   HG23  THR  31          2HG2      THR  31   1.722   3.256  -7.746
  239    H    GLU  32           HN       GLU  32  -1.546   6.110  -8.117
  240    HA   GLU  32           HA       GLU  32  -2.226   7.672  -5.782
  241    HB2  GLU  32           2HB      GLU  32  -3.988   6.095  -7.661
  242    HB3  GLU  32           1HB      GLU  32  -4.543   7.241  -6.448
  243    HG2  GLU  32           2HG      GLU  32  -3.657   9.073  -7.610
  244    HG3  GLU  32           1HG      GLU  32  -2.661   8.046  -8.640
  245    H    THR  33           HN       THR  33  -3.243   4.389  -6.775
  246    HA   THR  33           HA       THR  33  -2.860   3.551  -3.983
  247    HB   THR  33           HB       THR  33  -4.857   2.005  -4.353
  248    HG1  THR  33           1HG      THR  33  -6.071   2.267  -6.105
  249   HG21  THR  33          3HG2      THR  33  -6.511   3.737  -3.823
  250   HG22  THR  33          1HG2      THR  33  -5.371   4.979  -4.336
  251   HG23  THR  33          2HG2      THR  33  -5.011   3.982  -2.925
  252    H    VAL  34           HN       VAL  34  -2.117   1.459  -3.678
  253    HA   VAL  34           HA       VAL  34  -1.408  -0.000  -6.138
  254    HB   VAL  34           HB       VAL  34   0.618  -0.842  -4.926
  255   HG11  VAL  34          1HG1      VAL  34   0.779   0.888  -6.611
  256   HG12  VAL  34          2HG1      VAL  34   1.933   1.188  -5.312
  257   HG13  VAL  34          3HG1      VAL  34   0.443   2.128  -5.401
  258   HG21  VAL  34          3HG2      VAL  34  -0.057   1.384  -3.000
  259   HG22  VAL  34          1HG2      VAL  34   1.447   0.463  -3.014
  260   HG23  VAL  34          2HG2      VAL  34  -0.077  -0.342  -2.641
  261    H    GLN  35           HN       GLN  35  -1.494  -2.214  -6.074
  262    HA   GLN  35           HA       GLN  35  -3.271  -3.248  -4.003
  263    HB2  GLN  35           2HB      GLN  35  -2.501  -4.332  -6.717
  264    HB3  GLN  35           1HB      GLN  35  -3.600  -5.136  -5.602
  265    HG2  GLN  35           2HG      GLN  35  -5.201  -3.416  -5.785
  266    HG3  GLN  35           1HG      GLN  35  -4.060  -2.345  -6.594
  267   HE21  GLN  35          1HE2      GLN  35  -3.595  -2.669  -8.763
  268   HE22  GLN  35          2HE2      GLN  35  -4.579  -3.667  -9.780
  269    H    VAL  36           HN       VAL  36  -2.558  -4.449  -2.435
  270    HA   VAL  36           HA       VAL  36  -0.006  -5.897  -2.761
  271    HB   VAL  36           HB       VAL  36  -1.071  -4.808  -0.152
  272   HG11  VAL  36          1HG1      VAL  36   1.653  -5.828  -0.936
  273   HG12  VAL  36          2HG1      VAL  36   0.456  -6.710   0.014
  274   HG13  VAL  36          3HG1      VAL  36   1.179  -5.236   0.658
  275   HG21  VAL  36          3HG2      VAL  36  -0.586  -2.940  -1.643
  276   HG22  VAL  36          1HG2      VAL  36   1.021  -3.595  -1.955
  277   HG23  VAL  36          2HG2      VAL  36   0.597  -3.031  -0.338
  278    H    ASP  37           HN       ASP  37  -0.198  -8.000  -2.653
  279    HA   ASP  37           HA       ASP  37  -2.273  -9.180  -0.930
  280    HB2  ASP  37           2HB      ASP  37  -2.929  -9.443  -3.291
  281    HB3  ASP  37           1HB      ASP  37  -1.378 -10.194  -3.643
  282    H    LEU  38           HN       LEU  38  -1.587 -10.910   0.313
  283    HA   LEU  38           HA       LEU  38   1.327 -11.337   0.262
  284    HB2  LEU  38           2HB      LEU  38  -0.538 -11.469   2.632
  285    HB3  LEU  38           1HB      LEU  38   1.202 -11.675   2.676
  286    HG   LEU  38           HG       LEU  38  -0.234  -9.121   1.934
  287   HD11  LEU  38          1HD1      LEU  38   1.257  -9.899   4.436
  288   HD12  LEU  38          2HD1      LEU  38  -0.482  -9.636   4.293
  289   HD13  LEU  38          3HD1      LEU  38   0.635  -8.289   4.073
  290   HD21  LEU  38          3HD2      LEU  38   1.986  -8.103   2.032
  291   HD22  LEU  38          1HD2      LEU  38   1.910  -9.355   0.792
  292   HD23  LEU  38          2HD2      LEU  38   2.702  -9.687   2.333
  293    H    GLU  39           HN       GLU  39   2.122 -13.370   0.392
  294    HA   GLU  39           HA       GLU  39   0.176 -15.574   0.560
  295    HB2  GLU  39           2HB      GLU  39   2.461 -15.112  -1.230
  296    HB3  GLU  39           1HB      GLU  39   2.418 -16.710  -0.511
  297    HG2  GLU  39           2HG      GLU  39   0.007 -16.823  -1.315
  298    HG3  GLU  39           1HG      GLU  39   0.411 -15.423  -2.309
  299    H    GLY  40           HN       GLY  40   0.710 -17.370   1.798
  300    HA2  GLY  40           2HA      GLY  40   3.048 -18.146   2.915
  301    HA3  GLY  40           1HA      GLY  40   2.532 -16.849   3.986
  302    HA   PRO  41           HA       PRO  41   0.690 -20.907   5.441
  303    HB2  PRO  41           2HB      PRO  41   1.464 -19.686   8.031
  304    HB3  PRO  41           1HB      PRO  41   1.694 -21.341   7.454
  305    HG2  PRO  41           2HG      PRO  41   3.748 -19.642   7.626
  306    HG3  PRO  41           1HG      PRO  41   3.624 -20.815   6.301
  307    HD2  PRO  41           2HD      PRO  41   3.047 -17.879   6.290
  308    HD3  PRO  41           1HD      PRO  41   3.818 -18.882   5.043
  309    H    ARG  42           HN       ARG  42  -1.440 -20.872   5.676
  310    HA   ARG  42           HA       ARG  42  -3.011 -18.616   5.917
  311    HB2  ARG  42           2HB      ARG  42  -4.887 -20.095   6.418
  312    HB3  ARG  42           1HB      ARG  42  -3.885 -20.767   5.139
  313    HG2  ARG  42           2HG      ARG  42  -2.905 -22.348   6.650
  314    HG3  ARG  42           1HG      ARG  42  -3.709 -21.593   8.028
  315    HD2  ARG  42           2HD      ARG  42  -4.852 -23.639   7.329
  316    HD3  ARG  42           1HD      ARG  42  -5.880 -22.222   7.132
  317    HE   ARG  42           HE       ARG  42  -4.870 -22.423   4.690
  318   HH11  ARG  42          1HH1      ARG  42  -6.187 -24.868   6.808
  319   HH12  ARG  42          2HH1      ARG  42  -6.694 -25.910   5.518
  320   HH21  ARG  42          1HH2      ARG  42  -5.525 -23.773   2.982
  321   HH22  ARG  42          2HH2      ARG  42  -6.301 -25.294   3.330
  322    H    GLY  43           HN       GLY  43  -1.632 -20.598   8.466
  323    HA2  GLY  43           2HA      GLY  43  -3.110 -19.661  10.646
  324    HA3  GLY  43           1HA      GLY  43  -1.450 -20.235  10.723
  325    H    VAL  44           HN       VAL  44  -0.080 -18.384   9.290
  326    HA   VAL  44           HA       VAL  44   0.175 -16.254  11.133
  327    HB   VAL  44           HB       VAL  44   1.264 -16.403   8.311
  328   HG11  VAL  44          1HG1      VAL  44   2.941 -14.808   9.083
  329   HG12  VAL  44          2HG1      VAL  44   2.164 -14.746  10.666
  330   HG13  VAL  44          3HG1      VAL  44   1.314 -14.145   9.244
  331   HG21  VAL  44          3HG2      VAL  44   3.318 -17.236   9.344
  332   HG22  VAL  44          1HG2      VAL  44   1.961 -18.326   9.629
  333   HG23  VAL  44          2HG2      VAL  44   2.520 -17.258  10.918
  334    H    LEU  45           HN       LEU  45  -1.273 -16.496   7.918
  335    HA   LEU  45           HA       LEU  45  -1.898 -13.799   7.526
  336    HB2  LEU  45           2HB      LEU  45  -3.416 -16.227   6.576
  337    HB3  LEU  45           1HB      LEU  45  -3.576 -14.608   5.924
  338    HG   LEU  45           HG       LEU  45  -1.073 -16.293   5.805
  339   HD11  LEU  45          1HD1      LEU  45  -2.819 -17.192   4.387
  340   HD12  LEU  45          2HD1      LEU  45  -1.562 -16.435   3.407
  341   HD13  LEU  45          3HD1      LEU  45  -3.091 -15.599   3.679
  342   HD21  LEU  45          3HD2      LEU  45  -1.721 -13.617   4.578
  343   HD22  LEU  45          1HD2      LEU  45  -0.260 -14.561   4.281
  344   HD23  LEU  45          2HD2      LEU  45  -0.581 -13.913   5.890
  345    H    THR  46           HN       THR  46  -3.673 -16.366   9.159
  346    HA   THR  46           HA       THR  46  -6.029 -14.859   9.628
  347    HB   THR  46           HB       THR  46  -5.008 -17.237  11.194
  348    HG1  THR  46           1HG      THR  46  -5.158 -17.774   8.994
  349   HG21  THR  46          3HG2      THR  46  -7.792 -16.132  10.807
  350   HG22  THR  46          1HG2      THR  46  -6.853 -16.095  12.300
  351   HG23  THR  46          2HG2      THR  46  -7.402 -17.636  11.640
  352    H    VAL  47           HN       VAL  47  -3.191 -15.608  11.648
  353    HA   VAL  47           HA       VAL  47  -4.040 -14.280  13.967
  354    HB   VAL  47           HB       VAL  47  -1.227 -14.762  12.974
  355   HG11  VAL  47          1HG1      VAL  47  -1.290 -12.962  14.643
  356   HG12  VAL  47          2HG1      VAL  47  -0.497 -14.408  15.268
  357   HG13  VAL  47          3HG1      VAL  47  -2.150 -14.029  15.752
  358   HG21  VAL  47          3HG2      VAL  47  -1.267 -16.641  14.563
  359   HG22  VAL  47          1HG2      VAL  47  -2.479 -16.810  13.294
  360   HG23  VAL  47          2HG2      VAL  47  -2.961 -16.290  14.910
  361    H    PHE  48           HN       PHE  48  -2.157 -13.133  11.194
  362    HA   PHE  48           HA       PHE  48  -1.659 -10.534  12.171
  363    HB2  PHE  48           2HB      PHE  48  -0.421 -11.555  10.289
  364    HB3  PHE  48           1HB      PHE  48  -1.874 -11.473   9.301
  365    HD1  PHE  48           1HD      PHE  48   0.567  -9.375  11.141
  366    HD2  PHE  48           2HD      PHE  48  -2.355  -9.564   8.053
  367    HE1  PHE  48           1HE      PHE  48   1.211  -7.120  10.400
  368    HE2  PHE  48           2HE      PHE  48  -1.718  -7.306   7.307
  369    HZ   PHE  48           HZ       PHE  48   0.067  -6.081   8.480
  370    H    ARG  49           HN       ARG  49  -4.352 -11.932  10.393
  371    HA   ARG  49           HA       ARG  49  -5.585  -9.451   9.764
  372    HB2  ARG  49           2HB      ARG  49  -6.036 -12.215   9.227
  373    HB3  ARG  49           1HB      ARG  49  -7.533 -11.497   9.794
  374    HG2  ARG  49           2HG      ARG  49  -5.874 -10.302   7.593
  375    HG3  ARG  49           1HG      ARG  49  -7.152 -11.479   7.305
  376    HD2  ARG  49           2HD      ARG  49  -7.993  -9.230   6.957
  377    HD3  ARG  49           1HD      ARG  49  -8.771  -9.956   8.360
  378    HE   ARG  49           HE       ARG  49  -6.936  -8.623   9.619
  379   HH11  ARG  49          1HH1      ARG  49  -8.694  -7.551   6.788
  380   HH12  ARG  49          2HH1      ARG  49  -8.554  -5.870   7.193
  381   HH21  ARG  49          1HH2      ARG  49  -6.759  -6.415  10.153
  382   HH22  ARG  49          2HH2      ARG  49  -7.467  -5.226   9.095
  383    H    PHE  50           HN       PHE  50  -5.429 -11.242  12.653
  384    HA   PHE  50           HA       PHE  50  -7.910 -10.386  13.760
  385    HB2  PHE  50           2HB      PHE  50  -5.390 -11.560  14.892
  386    HB3  PHE  50           1HB      PHE  50  -6.631 -10.926  15.953
  387    HD1  PHE  50           2HD      PHE  50  -9.119 -11.743  14.962
  388    HD2  PHE  50           1HD      PHE  50  -5.425 -13.849  14.782
  389    HE1  PHE  50           2HE      PHE  50 -10.345 -13.870  14.803
  390    HE2  PHE  50           1HE      PHE  50  -6.646 -15.979  14.620
  391    HZ   PHE  50           HZ       PHE  50  -9.106 -15.991  14.633
  392    H    ALA  51           HN       ALA  51  -4.826  -8.947  13.306
  393    HA   ALA  51           HA       ALA  51  -5.262  -6.895  15.309
  394    HB1  ALA  51           1HB      ALA  51  -2.964  -7.283  13.394
  395    HB2  ALA  51           2HB      ALA  51  -3.024  -7.858  15.060
  396    HB3  ALA  51           3HB      ALA  51  -3.028  -6.125  14.722
  397    H    ARG  52           HN       ARG  52  -5.224  -4.672  14.785
  398    HA   ARG  52           HA       ARG  52  -6.670  -3.993  12.407
  399    HB2  ARG  52           2HB      ARG  52  -5.761  -2.565  14.860
  400    HB3  ARG  52           1HB      ARG  52  -6.214  -1.624  13.455
  401    HG2  ARG  52           2HG      ARG  52  -8.409  -2.796  13.460
  402    HG3  ARG  52           1HG      ARG  52  -7.934  -3.557  14.981
  403    HD2  ARG  52           2HD      ARG  52  -7.815  -1.447  16.083
  404    HD3  ARG  52           1HD      ARG  52  -7.994  -0.575  14.560
  405    HE   ARG  52           HE       ARG  52 -10.155  -2.273  15.630
  406   HH11  ARG  52          1HH1      ARG  52  -8.985   0.800  14.401
  407   HH12  ARG  52          2HH1      ARG  52 -10.568   1.518  14.354
  408   HH21  ARG  52          1HH2      ARG  52 -12.224  -1.332  15.568
  409   HH22  ARG  52          2HH2      ARG  52 -12.412   0.317  15.021
  410    HA   PRO  53           HA       PRO  53  -3.422  -2.834   9.697
  411    HB2  PRO  53           2HB      PRO  53  -4.262  -0.293   8.927
  412    HB3  PRO  53           1HB      PRO  53  -4.728  -1.818   8.172
  413    HG2  PRO  53           2HG      PRO  53  -6.195  -0.153  10.161
  414    HG3  PRO  53           1HG      PRO  53  -6.832  -1.116   8.816
  415    HD2  PRO  53           2HD      PRO  53  -7.003  -1.954  11.369
  416    HD3  PRO  53           1HD      PRO  53  -6.749  -3.089  10.027
  417    H    SER  54           HN       SER  54  -1.496  -2.313  10.354
  418    HA   SER  54           HA       SER  54  -0.993   0.280  11.577
  419    HB2  SER  54           2HB      SER  54  -0.022  -2.427  12.430
  420    HB3  SER  54           1HB      SER  54   0.650  -0.924  13.003
  421    HG   SER  54           HG       SER  54  -2.019  -0.856  13.222
  422    H    TYR  55           HN       TYR  55  -0.752  -0.911   8.901
  423    HA   TYR  55           HA       TYR  55   2.148  -0.760   8.503
  424    HB2  TYR  55           2HB      TYR  55   1.606  -2.047   6.338
  425    HB3  TYR  55           1HB      TYR  55   1.551  -2.938   7.853
  426    HD1  TYR  55           2HD      TYR  55  -0.440  -1.565   5.094
  427    HD2  TYR  55           1HD      TYR  55  -0.556  -3.741   8.746
  428    HE1  TYR  55           2HE      TYR  55  -2.742  -2.270   4.594
  429    HE2  TYR  55           1HE      TYR  55  -2.856  -4.454   8.255
  430    HH   TYR  55           HH       TYR  55  -4.292  -4.094   5.212
  431    H    GLU  56           HN       GLU  56   2.910   0.798   7.250
  432    HA   GLU  56           HA       GLU  56   0.974   2.412   5.732
  433    HB2  GLU  56           2HB      GLU  56   3.419   3.199   7.295
  434    HB3  GLU  56           1HB      GLU  56   2.799   4.229   6.017
  435    HG2  GLU  56           2HG      GLU  56   1.968   5.048   8.080
  436    HG3  GLU  56           1HG      GLU  56   0.622   4.304   7.224
  437    H    VAL  57           HN       VAL  57   1.498   3.036   3.674
  438    HA   VAL  57           HA       VAL  57   3.965   1.893   2.534
  439    HB   VAL  57           HB       VAL  57   1.394   2.504   1.048
  440   HG11  VAL  57          1HG1      VAL  57   2.422   1.211  -0.770
  441   HG12  VAL  57          2HG1      VAL  57   3.899   1.067   0.182
  442   HG13  VAL  57          3HG1      VAL  57   3.353   2.653  -0.361
  443   HG21  VAL  57          3HG2      VAL  57   1.029   0.656   2.574
  444   HG22  VAL  57          1HG2      VAL  57   2.477  -0.154   1.979
  445   HG23  VAL  57          2HG2      VAL  57   1.088   0.070   0.912
  446    H    PHE  58           HN       PHE  58   5.408   3.351   1.816
  447    HA   PHE  58           HA       PHE  58   4.567   5.908   0.794
  448    HB2  PHE  58           2HB      PHE  58   5.677   7.273   2.444
  449    HB3  PHE  58           1HB      PHE  58   4.533   6.227   3.277
  450    HD1  PHE  58           1HD      PHE  58   5.430   4.152   4.434
  451    HD2  PHE  58           2HD      PHE  58   7.944   7.278   3.005
  452    HE1  PHE  58           1HE      PHE  58   7.233   3.375   5.911
  453    HE2  PHE  58           2HE      PHE  58   9.751   6.503   4.487
  454    HZ   PHE  58           HZ       PHE  58   9.395   4.548   5.940
  455    H    VAL  59           HN       VAL  59   6.363   7.164  -0.017
  456    HA   VAL  59           HA       VAL  59   8.880   5.651  -0.311
  457    HB   VAL  59           HB       VAL  59   7.829   7.455  -2.479
  458   HG11  VAL  59          1HG1      VAL  59   9.394   6.200  -3.885
  459   HG12  VAL  59          2HG1      VAL  59   9.860   5.230  -2.488
  460   HG13  VAL  59          3HG1      VAL  59  10.206   6.958  -2.515
  461   HG21  VAL  59          3HG2      VAL  59   7.066   5.466  -3.708
  462   HG22  VAL  59          1HG2      VAL  59   6.144   5.725  -2.227
  463   HG23  VAL  59          2HG2      VAL  59   7.390   4.478  -2.284
  464    H    ASP  60           HN       ASP  60  10.679   6.860   0.082
  465    HA   ASP  60           HA       ASP  60  10.228   9.690   0.724
  466    HB2  ASP  60           2HB      ASP  60  11.133   8.264   2.555
  467    HB3  ASP  60           1HB      ASP  60  12.545   7.930   1.557
  468    H    LEU  61           HN       LEU  61  10.587  10.866  -1.047
  469    HA   LEU  61           HA       LEU  61  13.111  10.422  -2.486
  470    HB2  LEU  61           2HB      LEU  61  10.373  10.828  -3.673
  471    HB3  LEU  61           1HB      LEU  61  11.849  11.066  -4.588
  472    HG   LEU  61           HG       LEU  61  10.968   8.465  -3.325
  473   HD11  LEU  61          1HD1      LEU  61  11.109   9.308  -6.215
  474   HD12  LEU  61          2HD1      LEU  61   9.631   9.113  -5.274
  475   HD13  LEU  61          3HD1      LEU  61  10.650   7.714  -5.618
  476   HD21  LEU  61          3HD2      LEU  61  13.327   9.042  -5.120
  477   HD22  LEU  61          1HD2      LEU  61  12.869   7.477  -4.453
  478   HD23  LEU  61          2HD2      LEU  61  13.425   8.763  -3.380
  479    H    THR  62           HN       THR  62  12.637  12.283  -0.441
  480    HA   THR  62           HA       THR  62  12.021  14.845  -1.544
  481    HB   THR  62           HB       THR  62  11.655  14.420   0.830
  482    HG1  THR  62           1HG      THR  62  13.530  16.412   0.084
  483   HG21  THR  62          3HG2      THR  62  14.659  14.180   1.021
  484   HG22  THR  62          1HG2      THR  62  13.500  12.873   1.244
  485   HG23  THR  62          2HG2      THR  62  13.541  14.218   2.386
  486    H    GLU  63           HN       GLU  63  14.777  12.849  -1.590
  487    HA   GLU  63           HA       GLU  63  16.640  15.036  -1.996
  488    HB2  GLU  63           2HB      GLU  63  16.993  12.049  -2.156
  489    HB3  GLU  63           1HB      GLU  63  18.280  13.191  -2.447
  490    HG2  GLU  63           2HG      GLU  63  17.776  14.057  -0.122
  491    HG3  GLU  63           1HG      GLU  63  16.859  12.577   0.089
  492    H    ALA  64           HN       ALA  64  14.335  13.613  -3.851
  493    HA   ALA  64           HA       ALA  64  15.828  13.448  -6.323
  494    HB1  ALA  64           1HB      ALA  64  13.984  11.888  -5.880
  495    HB2  ALA  64           2HB      ALA  64  13.708  12.838  -7.341
  496    HB3  ALA  64           3HB      ALA  64  12.856  13.243  -5.850
  497    H    GLY  65           HN       GLY  65  15.800  14.931  -7.980
  498    HA2  GLY  65           2HA      GLY  65  14.697  17.546  -7.253
  499    HA3  GLY  65           1HA      GLY  65  16.004  17.267  -8.393
  500    H    GLU  66           HN       GLU  66  15.283  18.125 -10.209
  501    HA   GLU  66           HA       GLU  66  12.543  18.220 -10.950
  502    HB2  GLU  66           2HB      GLU  66  14.884  18.696 -12.786
  503    HB3  GLU  66           1HB      GLU  66  13.270  19.375 -12.901
  504    HG2  GLU  66           2HG      GLU  66  15.328  20.017 -10.801
  505    HG3  GLU  66           1HG      GLU  66  14.854  21.042 -12.155
  506    H    GLY  67           HN       GLY  67  11.449  17.128 -12.562
  507    HA2  GLY  67           2HA      GLY  67  11.271  15.605 -14.376
  508    HA3  GLY  67           1HA      GLY  67  12.838  14.941 -13.940
  509    H    SER  68           HN       SER  68  10.645  13.310 -14.463
  510    HA   SER  68           HA       SER  68   9.458  12.526 -11.968
  511    HB2  SER  68           2HB      SER  68   8.248  12.257 -14.112
  512    HB3  SER  68           1HB      SER  68   9.433  11.057 -14.617
  513    HG   SER  68           HG       SER  68   7.702  10.895 -12.370
  514    H    HIS  69           HN       HIS  69   9.942  10.806 -10.742
  515    HA   HIS  69           HA       HIS  69  12.440   9.390 -11.379
  516    HB2  HIS  69           2HB      HIS  69  11.634  10.652  -8.755
  517    HB3  HIS  69           1HB      HIS  69  12.909   9.444  -8.878
  518    HD1  HIS  69           1HD      HIS  69  12.141  13.018  -9.720
  519    HD2  HIS  69           2HD      HIS  69  15.281  10.318 -10.076
  520    HE1  HIS  69           1HE      HIS  69  14.139  14.390 -10.362
  521    HE2  HIS  69           2HE      HIS  69  15.949  12.701 -10.831
  522    H    THR  70           HN       THR  70  12.327   7.264 -11.255
  523    HA   THR  70           HA       THR  70   9.882   6.109 -10.089
  524    HB   THR  70           HB       THR  70  11.394   4.983 -12.449
  525    HG1  THR  70           1HG      THR  70  10.191   7.219 -12.537
  526   HG21  THR  70          3HG2      THR  70   9.964   3.393 -11.305
  527   HG22  THR  70          1HG2      THR  70   9.256   3.818 -12.862
  528   HG23  THR  70          2HG2      THR  70   8.609   4.518 -11.378
  529    H    VAL  71           HN       VAL  71  10.327   4.913  -8.358
  530    HA   VAL  71           HA       VAL  71  12.607   3.071  -8.419
  531    HB   VAL  71           HB       VAL  71  13.124   3.557  -6.030
  532   HG11  VAL  71          1HG1      VAL  71  14.386   5.620  -6.418
  533   HG12  VAL  71          2HG1      VAL  71  13.449   5.913  -7.883
  534   HG13  VAL  71          3HG1      VAL  71  14.518   4.514  -7.786
  535   HG21  VAL  71          3HG2      VAL  71  11.307   5.929  -6.446
  536   HG22  VAL  71          1HG2      VAL  71  12.353   5.677  -5.049
  537   HG23  VAL  71          2HG2      VAL  71  11.020   4.565  -5.364
  538    H    ASP  72           HN       ASP  72  12.376   1.408  -6.596
  539    HA   ASP  72           HA       ASP  72   9.652   0.491  -6.561
  540    HB2  ASP  72           2HB      ASP  72  10.521  -1.442  -5.292
  541    HB3  ASP  72           1HB      ASP  72  11.420  -1.158  -6.776
  542    H    VAL  73           HN       VAL  73   8.411   0.052  -4.691
  543    HA   VAL  73           HA       VAL  73   8.723   2.171  -2.712
  544    HB   VAL  73           HB       VAL  73   6.380   0.312  -3.142
  545   HG11  VAL  73          1HG1      VAL  73   5.118   1.960  -1.848
  546   HG12  VAL  73          2HG1      VAL  73   6.585   2.909  -1.616
  547   HG13  VAL  73          3HG1      VAL  73   6.454   1.300  -0.902
  548   HG21  VAL  73          3HG2      VAL  73   6.821   3.118  -4.158
  549   HG22  VAL  73          1HG2      VAL  73   5.317   2.208  -4.288
  550   HG23  VAL  73          2HG2      VAL  73   6.759   1.651  -5.136
  551    H    GLU  74           HN       GLU  74   9.420   1.794  -0.714
  552    HA   GLU  74           HA       GLU  74   9.770  -0.940   0.211
  553    HB2  GLU  74           2HB      GLU  74  11.551   0.838   0.458
  554    HB3  GLU  74           1HB      GLU  74  10.502   1.634   1.624
  555    HG2  GLU  74           2HG      GLU  74  10.655  -0.211   3.128
  556    HG3  GLU  74           1HG      GLU  74  11.502  -1.187   1.927
  557    H    HIS  75           HN       HIS  75   8.910  -1.637   2.317
  558    HA   HIS  75           HA       HIS  75   6.342  -0.273   2.855
  559    HB2  HIS  75           2HB      HIS  75   6.711  -3.260   3.020
  560    HB3  HIS  75           1HB      HIS  75   5.208  -2.354   2.964
  561    HD1  HIS  75           1HD      HIS  75   4.554  -1.343   0.585
  562    HD2  HIS  75           2HD      HIS  75   7.738  -4.005   0.596
  563    HE1  HIS  75           1HE      HIS  75   4.895  -1.998  -1.819
  564    HE2  HIS  75           2HE      HIS  75   6.984  -3.418  -1.803
  565    H    ARG  76           HN       ARG  76   5.549  -0.340   4.970
  566    HA   ARG  76           HA       ARG  76   7.319  -1.474   7.025
  567    HB2  ARG  76           2HB      ARG  76   6.052   1.276   7.065
  568    HB3  ARG  76           1HB      ARG  76   6.860   0.531   8.435
  569    HG2  ARG  76           2HG      ARG  76   8.298   0.929   5.843
  570    HG3  ARG  76           1HG      ARG  76   8.133   2.249   7.001
  571    HD2  ARG  76           2HD      ARG  76  10.248   1.145   7.347
  572    HD3  ARG  76           1HD      ARG  76   9.192   0.823   8.720
  573    HE   ARG  76           HE       ARG  76   8.753  -1.363   7.362
  574   HH11  ARG  76          1HH1      ARG  76  11.797   0.326   7.723
  575   HH12  ARG  76          2HH1      ARG  76  12.759  -1.119   7.614
  576   HH21  ARG  76          1HH2      ARG  76   9.986  -3.267   7.219
  577   HH22  ARG  76          2HH2      ARG  76  11.723  -3.180   7.340
  578    H    GLY  77           HN       GLY  77   6.231  -2.112   8.952
  579    HA2  GLY  77           2HA      GLY  77   4.101  -2.067  10.214
  580    HA3  GLY  77           1HA      GLY  77   3.286  -2.232   8.665
  581    H    PHE  78           HN       PHE  78   3.889  -4.241   7.409
  582    HA   PHE  78           HA       PHE  78   3.956  -6.518   9.214
  583    HB2  PHE  78           2HB      PHE  78   3.591  -7.808   7.023
  584    HB3  PHE  78           1HB      PHE  78   2.283  -6.772   7.576
  585    HD1  PHE  78           1HD      PHE  78   4.869  -7.262   5.036
  586    HD2  PHE  78           2HD      PHE  78   1.703  -4.756   6.381
  587    HE1  PHE  78           1HE      PHE  78   4.839  -6.124   2.851
  588    HE2  PHE  78           2HE      PHE  78   1.672  -3.616   4.207
  589    HZ   PHE  78           HZ       PHE  78   3.236  -4.295   2.434
  590    HA   PRO  79           HA       PRO  79   8.244  -7.343   8.435
  591    HB2  PRO  79           2HB      PRO  79   7.839 -10.101   9.221
  592    HB3  PRO  79           1HB      PRO  79   8.631  -8.802  10.115
  593    HG2  PRO  79           2HG      PRO  79   6.254  -9.918  10.864
  594    HG3  PRO  79           1HG      PRO  79   6.729  -8.257  11.259
  595    HD2  PRO  79           2HD      PRO  79   4.903  -9.248   9.106
  596    HD3  PRO  79           1HD      PRO  79   4.745  -7.820  10.152
  597    H    GLY  80           HN       GLY  80   9.641  -8.712   7.140
  598    HA2  GLY  80           2HA      GLY  80   8.306  -9.485   4.678
  599    HA3  GLY  80           1HA      GLY  80  10.041  -9.349   4.930
  600    H    ASP  81           HN       ASP  81   7.734 -11.222   6.835
  601    HA   ASP  81           HA       ASP  81   9.289 -13.625   6.418
  602    HB2  ASP  81           2HB      ASP  81   8.374 -13.182   8.649
  603    HB3  ASP  81           1HB      ASP  81   6.748 -13.166   7.981
  604    H    LEU  82           HN       LEU  82   6.125 -12.363   5.652
  605    HA   LEU  82           HA       LEU  82   5.341 -14.711   4.170
  606    HB2  LEU  82           2HB      LEU  82   4.002 -12.019   4.431
  607    HB3  LEU  82           1HB      LEU  82   3.286 -13.449   3.716
  608    HG   LEU  82           HG       LEU  82   4.098 -13.191   6.615
  609   HD11  LEU  82          1HD1      LEU  82   1.366 -13.105   5.337
  610   HD12  LEU  82          2HD1      LEU  82   2.209 -11.746   6.078
  611   HD13  LEU  82          3HD1      LEU  82   1.697 -13.111   7.071
  612   HD21  LEU  82          3HD2      LEU  82   4.215 -15.488   5.808
  613   HD22  LEU  82          1HD2      LEU  82   2.580 -15.357   5.159
  614   HD23  LEU  82          2HD2      LEU  82   2.846 -15.279   6.901
  615    H    ALA  83           HN       ALA  83   4.514 -14.423   1.904
  616    HA   ALA  83           HA       ALA  83   6.509 -13.065   0.305
  617    HB1  ALA  83           1HB      ALA  83   4.082 -14.640  -0.554
  618    HB2  ALA  83           2HB      ALA  83   5.708 -15.286  -0.346
  619    HB3  ALA  83           3HB      ALA  83   5.391 -14.088  -1.600
  620    H    VAL  84           HN       VAL  84   6.326 -10.975  -0.095
  621    HA   VAL  84           HA       VAL  84   3.707  -9.700   0.125
  622    HB   VAL  84           HB       VAL  84   6.441  -8.429  -0.157
  623   HG11  VAL  84          1HG1      VAL  84   5.346  -6.382   0.592
  624   HG12  VAL  84          2HG1      VAL  84   3.792  -7.216   0.622
  625   HG13  VAL  84          3HG1      VAL  84   4.636  -6.975  -0.910
  626   HG21  VAL  84          3HG2      VAL  84   4.772  -8.875   2.311
  627   HG22  VAL  84          1HG2      VAL  84   6.278  -7.960   2.237
  628   HG23  VAL  84          2HG2      VAL  84   6.282  -9.694   1.909
  629    H    THR  85           HN       THR  85   2.553  -9.581  -1.694
  630    HA   THR  85           HA       THR  85   4.003  -9.191  -4.219
  631    HB   THR  85           HB       THR  85   1.120  -9.987  -4.080
  632    HG1  THR  85           1HG      THR  85   2.570 -11.450  -2.816
  633   HG21  THR  85          3HG2      THR  85   2.060  -9.313  -6.240
  634   HG22  THR  85          1HG2      THR  85   1.632 -11.024  -6.238
  635   HG23  THR  85          2HG2      THR  85   3.319 -10.537  -6.076
  636    H    VAL  86           HN       VAL  86   3.784  -7.385  -5.234
  637    HA   VAL  86           HA       VAL  86   1.540  -5.558  -4.665
  638    HB   VAL  86           HB       VAL  86   3.918  -4.150  -5.539
  639   HG11  VAL  86          1HG1      VAL  86   2.001  -3.093  -4.474
  640   HG12  VAL  86          2HG1      VAL  86   3.470  -2.769  -3.555
  641   HG13  VAL  86          3HG1      VAL  86   2.317  -3.970  -2.976
  642   HG21  VAL  86          3HG2      VAL  86   5.259  -4.374  -3.456
  643   HG22  VAL  86          1HG2      VAL  86   5.260  -5.803  -4.491
  644   HG23  VAL  86          2HG2      VAL  86   4.276  -5.775  -3.026
  645    H    GLU  87           HN       GLU  87   0.821  -4.428  -6.714
  646    HA   GLU  87           HA       GLU  87   3.061  -4.578  -8.614
  647    HB2  GLU  87           2HB      GLU  87   0.147  -4.768  -9.378
  648    HB3  GLU  87           1HB      GLU  87   1.471  -4.591 -10.518
  649    HG2  GLU  87           2HG      GLU  87   2.378  -6.752  -9.729
  650    HG3  GLU  87           1HG      GLU  87   0.965  -6.923  -8.686
  651    HA   PRO  88           HA       PRO  88   3.605  -1.423 -10.087
  652    HB2  PRO  88           2HB      PRO  88   4.761   0.458  -8.545
  653    HB3  PRO  88           1HB      PRO  88   3.054   0.529  -8.963
  654    HG2  PRO  88           2HG      PRO  88   4.255   0.049  -6.362
  655    HG3  PRO  88           1HG      PRO  88   2.542   0.281  -6.752
  656    HD2  PRO  88           2HD      PRO  88   4.075  -2.253  -6.435
  657    HD3  PRO  88           1HD      PRO  88   2.332  -1.954  -6.230
  658    H    ARG  89           HN       ARG  89   5.623  -2.125 -10.746
  659    HA   ARG  89           HA       ARG  89   7.218  -3.555  -8.809
  660    HB2  ARG  89           2HB      ARG  89   7.560  -2.930 -11.745
  661    HB3  ARG  89           1HB      ARG  89   8.903  -3.585 -10.818
  662    HG2  ARG  89           2HG      ARG  89   6.201  -4.877 -11.056
  663    HG3  ARG  89           1HG      ARG  89   7.613  -5.277 -12.030
  664    HD2  ARG  89           2HD      ARG  89   8.845  -5.769  -9.910
  665    HD3  ARG  89           1HD      ARG  89   7.330  -5.541  -9.041
  666    HE   ARG  89           HE       ARG  89   6.769  -7.424 -10.953
  667   HH11  ARG  89          1HH1      ARG  89   9.061  -7.119  -8.318
  668   HH12  ARG  89          2HH1      ARG  89   9.158  -8.831  -8.025
  669   HH21  ARG  89          1HH2      ARG  89   6.897  -9.685 -10.579
  670   HH22  ARG  89          2HH2      ARG  89   7.951 -10.290  -9.330
  671    H    MET  90           HN       MET  90   7.528  -0.645 -10.740
  672    HA   MET  90           HA       MET  90   8.868   0.584  -8.437
  673    HB2  MET  90           2HB      MET  90   9.544   1.028 -11.358
  674    HB3  MET  90           1HB      MET  90  10.104   2.066 -10.056
  675    HG2  MET  90           2HG      MET  90  11.259   0.150  -9.047
  676    HG3  MET  90           1HG      MET  90  10.728  -0.856 -10.390
  677    HE1  MET  90           3HE      MET  90  14.587  -0.402 -11.000
  678    HE2  MET  90           1HE      MET  90  13.285  -1.556 -10.712
  679    HE3  MET  90           2HE      MET  90  13.798  -0.462  -9.426
  680    H    ALA  91           HN       ALA  91   8.350   2.857  -8.194
  681    HA   ALA  91           HA       ALA  91   5.803   3.545  -9.514
  682    HB1  ALA  91           1HB      ALA  91   5.447   2.931  -7.181
  683    HB2  ALA  91           2HB      ALA  91   5.139   4.650  -7.428
  684    HB3  ALA  91           3HB      ALA  91   6.643   4.126  -6.672
  685    H    ARG  92           HN       ARG  92   5.502   5.681 -10.113
  686    HA   ARG  92           HA       ARG  92   7.996   7.231 -10.194
  687    HB2  ARG  92           2HB      ARG  92   7.241   8.166 -12.295
  688    HB3  ARG  92           1HB      ARG  92   7.202   6.413 -12.392
  689    HG2  ARG  92           2HG      ARG  92   4.782   6.449 -12.022
  690    HG3  ARG  92           1HG      ARG  92   4.825   8.211 -11.938
  691    HD2  ARG  92           2HD      ARG  92   4.128   7.583 -14.140
  692    HD3  ARG  92           1HD      ARG  92   5.765   8.229 -14.243
  693    HE   ARG  92           HE       ARG  92   5.238   5.330 -14.187
  694   HH11  ARG  92          1HH1      ARG  92   6.740   8.139 -15.619
  695   HH12  ARG  92          2HH1      ARG  92   7.650   7.231 -16.784
  696   HH21  ARG  92          1HH2      ARG  92   6.418   4.114 -15.736
  697   HH22  ARG  92          2HH2      ARG  92   7.429   4.940 -16.880
  698    H    VAL  93           HN       VAL  93   8.031   9.197  -9.351
  699    HA   VAL  93           HA       VAL  93   5.458  10.527  -8.814
  700    HB   VAL  93           HB       VAL  93   6.675   9.902  -6.739
  701   HG11  VAL  93          1HG1      VAL  93   8.720  11.110  -6.122
  702   HG12  VAL  93          2HG1      VAL  93   8.790  11.802  -7.743
  703   HG13  VAL  93          3HG1      VAL  93   8.964  10.061  -7.520
  704   HG21  VAL  93          3HG2      VAL  93   5.164  11.790  -6.709
  705   HG22  VAL  93          1HG2      VAL  93   6.453  12.861  -7.263
  706   HG23  VAL  93          2HG2      VAL  93   6.552  12.113  -5.668
  707    H    GLN  94           HN       GLN  94   5.216  12.599  -9.552
  708    HA   GLN  94           HA       GLN  94   7.470  13.682 -11.100
  709    HB2  GLN  94           2HB      GLN  94   5.425  13.300 -12.393
  710    HB3  GLN  94           1HB      GLN  94   4.507  14.282 -11.265
  711    HG2  GLN  94           2HG      GLN  94   4.917  15.565 -13.223
  712    HG3  GLN  94           1HG      GLN  94   5.893  16.231 -11.923
  713   HE21  GLN  94          1HE2      GLN  94   6.188  16.450 -14.789
  714   HE22  GLN  94          2HE2      GLN  94   7.769  15.856 -15.144
  715    H    LEU  95           HN       LEU  95   8.555  15.268 -10.206
  716    HA   LEU  95           HA       LEU  95   7.214  16.935  -8.186
  717    HB2  LEU  95           2HB      LEU  95  10.108  16.065  -8.324
  718    HB3  LEU  95           1HB      LEU  95   9.474  17.224  -7.172
  719    HG   LEU  95           HG       LEU  95   8.658  14.323  -7.348
  720   HD11  LEU  95          1HD1      LEU  95  10.935  14.576  -6.540
  721   HD12  LEU  95          2HD1      LEU  95   9.861  14.101  -5.223
  722   HD13  LEU  95          3HD1      LEU  95  10.399  15.775  -5.364
  723   HD21  LEU  95          3HD2      LEU  95   7.920  16.480  -5.372
  724   HD22  LEU  95          1HD2      LEU  95   7.519  14.771  -5.216
  725   HD23  LEU  95          2HD2      LEU  95   6.842  15.717  -6.541
  726    H    GLU  96           HN       GLU  96   7.291  19.075  -8.453
  727    HA   GLU  96           HA       GLU  96   9.217  20.197 -10.342
  728    HB2  GLU  96           2HB      GLU  96   7.138  19.787 -11.630
  729    HB3  GLU  96           1HB      GLU  96   6.245  20.770 -10.477
  730    HG2  GLU  96           2HG      GLU  96   7.499  22.730 -11.115
  731    HG3  GLU  96           1HG      GLU  96   8.517  21.765 -12.183
  732    H    GLU  97           HN       GLU  97   9.833  22.271  -9.879
  733    HA   GLU  97           HA       GLU  97   9.439  23.258  -7.256
  734    HB2  GLU  97           2HB      GLU  97  10.691  25.269  -8.209
  735    HB3  GLU  97           1HB      GLU  97  11.518  23.724  -8.246
  736    HG2  GLU  97           2HG      GLU  97  11.977  24.299 -10.357
  737    HG3  GLU  97           1HG      GLU  97  10.352  23.708 -10.679
  738    H    ARG  98           HN       ARG  98   6.948  22.954  -8.280
  739    HA   ARG  98           HA       ARG  98   5.915  25.694  -8.392
  740    HB2  ARG  98           2HB      ARG  98   5.959  24.881 -10.714
  741    HB3  ARG  98           1HB      ARG  98   5.044  23.461 -10.237
  742    HG2  ARG  98           2HG      ARG  98   3.382  24.769 -11.093
  743    HG3  ARG  98           1HG      ARG  98   3.318  25.242  -9.394
  744    HD2  ARG  98           2HD      ARG  98   3.245  27.241 -10.683
  745    HD3  ARG  98           1HD      ARG  98   4.854  27.140  -9.966
  746    HE   ARG  98           HE       ARG  98   4.736  25.982 -12.584
  747   HH11  ARG  98          1HH1      ARG  98   5.094  29.000 -10.836
  748   HH12  ARG  98          2HH1      ARG  98   5.897  29.808 -12.151
  749   HH21  ARG  98          1HH2      ARG  98   5.771  27.038 -14.300
  750   HH22  ARG  98          2HH2      ARG  98   6.252  28.700 -14.133
  751    H    GLN  99           HN       GLN  99   4.060  25.923  -7.229
  752    HA   GLN  99           HA       GLN  99   3.460  23.803  -5.421
  753    HB2  GLN  99           2HB      GLN  99   1.874  25.536  -4.507
  754    HB3  GLN  99           1HB      GLN  99   3.570  25.955  -4.474
  755    HG2  GLN  99           2HG      GLN  99   3.283  27.365  -6.407
  756    HG3  GLN  99           1HG      GLN  99   1.596  26.870  -6.550
  757   HE21  GLN  99          1HE2      GLN  99   0.098  27.634  -5.084
  758   HE22  GLN  99          2HE2      GLN  99   0.412  28.981  -4.046
  759    H    THR 100           HN       THR 100   1.787  22.477  -5.424
  760    HA   THR 100           HA       THR 100  -0.392  22.921  -7.366
  761    HB   THR 100           HB       THR 100   0.757  20.200  -6.691
  762    HG1  THR 100           1HG      THR 100   2.406  21.185  -7.786
  763   HG21  THR 100          3HG2      THR 100  -0.390  19.512  -8.751
  764   HG22  THR 100          1HG2      THR 100  -0.991  21.158  -8.966
  765   HG23  THR 100          2HG2      THR 100  -1.524  20.197  -7.586
  766    H    VAL 101           HN       VAL 101   0.329  23.001  -4.292
  767    HA   VAL 101           HA       VAL 101  -0.926  23.057  -2.408
  768    HB   VAL 101           HB       VAL 101  -3.181  21.818  -3.989
  769   HG11  VAL 101          1HG1      VAL 101  -3.205  23.198  -1.309
  770   HG12  VAL 101          2HG1      VAL 101  -3.390  21.464  -1.580
  771   HG13  VAL 101          3HG1      VAL 101  -4.612  22.587  -2.177
  772   HG21  VAL 101          3HG2      VAL 101  -2.653  24.706  -3.282
  773   HG22  VAL 101          1HG2      VAL 101  -4.103  24.093  -4.076
  774   HG23  VAL 101          2HG2      VAL 101  -2.541  23.993  -4.892
  775    H    SER 102           HN       SER 102  -1.256  20.138  -4.275
  776    HA   SER 102           HA       SER 102  -0.650  17.994  -3.877
  777    HB2  SER 102           2HB      SER 102   1.331  18.924  -2.747
  778    HB3  SER 102           1HB      SER 102   0.423  19.012  -1.237
  779    HG   SER 102           HG       SER 102   1.815  17.100  -1.627
  780    H    VAL 103           HN       VAL 103  -1.626  16.195  -3.113
  781    HA   VAL 103           HA       VAL 103  -3.033  16.111  -0.630
  782    HB   VAL 103           HB       VAL 103  -4.768  17.261  -1.838
  783   HG11  VAL 103          1HG1      VAL 103  -4.591  15.096  -3.925
  784   HG12  VAL 103          2HG1      VAL 103  -4.121  16.784  -4.121
  785   HG13  VAL 103          3HG1      VAL 103  -5.814  16.366  -3.864
  786   HG21  VAL 103          3HG2      VAL 103  -5.392  14.330  -1.518
  787   HG22  VAL 103          1HG2      VAL 103  -6.606  15.598  -1.708
  788   HG23  VAL 103          2HG2      VAL 103  -5.546  15.594  -0.299
  789    HA   PRO 104           HA       PRO 104  -1.513  12.084  -2.035
  790    HB2  PRO 104           2HB      PRO 104  -0.089  11.473   0.120
  791    HB3  PRO 104           1HB      PRO 104   0.451  12.737  -0.992
  792    HG2  PRO 104           2HG      PRO 104  -0.835  12.993   1.687
  793    HG3  PRO 104           1HG      PRO 104   0.424  13.993   0.944
  794    HD2  PRO 104           2HD      PRO 104  -2.334  14.562   1.027
  795    HD3  PRO 104           1HD      PRO 104  -1.114  15.387   0.036
  796    H    VAL 105           HN       VAL 105  -4.039  12.785  -0.270
  797    HA   VAL 105           HA       VAL 105  -4.706  10.040   0.248
  798    HB   VAL 105           HB       VAL 105  -3.522  10.563   2.325
  799   HG11  VAL 105          1HG1      VAL 105  -5.542  12.776   2.647
  800   HG12  VAL 105          2HG1      VAL 105  -3.811  12.968   2.375
  801   HG13  VAL 105          3HG1      VAL 105  -4.393  12.258   3.882
  802   HG21  VAL 105          3HG2      VAL 105  -5.261   9.936   3.910
  803   HG22  VAL 105          1HG2      VAL 105  -5.436   9.038   2.402
  804   HG23  VAL 105          2HG2      VAL 105  -6.503  10.400   2.747
  805    H    THR 106           HN       THR 106  -6.805   9.710  -0.102
  806    HA   THR 106           HA       THR 106  -8.769  11.780   0.494
  807    HB   THR 106           HB       THR 106  -8.705  10.632  -2.309
  808    HG1  THR 106           1HG      THR 106  -7.189  12.657  -1.232
  809   HG21  THR 106          3HG2      THR 106 -10.194  12.528  -2.797
  810   HG22  THR 106          1HG2      THR 106 -10.120  13.019  -1.102
  811   HG23  THR 106          2HG2      THR 106 -10.866  11.483  -1.547
  812    H    VAL 107           HN       VAL 107  -8.293   9.394   1.731
  813    HA   VAL 107           HA       VAL 107  -9.430   7.077   0.805
  814    HB   VAL 107           HB       VAL 107  -8.076   7.035   2.764
  815   HG11  VAL 107          1HG1      VAL 107  -8.811   7.947   4.925
  816   HG12  VAL 107          2HG1      VAL 107 -10.214   8.659   4.129
  817   HG13  VAL 107          3HG1      VAL 107  -8.592   9.200   3.701
  818   HG21  VAL 107          3HG2      VAL 107  -9.686   5.243   2.604
  819   HG22  VAL 107          1HG2      VAL 107 -10.897   6.217   3.438
  820   HG23  VAL 107          2HG2      VAL 107  -9.450   5.686   4.295
  821    H    GLU 108           HN       GLU 108 -11.249   7.077  -0.175
  822    HA   GLU 108           HA       GLU 108 -13.635   6.507   0.914
  823    HB2  GLU 108           2HB      GLU 108 -13.335   9.457   0.821
  824    HB3  GLU 108           1HB      GLU 108 -14.826   8.826   0.142
  825    HG2  GLU 108           2HG      GLU 108 -13.812   8.580   2.956
  826    HG3  GLU 108           1HG      GLU 108 -15.298   9.335   2.385
  827    H    MET 109           HN       MET 109 -11.909   8.189  -1.583
  828    HA   MET 109           HA       MET 109 -13.865   7.678  -3.629
  829    HB2  MET 109           2HB      MET 109 -12.183   8.574  -5.188
  830    HB3  MET 109           1HB      MET 109 -12.446   9.647  -3.824
  831    HG2  MET 109           2HG      MET 109 -10.388   8.904  -2.804
  832    HG3  MET 109           1HG      MET 109 -10.136   7.738  -4.100
  833    HE1  MET 109           3HE      MET 109  -9.640  10.160  -7.187
  834    HE2  MET 109           1HE      MET 109 -11.144   9.443  -6.607
  835    HE3  MET 109           2HE      MET 109  -9.670   8.476  -6.667
  836    H    ILE 110           HN       ILE 110 -14.223   5.759  -4.370
  837    HA   ILE 110           HA       ILE 110 -12.036   4.140  -5.331
  838    HB   ILE 110           HB       ILE 110 -12.200   3.379  -3.006
  839   HG12  ILE 110          2HG1      ILE 110 -12.533   0.957  -3.453
  840   HG13  ILE 110          1HG1      ILE 110 -13.217   1.365  -5.022
  841   HG21  ILE 110          1HG2      ILE 110 -15.043   2.664  -3.686
  842   HG22  ILE 110          2HG2      ILE 110 -14.518   3.908  -2.551
  843   HG23  ILE 110          3HG2      ILE 110 -14.202   2.206  -2.206
  844   HD11  ILE 110          3HD1      ILE 110 -11.080   2.394  -5.654
  845   HD12  ILE 110          1HD1      ILE 110 -10.920   0.684  -5.258
  846   HD13  ILE 110          2HD1      ILE 110 -10.407   1.910  -4.097
  847    H    ASN 111           HN       ASN 111 -15.467   4.797  -5.038
  848    HA   ASN 111           HA       ASN 111 -16.295   2.947  -7.049
  849    HB2  ASN 111           2HB      ASN 111 -17.861   3.926  -5.378
  850    HB3  ASN 111           1HB      ASN 111 -17.648   5.501  -6.134
  851   HD21  ASN 111          1HD2      ASN 111 -19.731   5.768  -6.789
  852   HD22  ASN 111          2HD2      ASN 111 -20.480   4.778  -7.997
  853    H    LEU 112           HN       LEU 112 -15.597   3.093  -9.091
  854    HA   LEU 112           HA       LEU 112 -15.512   5.723 -10.355
  855    HB2  LEU 112           2HB      LEU 112 -13.296   5.192 -11.353
  856    HB3  LEU 112           1HB      LEU 112 -13.259   5.445  -9.622
  857    HG   LEU 112           HG       LEU 112 -13.382   2.837  -9.494
  858   HD11  LEU 112          1HD1      LEU 112 -13.800   2.456 -11.869
  859   HD12  LEU 112          2HD1      LEU 112 -12.286   1.711 -11.357
  860   HD13  LEU 112          3HD1      LEU 112 -12.261   3.222 -12.265
  861   HD21  LEU 112          3HD2      LEU 112 -10.940   2.729  -9.560
  862   HD22  LEU 112          1HD2      LEU 112 -11.505   4.181  -8.736
  863   HD23  LEU 112          2HD2      LEU 112 -10.897   4.287 -10.387
  864    H    GLU 113           HN       GLU 113 -15.183   5.544 -12.736
  865    HA   GLU 113           HA       GLU 113 -15.913   2.948 -13.857
  866    HB2  GLU 113           2HB      GLU 113 -17.604   3.934 -15.313
  867    HB3  GLU 113           1HB      GLU 113 -18.030   4.179 -13.626
  868    HG2  GLU 113           2HG      GLU 113 -17.326   6.477 -13.728
  869    HG3  GLU 113           1HG      GLU 113 -16.715   6.257 -15.366
  870    H    HIS 114           HN       HIS 114 -14.970   2.539 -15.797
  871    HA   HIS 114           HA       HIS 114 -13.501   4.761 -17.046
  872    HB2  HIS 114           2HB      HIS 114 -11.961   3.025 -18.019
  873    HB3  HIS 114           1HB      HIS 114 -11.847   3.217 -16.277
  874    HD1  HIS 114           1HD      HIS 114 -12.484   0.737 -18.909
  875    HD2  HIS 114           2HD      HIS 114 -12.995   1.020 -14.791
  876    HE1  HIS 114           1HE      HIS 114 -12.837  -1.621 -18.101
  877    HE2  HIS 114           2HE      HIS 114 -13.045  -1.439 -15.598
  878    H    HIS 115           HN       HIS 115 -15.233   5.381 -18.214
  879    HA   HIS 115           HA       HIS 115 -15.968   3.695 -20.478
  880    HB2  HIS 115           2HB      HIS 115 -17.641   3.157 -18.776
  881    HB3  HIS 115           1HB      HIS 115 -17.961   4.863 -18.512
  882    HD1  HIS 115           1HD      HIS 115 -18.869   1.996 -20.658
  883    HD2  HIS 115           2HD      HIS 115 -19.466   6.114 -20.598
  884    HE1  HIS 115           1HE      HIS 115 -20.741   2.439 -22.280
  885    HE2  HIS 115           2HE      HIS 115 -21.189   4.918 -22.107
  886    H    HIS 116           HN       HIS 116 -14.888   5.168 -21.788
  887    HA   HIS 116           HA       HIS 116 -15.805   7.942 -21.774
  888    HB2  HIS 116           2HB      HIS 116 -13.485   6.498 -22.989
  889    HB3  HIS 116           1HB      HIS 116 -14.029   7.998 -23.734
  890    HD1  HIS 116           1HD      HIS 116 -12.341   6.653 -20.678
  891    HD2  HIS 116           2HD      HIS 116 -13.549  10.313 -22.242
  892    HE1  HIS 116           1HE      HIS 116 -11.196   8.401 -19.282
  893    HE2  HIS 116           2HE      HIS 116 -11.748  10.588 -20.409
  894    H    HIS 117           HN       HIS 117 -16.816   8.918 -23.486
  895    HA   HIS 117           HA       HIS 117 -17.530   7.252 -25.778
  896    HB2  HIS 117           2HB      HIS 117 -19.888   7.815 -25.656
  897    HB3  HIS 117           1HB      HIS 117 -19.399   7.033 -24.159
  898    HD1  HIS 117           1HD      HIS 117 -21.203   9.872 -25.407
  899    HD2  HIS 117           2HD      HIS 117 -18.934   9.064 -22.017
  900    HE1  HIS 117           1HE      HIS 117 -21.873  11.607 -23.716
  901    HE2  HIS 117           2HE      HIS 117 -20.363  11.205 -21.737
  902    H    HIS 118           HN       HIS 118 -17.357   8.326 -27.630
  903    HA   HIS 118           HA       HIS 118 -16.380  11.008 -27.600
  904    HB2  HIS 118           2HB      HIS 118 -16.060  10.788 -29.934
  905    HB3  HIS 118           1HB      HIS 118 -15.769   9.181 -29.283
  906    HD1  HIS 118           1HD      HIS 118 -17.671  10.940 -31.821
  907    HD2  HIS 118           2HD      HIS 118 -18.114   7.417 -29.651
  908    HE1  HIS 118           1HE      HIS 118 -19.406   9.593 -33.051
  909    HE2  HIS 118           2HE      HIS 118 -19.825   7.586 -31.579
  910    H    HIS 119           HN       HIS 119 -17.324  12.867 -28.452
  911    HA   HIS 119           HA       HIS 119 -20.202  12.704 -29.015
  912    HB2  HIS 119           2HB      HIS 119 -19.848  13.674 -26.767
  913    HB3  HIS 119           1HB      HIS 119 -18.812  14.911 -27.471
  914    HD1  HIS 119           1HD      HIS 119 -19.935  16.951 -28.442
  915    HD2  HIS 119           2HD      HIS 119 -22.623  13.910 -27.527
  916    HE1  HIS 119           1HE      HIS 119 -22.224  17.952 -28.744
  917    HE2  HIS 119           2HE      HIS 119 -23.821  16.035 -28.390
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1  -9.117 -33.061  -2.794
    2    H2   MET   1           H2       MET   1  -7.484 -32.623  -2.895
    3    H3   MET   1           H3       MET   1  -8.553 -31.699  -1.959
    4    HA   MET   1           HA       MET   1  -8.896 -33.498  -0.449
    5    HB2  MET   1           2HB      MET   1  -6.914 -34.978  -2.187
    6    HB3  MET   1           1HB      MET   1  -7.426 -35.516  -0.598
    7    HG2  MET   1           2HG      MET   1  -8.652 -36.750  -2.195
    8    HG3  MET   1           1HG      MET   1  -9.764 -35.594  -1.466
    9    HE1  MET   1           2HE      MET   1 -11.449 -36.127  -3.475
   10    HE2  MET   1           3HE      MET   1 -10.273 -37.216  -4.207
   11    HE3  MET   1           1HE      MET   1 -11.017 -35.947  -5.174
   12    HA   PRO   2           HA       PRO   2  -4.427 -32.805   0.928
   13    HB2  PRO   2           2HB      PRO   2  -2.648 -32.145  -1.238
   14    HB3  PRO   2           1HB      PRO   2  -2.641 -33.582  -0.215
   15    HG2  PRO   2           2HG      PRO   2  -3.244 -33.609  -2.888
   16    HG3  PRO   2           1HG      PRO   2  -3.821 -34.816  -1.727
   17    HD2  PRO   2           2HD      PRO   2  -5.248 -32.433  -2.848
   18    HD3  PRO   2           1HD      PRO   2  -5.858 -34.078  -2.549
   19    H    THR   3           HN       THR   3  -4.365 -30.942   1.974
   20    HA   THR   3           HA       THR   3  -4.097 -28.456   0.418
   21    HB   THR   3           HB       THR   3  -5.601 -28.511   2.992
   22    HG1  THR   3           1HG      THR   3  -6.444 -30.009   1.220
   23   HG21  THR   3          3HG2      THR   3  -5.721 -26.728   0.564
   24   HG22  THR   3          1HG2      THR   3  -4.944 -26.341   2.098
   25   HG23  THR   3          2HG2      THR   3  -6.696 -26.535   2.021
   26    H    PHE   4           HN       PHE   4  -2.795 -26.854   1.356
   27    HA   PHE   4           HA       PHE   4  -1.146 -27.798   3.599
   28    HB2  PHE   4           2HB      PHE   4  -0.061 -27.871   1.318
   29    HB3  PHE   4           1HB      PHE   4  -0.181 -26.123   1.307
   30    HD1  PHE   4           1HD      PHE   4   1.086 -28.848   3.505
   31    HD2  PHE   4           2HD      PHE   4   1.658 -24.915   1.975
   32    HE1  PHE   4           1HE      PHE   4   3.237 -28.703   4.692
   33    HE2  PHE   4           2HE      PHE   4   3.809 -24.763   3.160
   34    HZ   PHE   4           HZ       PHE   4   4.601 -26.659   4.520
   35    H    ASP   5           HN       ASP   5   0.109 -25.909   4.620
   36    HA   ASP   5           HA       ASP   5  -1.807 -23.950   5.443
   37    HB2  ASP   5           2HB      ASP   5   1.083 -24.379   6.187
   38    HB3  ASP   5           1HB      ASP   5   0.055 -23.164   6.925
   39    H    HIS   6           HN       HIS   6  -1.084 -23.722   2.708
   40    HA   HIS   6           HA       HIS   6   0.306 -21.123   2.723
   41    HB2  HIS   6           2HB      HIS   6   1.590 -22.867   1.527
   42    HB3  HIS   6           1HB      HIS   6   0.210 -23.155   0.475
   43    HD1  HIS   6           1HD      HIS   6   3.178 -21.012   0.880
   44    HD2  HIS   6           2HD      HIS   6  -0.358 -20.963  -1.322
   45    HE1  HIS   6           1HE      HIS   6   3.523 -19.300  -0.930
   46    HE2  HIS   6           2HE      HIS   6   1.318 -19.177  -2.155
   47    H    GLY   7           HN       GLY   7  -1.204 -19.598   2.603
   48    HA2  GLY   7           2HA      GLY   7  -3.400 -20.000   0.663
   49    HA3  GLY   7           1HA      GLY   7  -3.687 -19.312   2.254
   50    H    ASN   8           HN       ASN   8  -4.633 -17.695   0.634
   51    HA   ASN   8           HA       ASN   8  -2.576 -15.683  -0.014
   52    HB2  ASN   8           2HB      ASN   8  -5.257 -16.136  -1.340
   53    HB3  ASN   8           1HB      ASN   8  -4.154 -14.826  -1.721
   54   HD21  ASN   8          1HD2      ASN   8  -2.485 -15.174  -3.068
   55   HD22  ASN   8          2HD2      ASN   8  -2.178 -16.688  -3.857
   56    H    LEU   9           HN       LEU   9  -3.211 -13.493   0.273
   57    HA   LEU   9           HA       LEU   9  -5.680 -12.906   1.682
   58    HB2  LEU   9           2HB      LEU   9  -4.081 -13.462   3.486
   59    HB3  LEU   9           1HB      LEU   9  -2.980 -12.242   2.872
   60    HG   LEU   9           HG       LEU   9  -4.678 -10.499   3.379
   61   HD11  LEU   9          1HD1      LEU   9  -6.168 -12.770   4.680
   62   HD12  LEU   9          2HD1      LEU   9  -6.669 -11.904   3.227
   63   HD13  LEU   9          3HD1      LEU   9  -6.590 -11.062   4.775
   64   HD21  LEU   9          3HD2      LEU   9  -2.886 -11.026   4.966
   65   HD22  LEU   9          1HD2      LEU   9  -3.923 -12.235   5.726
   66   HD23  LEU   9          2HD2      LEU   9  -4.365 -10.530   5.787
   67    H    SER  10           HN       SER  10  -6.497 -11.082   0.868
   68    HA   SER  10           HA       SER  10  -4.789  -9.500  -0.880
   69    HB2  SER  10           2HB      SER  10  -7.786  -9.443  -0.474
   70    HB3  SER  10           1HB      SER  10  -6.897  -8.541  -1.703
   71    HG   SER  10           HG       SER  10  -6.090 -10.741  -2.322
   72    H    LEU  11           HN       LEU  11  -3.949  -7.605  -0.297
   73    HA   LEU  11           HA       LEU  11  -5.050  -6.205   2.032
   74    HB2  LEU  11           2HB      LEU  11  -2.545  -5.645   0.438
   75    HB3  LEU  11           1HB      LEU  11  -3.041  -4.787   1.883
   76    HG   LEU  11           HG       LEU  11  -2.323  -7.719   1.775
   77   HD11  LEU  11          1HD1      LEU  11  -0.306  -7.049   2.991
   78   HD12  LEU  11          2HD1      LEU  11  -0.765  -5.355   2.806
   79   HD13  LEU  11          3HD1      LEU  11  -0.377  -6.324   1.385
   80   HD21  LEU  11          3HD2      LEU  11  -2.850  -5.916   4.132
   81   HD22  LEU  11          1HD2      LEU  11  -2.387  -7.618   4.194
   82   HD23  LEU  11          2HD2      LEU  11  -3.951  -7.155   3.522
   83    H    GLY  12           HN       GLY  12  -4.270  -5.673  -1.391
   84    HA2  GLY  12           2HA      GLY  12  -5.875  -4.740  -2.870
   85    HA3  GLY  12           1HA      GLY  12  -6.632  -3.938  -1.507
   86    H    GLU  13           HN       GLU  13  -6.662  -2.116  -2.938
   87    HA   GLU  13           HA       GLU  13  -4.265  -0.838  -3.810
   88    HB2  GLU  13           2HB      GLU  13  -7.123   0.107  -3.566
   89    HB3  GLU  13           1HB      GLU  13  -5.835   1.102  -4.230
   90    HG2  GLU  13           2HG      GLU  13  -6.518  -1.598  -5.340
   91    HG3  GLU  13           1HG      GLU  13  -7.317  -0.122  -5.873
   92    H    LEU  14           HN       LEU  14  -2.860   0.093  -2.491
   93    HA   LEU  14           HA       LEU  14  -3.902   1.638  -0.204
   94    HB2  LEU  14           2HB      LEU  14  -1.236   0.250  -0.494
   95    HB3  LEU  14           1HB      LEU  14  -1.698   1.266   0.861
   96    HG   LEU  14           HG       LEU  14  -3.072  -1.307   0.089
   97   HD11  LEU  14          1HD1      LEU  14  -0.811  -1.708   0.896
   98   HD12  LEU  14          2HD1      LEU  14  -2.005  -2.233   2.081
   99   HD13  LEU  14          3HD1      LEU  14  -1.133  -0.719   2.321
  100   HD21  LEU  14          3HD2      LEU  14  -4.543   0.296   1.197
  101   HD22  LEU  14          1HD2      LEU  14  -3.376   0.461   2.511
  102   HD23  LEU  14          2HD2      LEU  14  -4.188  -1.081   2.243
  103    H    GLU  15           HN       GLU  15  -3.025   3.674   0.179
  104    HA   GLU  15           HA       GLU  15  -2.218   5.071  -2.183
  105    HB2  GLU  15           2HB      GLU  15  -2.366   6.009   0.684
  106    HB3  GLU  15           1HB      GLU  15  -2.118   7.054  -0.707
  107    HG2  GLU  15           2HG      GLU  15  -4.306   6.449  -1.573
  108    HG3  GLU  15           1HG      GLU  15  -4.559   5.366  -0.204
  109    H    LEU  16           HN       LEU  16  -0.277   5.920  -2.738
  110    HA   LEU  16           HA       LEU  16   2.069   4.848  -1.417
  111    HB2  LEU  16           2HB      LEU  16   1.902   4.936  -3.882
  112    HB3  LEU  16           1HB      LEU  16   1.817   6.684  -3.804
  113    HG   LEU  16           HG       LEU  16   4.113   6.610  -2.704
  114   HD11  LEU  16          1HD1      LEU  16   5.452   4.630  -3.108
  115   HD12  LEU  16          2HD1      LEU  16   4.056   3.808  -3.805
  116   HD13  LEU  16          3HD1      LEU  16   4.062   4.240  -2.095
  117   HD21  LEU  16          3HD2      LEU  16   3.844   5.624  -5.541
  118   HD22  LEU  16          1HD2      LEU  16   5.266   6.397  -4.843
  119   HD23  LEU  16          2HD2      LEU  16   3.767   7.307  -5.019
  120    H    THR  17           HN       THR  17   2.652   5.850   0.401
  121    HA   THR  17           HA       THR  17   2.233   8.705   0.718
  122    HB   THR  17           HB       THR  17   3.473   6.772   2.684
  123    HG1  THR  17           1HG      THR  17   1.322   6.153   2.045
  124   HG21  THR  17          3HG2      THR  17   2.731   8.424   4.350
  125   HG22  THR  17          1HG2      THR  17   2.136   9.457   3.054
  126   HG23  THR  17          2HG2      THR  17   3.861   9.129   3.196
  127    H    VAL  18           HN       VAL  18   3.722  10.050  -0.033
  128    HA   VAL  18           HA       VAL  18   6.549   9.231   0.072
  129    HB   VAL  18           HB       VAL  18   5.189  10.979  -1.985
  130   HG11  VAL  18          1HG1      VAL  18   7.385  10.995  -3.111
  131   HG12  VAL  18          2HG1      VAL  18   8.087  10.191  -1.706
  132   HG13  VAL  18          3HG1      VAL  18   7.413  11.814  -1.550
  133   HG21  VAL  18          3HG2      VAL  18   5.761   9.215  -3.564
  134   HG22  VAL  18          1HG2      VAL  18   4.745   8.588  -2.268
  135   HG23  VAL  18          2HG2      VAL  18   6.479   8.266  -2.261
  136    H    LEU  19           HN       LEU  19   7.854  10.494   1.230
  137    HA   LEU  19           HA       LEU  19   6.868  13.070   2.179
  138    HB2  LEU  19           2HB      LEU  19   9.368  11.523   2.876
  139    HB3  LEU  19           1HB      LEU  19   8.940  13.075   3.569
  140    HG   LEU  19           HG       LEU  19   7.452  10.472   3.905
  141   HD11  LEU  19          1HD1      LEU  19   9.486  10.672   5.238
  142   HD12  LEU  19          2HD1      LEU  19   8.040  10.717   6.247
  143   HD13  LEU  19          3HD1      LEU  19   8.913  12.208   5.890
  144   HD21  LEU  19          3HD2      LEU  19   5.878  12.320   3.721
  145   HD22  LEU  19          1HD2      LEU  19   6.760  13.208   4.962
  146   HD23  LEU  19          2HD2      LEU  19   5.942  11.698   5.371
  147    H    TYR  20           HN       TYR  20   7.471  14.943   1.345
  148    HA   TYR  20           HA       TYR  20   9.753  14.980  -0.505
  149    HB2  TYR  20           2HB      TYR  20   8.426  16.689  -1.826
  150    HB3  TYR  20           1HB      TYR  20   7.831  15.036  -1.903
  151    HD1  TYR  20           1HD      TYR  20   5.789  14.403  -0.621
  152    HD2  TYR  20           2HD      TYR  20   7.080  18.447  -0.934
  153    HE1  TYR  20           1HE      TYR  20   3.552  15.162   0.063
  154    HE2  TYR  20           2HE      TYR  20   4.848  19.217  -0.247
  155    HH   TYR  20           HH       TYR  20   2.417  18.192  -0.387
  156    H    ASP  21           HN       ASP  21  10.139  17.477  -1.059
  157    HA   ASP  21           HA       ASP  21  10.876  18.609   1.527
  158    HB2  ASP  21           2HB      ASP  21  12.590  18.241  -0.262
  159    HB3  ASP  21           1HB      ASP  21  11.762  19.444  -1.244
  160    H    GLU  22           HN       GLU  22   9.776  20.249   2.379
  161    HA   GLU  22           HA       GLU  22   7.398  21.130   1.127
  162    HB2  GLU  22           2HB      GLU  22   7.044  22.457   3.146
  163    HB3  GLU  22           1HB      GLU  22   7.564  20.824   3.548
  164    HG2  GLU  22           2HG      GLU  22   9.684  21.531   4.210
  165    HG3  GLU  22           1HG      GLU  22   9.540  23.069   3.362
  166    H    GLU  23           HN       GLU  23  10.543  22.343   0.791
  167    HA   GLU  23           HA       GLU  23  10.033  25.112   0.869
  168    HB2  GLU  23           2HB      GLU  23  12.189  23.591  -0.593
  169    HB3  GLU  23           1HB      GLU  23  12.185  25.323  -0.306
  170    HG2  GLU  23           2HG      GLU  23  12.274  23.171   1.789
  171    HG3  GLU  23           1HG      GLU  23  13.616  24.191   1.281
  172    H    ARG  24           HN       ARG  24  10.762  23.183  -2.054
  173    HA   ARG  24           HA       ARG  24   8.675  24.648  -3.478
  174    HB2  ARG  24           2HB      ARG  24  11.581  24.521  -4.234
  175    HB3  ARG  24           1HB      ARG  24  10.321  24.883  -5.390
  176    HG2  ARG  24           2HG      ARG  24   9.662  26.821  -3.973
  177    HG3  ARG  24           1HG      ARG  24  11.069  26.483  -2.961
  178    HD2  ARG  24           2HD      ARG  24  11.724  28.177  -4.485
  179    HD3  ARG  24           1HD      ARG  24  12.474  26.681  -5.037
  180    HE   ARG  24           HE       ARG  24   9.928  27.428  -6.255
  181   HH11  ARG  24          1HH1      ARG  24  13.414  27.181  -6.532
  182   HH12  ARG  24          2HH1      ARG  24  13.433  27.499  -8.241
  183   HH21  ARG  24          1HH2      ARG  24   9.942  27.827  -8.510
  184   HH22  ARG  24          2HH2      ARG  24  11.456  27.844  -9.371
  185    H    TYR  25           HN       TYR  25   9.722  21.718  -2.652
  186    HA   TYR  25           HA       TYR  25   9.519  20.582  -5.353
  187    HB2  TYR  25           2HB      TYR  25  10.704  19.398  -2.837
  188    HB3  TYR  25           1HB      TYR  25  10.566  18.544  -4.370
  189    HD1  TYR  25           2HD      TYR  25  11.862  19.348  -6.340
  190    HD2  TYR  25           1HD      TYR  25  12.446  20.963  -2.448
  191    HE1  TYR  25           2HE      TYR  25  14.014  20.294  -7.060
  192    HE2  TYR  25           1HE      TYR  25  14.594  21.914  -3.160
  193    HH   TYR  25           HH       TYR  25  15.537  22.101  -6.420
  194    H    ASP  26           HN       ASP  26   7.362  20.464  -5.612
  195    HA   ASP  26           HA       ASP  26   5.887  18.805  -3.683
  196    HB2  ASP  26           2HB      ASP  26   5.092  21.140  -3.862
  197    HB3  ASP  26           1HB      ASP  26   4.794  20.898  -5.578
  198    H    ILE  27           HN       ILE  27   4.229  17.436  -4.568
  199    HA   ILE  27           HA       ILE  27   5.279  16.075  -6.933
  200    HB   ILE  27           HB       ILE  27   3.162  15.148  -4.983
  201   HG12  ILE  27          2HG1      ILE  27   6.095  14.404  -5.144
  202   HG13  ILE  27          1HG1      ILE  27   5.383  15.452  -3.921
  203   HG21  ILE  27          1HG2      ILE  27   3.573  12.927  -5.955
  204   HG22  ILE  27          2HG2      ILE  27   4.684  13.653  -7.118
  205   HG23  ILE  27          3HG2      ILE  27   2.970  14.072  -7.154
  206   HD11  ILE  27          3HD1      ILE  27   4.046  13.610  -3.093
  207   HD12  ILE  27          1HD1      ILE  27   5.757  13.184  -3.095
  208   HD13  ILE  27          2HD1      ILE  27   4.689  12.552  -4.350
  209    H    VAL  28           HN       VAL  28   4.423  16.594  -8.848
  210    HA   VAL  28           HA       VAL  28   1.750  17.672  -9.058
  211    HB   VAL  28           HB       VAL  28   3.722  16.879 -11.218
  212   HG11  VAL  28          1HG1      VAL  28   1.449  16.788 -12.070
  213   HG12  VAL  28          2HG1      VAL  28   2.292  18.189 -12.730
  214   HG13  VAL  28          3HG1      VAL  28   1.122  18.399 -11.427
  215   HG21  VAL  28          3HG2      VAL  28   4.495  18.724  -9.832
  216   HG22  VAL  28          1HG2      VAL  28   2.978  19.583 -10.109
  217   HG23  VAL  28          2HG2      VAL  28   4.083  19.284 -11.452
  218    H    GLU  29           HN       GLU  29   3.418  14.744 -10.183
  219    HA   GLU  29           HA       GLU  29   0.909  13.292  -9.869
  220    HB2  GLU  29           2HB      GLU  29   2.562  13.372 -12.373
  221    HB3  GLU  29           1HB      GLU  29   1.591  11.960 -11.983
  222    HG2  GLU  29           2HG      GLU  29  -0.363  13.586 -11.767
  223    HG3  GLU  29           1HG      GLU  29   0.684  14.748 -12.579
  224    H    GLN  30           HN       GLN  30   1.164  11.041  -9.583
  225    HA   GLN  30           HA       GLN  30   3.783   9.894  -9.246
  226    HB2  GLN  30           2HB      GLN  30   3.555   9.424  -6.860
  227    HB3  GLN  30           1HB      GLN  30   3.497  11.161  -7.121
  228    HG2  GLN  30           2HG      GLN  30   1.134  11.211  -6.817
  229    HG3  GLN  30           1HG      GLN  30   1.039   9.453  -6.822
  230   HE21  GLN  30          1HE2      GLN  30   1.695   8.307  -5.020
  231   HE22  GLN  30          2HE2      GLN  30   1.906   9.054  -3.473
  232    H    THR  31           HN       THR  31   3.476   7.597  -8.322
  233    HA   THR  31           HA       THR  31   1.145   6.325  -9.406
  234    HB   THR  31           HB       THR  31   3.140   5.177  -7.431
  235    HG1  THR  31           1HG      THR  31   3.230   4.993 -10.279
  236   HG21  THR  31          3HG2      THR  31   1.105   3.847  -7.727
  237   HG22  THR  31          1HG2      THR  31   2.495   3.033  -8.443
  238   HG23  THR  31          2HG2      THR  31   1.335   3.869  -9.476
  239    H    GLU  32           HN       GLU  32  -0.748   6.875  -8.456
  240    HA   GLU  32           HA       GLU  32  -0.898   7.993  -5.882
  241    HB2  GLU  32           2HB      GLU  32  -3.105   6.902  -7.633
  242    HB3  GLU  32           1HB      GLU  32  -3.352   7.899  -6.204
  243    HG2  GLU  32           2HG      GLU  32  -2.089   9.710  -7.266
  244    HG3  GLU  32           1HG      GLU  32  -1.886   8.713  -8.704
  245    H    THR  33           HN       THR  33  -2.109   4.829  -7.023
  246    HA   THR  33           HA       THR  33  -1.696   3.834  -4.290
  247    HB   THR  33           HB       THR  33  -3.795   2.470  -4.527
  248    HG1  THR  33           1HG      THR  33  -4.568   2.508  -6.499
  249   HG21  THR  33          3HG2      THR  33  -5.319   4.286  -3.927
  250   HG22  THR  33          1HG2      THR  33  -4.166   5.467  -4.549
  251   HG23  THR  33          2HG2      THR  33  -3.753   4.488  -3.141
  252    H    VAL  34           HN       VAL  34  -1.170   1.648  -4.129
  253    HA   VAL  34           HA       VAL  34  -0.936   0.154  -6.652
  254    HB   VAL  34           HB       VAL  34   1.099  -0.981  -5.684
  255   HG11  VAL  34          1HG1      VAL  34   1.305   0.665  -7.461
  256   HG12  VAL  34          2HG1      VAL  34   2.656   0.793  -6.337
  257   HG13  VAL  34          3HG1      VAL  34   1.340   1.967  -6.274
  258   HG21  VAL  34          3HG2      VAL  34   0.827  -0.338  -3.357
  259   HG22  VAL  34          1HG2      VAL  34   1.030   1.361  -3.783
  260   HG23  VAL  34          2HG2      VAL  34   2.376   0.237  -3.973
  261    H    GLN  35           HN       GLN  35  -1.203  -2.109  -6.463
  262    HA   GLN  35           HA       GLN  35  -2.783  -2.842  -4.109
  263    HB2  GLN  35           2HB      GLN  35  -3.879  -3.067  -6.303
  264    HB3  GLN  35           1HB      GLN  35  -2.612  -4.170  -6.821
  265    HG2  GLN  35           2HG      GLN  35  -3.307  -5.820  -5.255
  266    HG3  GLN  35           1HG      GLN  35  -4.417  -4.692  -4.476
  267   HE21  GLN  35          1HE2      GLN  35  -6.163  -6.050  -4.814
  268   HE22  GLN  35          2HE2      GLN  35  -6.887  -6.247  -6.375
  269    H    VAL  36           HN       VAL  36  -2.036  -4.247  -2.676
  270    HA   VAL  36           HA       VAL  36   0.171  -6.032  -3.460
  271    HB   VAL  36           HB       VAL  36   1.145  -4.253  -2.148
  272   HG11  VAL  36          1HG1      VAL  36  -0.824  -3.441  -1.010
  273   HG12  VAL  36          2HG1      VAL  36   0.445  -3.801   0.158
  274   HG13  VAL  36          3HG1      VAL  36  -0.909  -4.913  -0.043
  275   HG21  VAL  36          3HG2      VAL  36   2.106  -5.533  -0.295
  276   HG22  VAL  36          1HG2      VAL  36   2.036  -6.480  -1.779
  277   HG23  VAL  36          2HG2      VAL  36   0.855  -6.761  -0.500
  278    H    ASP  37           HN       ASP  37   0.021  -8.092  -2.790
  279    HA   ASP  37           HA       ASP  37  -2.068  -8.802  -0.845
  280    HB2  ASP  37           2HB      ASP  37  -1.497 -10.255  -3.442
  281    HB3  ASP  37           1HB      ASP  37  -2.558 -10.850  -2.172
  282    H    LEU  38           HN       LEU  38  -1.660 -10.914   0.182
  283    HA   LEU  38           HA       LEU  38   1.236 -11.473   0.272
  284    HB2  LEU  38           2HB      LEU  38  -0.729 -11.426   2.564
  285    HB3  LEU  38           1HB      LEU  38   0.929 -11.980   2.687
  286    HG   LEU  38           HG       LEU  38   0.084  -9.172   1.969
  287   HD11  LEU  38          1HD1      LEU  38   0.945  -8.584   4.186
  288   HD12  LEU  38          2HD1      LEU  38   1.224 -10.291   4.527
  289   HD13  LEU  38          3HD1      LEU  38  -0.419  -9.696   4.291
  290   HD21  LEU  38          3HD2      LEU  38   2.454  -8.634   2.256
  291   HD22  LEU  38          1HD2      LEU  38   2.205  -9.792   0.949
  292   HD23  LEU  38          2HD2      LEU  38   2.808 -10.344   2.512
  293    H    GLU  39           HN       GLU  39   1.886 -13.533   0.286
  294    HA   GLU  39           HA       GLU  39  -0.144 -15.655   0.553
  295    HB2  GLU  39           2HB      GLU  39   2.150 -15.393  -1.354
  296    HB3  GLU  39           1HB      GLU  39   1.654 -16.989  -0.819
  297    HG2  GLU  39           2HG      GLU  39  -0.637 -16.466  -1.625
  298    HG3  GLU  39           1HG      GLU  39   0.007 -14.974  -2.303
  299    H    GLY  40           HN       GLY  40   0.772 -17.714   1.330
  300    HA2  GLY  40           2HA      GLY  40   2.995 -18.678   2.102
  301    HA3  GLY  40           1HA      GLY  40   3.081 -17.244   3.113
  302    HA   PRO  41           HA       PRO  41   1.507 -20.623   5.822
  303    HB2  PRO  41           2HB      PRO  41   2.279 -19.190   8.078
  304    HB3  PRO  41           1HB      PRO  41   3.244 -20.430   7.272
  305    HG2  PRO  41           2HG      PRO  41   3.388 -17.459   7.035
  306    HG3  PRO  41           1HG      PRO  41   4.700 -18.653   7.048
  307    HD2  PRO  41           2HD      PRO  41   3.880 -17.504   4.773
  308    HD3  PRO  41           1HD      PRO  41   4.383 -19.206   4.816
  309    H    ARG  42           HN       ARG  42  -0.576 -20.641   6.157
  310    HA   ARG  42           HA       ARG  42  -2.238 -18.396   6.139
  311    HB2  ARG  42           2HB      ARG  42  -4.030 -19.928   6.884
  312    HB3  ARG  42           1HB      ARG  42  -3.099 -20.570   5.540
  313    HG2  ARG  42           2HG      ARG  42  -1.905 -22.050   7.015
  314    HG3  ARG  42           1HG      ARG  42  -2.698 -21.339   8.422
  315    HD2  ARG  42           2HD      ARG  42  -4.851 -22.134   7.648
  316    HD3  ARG  42           1HD      ARG  42  -4.115 -22.763   6.174
  317    HE   ARG  42           HE       ARG  42  -2.741 -24.129   7.961
  318   HH11  ARG  42          1HH1      ARG  42  -6.170 -23.396   7.977
  319   HH12  ARG  42          2HH1      ARG  42  -6.609 -24.853   8.815
  320   HH21  ARG  42          1HH2      ARG  42  -3.310 -26.044   9.031
  321   HH22  ARG  42          2HH2      ARG  42  -4.979 -26.382   9.396
  322    H    GLY  43           HN       GLY  43  -0.648 -20.040   8.792
  323    HA2  GLY  43           2HA      GLY  43  -2.137 -19.080  10.947
  324    HA3  GLY  43           1HA      GLY  43  -0.420 -19.451  11.000
  325    H    VAL  44           HN       VAL  44   0.681 -17.574   9.368
  326    HA   VAL  44           HA       VAL  44   0.724 -15.284  11.032
  327    HB   VAL  44           HB       VAL  44   1.758 -15.538   8.199
  328   HG11  VAL  44          1HG1      VAL  44   2.490 -13.603  10.397
  329   HG12  VAL  44          2HG1      VAL  44   1.573 -13.222   8.939
  330   HG13  VAL  44          3HG1      VAL  44   3.263 -13.709   8.815
  331   HG21  VAL  44          3HG2      VAL  44   2.710 -17.262   9.622
  332   HG22  VAL  44          1HG2      VAL  44   3.156 -16.050  10.822
  333   HG23  VAL  44          2HG2      VAL  44   3.925 -16.041   9.234
  334    H    LEU  45           HN       LEU  45  -0.751 -15.946   7.886
  335    HA   LEU  45           HA       LEU  45  -1.779 -13.393   7.361
  336    HB2  LEU  45           2HB      LEU  45  -2.907 -16.091   6.589
  337    HB3  LEU  45           1HB      LEU  45  -3.393 -14.560   5.890
  338    HG   LEU  45           HG       LEU  45  -0.635 -15.768   5.688
  339   HD11  LEU  45          1HD1      LEU  45  -2.823 -15.510   3.632
  340   HD12  LEU  45          2HD1      LEU  45  -2.300 -17.006   4.406
  341   HD13  LEU  45          3HD1      LEU  45  -1.197 -16.129   3.345
  342   HD21  LEU  45          3HD2      LEU  45  -0.225 -13.982   4.061
  343   HD22  LEU  45          1HD2      LEU  45  -0.571 -13.339   5.667
  344   HD23  LEU  45          2HD2      LEU  45  -1.815 -13.302   4.417
  345    H    THR  46           HN       THR  46  -3.025 -16.048   9.295
  346    HA   THR  46           HA       THR  46  -5.597 -14.952   9.759
  347    HB   THR  46           HB       THR  46  -4.069 -16.912  11.491
  348    HG1  THR  46           1HG      THR  46  -4.286 -17.627   9.304
  349   HG21  THR  46          3HG2      THR  46  -6.271 -17.646  12.226
  350   HG22  THR  46          1HG2      THR  46  -7.038 -16.440  11.193
  351   HG23  THR  46          2HG2      THR  46  -6.057 -15.928  12.565
  352    H    VAL  47           HN       VAL  47  -2.534 -14.800  11.541
  353    HA   VAL  47           HA       VAL  47  -3.512 -13.426  13.798
  354    HB   VAL  47           HB       VAL  47  -0.729 -13.366  12.614
  355   HG11  VAL  47          1HG1      VAL  47  -1.073 -11.504  14.144
  356   HG12  VAL  47          2HG1      VAL  47   0.003 -12.706  14.859
  357   HG13  VAL  47          3HG1      VAL  47  -1.681 -12.612  15.374
  358   HG21  VAL  47          3HG2      VAL  47  -1.909 -15.090  14.789
  359   HG22  VAL  47          1HG2      VAL  47  -0.218 -15.073  14.288
  360   HG23  VAL  47          2HG2      VAL  47  -1.463 -15.621  13.166
  361    H    PHE  48           HN       PHE  48  -2.114 -12.260  10.755
  362    HA   PHE  48           HA       PHE  48  -2.159  -9.507  11.413
  363    HB2  PHE  48           2HB      PHE  48  -0.851 -10.580   9.541
  364    HB3  PHE  48           1HB      PHE  48  -2.360 -10.714   8.646
  365    HD1  PHE  48           2HD      PHE  48  -0.011  -8.301  10.168
  366    HD2  PHE  48           1HD      PHE  48  -3.200  -8.899   7.418
  367    HE1  PHE  48           2HE      PHE  48   0.330  -6.028   9.292
  368    HE2  PHE  48           1HE      PHE  48  -2.867  -6.626   6.532
  369    HZ   PHE  48           HZ       PHE  48  -1.098  -5.191   7.471
  370    H    ARG  49           HN       ARG  49  -4.557 -11.706  10.233
  371    HA   ARG  49           HA       ARG  49  -6.422  -9.851   9.201
  372    HB2  ARG  49           2HB      ARG  49  -6.159 -12.603   9.322
  373    HB3  ARG  49           1HB      ARG  49  -7.553 -12.293  10.343
  374    HG2  ARG  49           2HG      ARG  49  -7.483 -10.984   7.687
  375    HG3  ARG  49           1HG      ARG  49  -7.745 -12.726   7.739
  376    HD2  ARG  49           2HD      ARG  49  -9.892 -11.801   7.757
  377    HD3  ARG  49           1HD      ARG  49  -9.580 -12.224   9.439
  378    HE   ARG  49           HE       ARG  49  -8.941  -9.762   9.655
  379   HH11  ARG  49          1HH1      ARG  49 -11.367 -11.013   7.468
  380   HH12  ARG  49          2HH1      ARG  49 -12.277  -9.532   7.411
  381   HH21  ARG  49          1HH2      ARG  49 -10.127  -7.809   9.618
  382   HH22  ARG  49          2HH2      ARG  49 -11.575  -7.710   8.662
  383    H    PHE  50           HN       PHE  50  -5.644 -10.859  12.429
  384    HA   PHE  50           HA       PHE  50  -8.182 -10.237  13.584
  385    HB2  PHE  50           2HB      PHE  50  -5.469 -10.825  14.748
  386    HB3  PHE  50           1HB      PHE  50  -6.864 -10.450  15.739
  387    HD1  PHE  50           1HD      PHE  50  -9.027 -11.892  14.474
  388    HD2  PHE  50           2HD      PHE  50  -4.971 -13.044  15.057
  389    HE1  PHE  50           1HE      PHE  50  -9.699 -14.257  14.435
  390    HE2  PHE  50           2HE      PHE  50  -5.633 -15.412  15.015
  391    HZ   PHE  50           HZ       PHE  50  -8.001 -16.021  14.704
  392    H    ALA  51           HN       ALA  51  -5.249  -8.476  12.979
  393    HA   ALA  51           HA       ALA  51  -5.803  -6.443  14.946
  394    HB1  ALA  51           1HB      ALA  51  -3.718  -5.451  14.246
  395    HB2  ALA  51           2HB      ALA  51  -3.645  -6.514  12.841
  396    HB3  ALA  51           3HB      ALA  51  -3.499  -7.188  14.464
  397    H    ARG  52           HN       ARG  52  -5.738  -4.140  14.308
  398    HA   ARG  52           HA       ARG  52  -7.564  -3.596  12.143
  399    HB2  ARG  52           2HB      ARG  52  -6.188  -1.619  13.948
  400    HB3  ARG  52           1HB      ARG  52  -7.666  -1.406  13.050
  401    HG2  ARG  52           2HG      ARG  52  -8.744  -3.101  14.509
  402    HG3  ARG  52           1HG      ARG  52  -7.264  -3.125  15.474
  403    HD2  ARG  52           2HD      ARG  52  -7.559  -0.611  15.697
  404    HD3  ARG  52           1HD      ARG  52  -9.178  -0.844  15.039
  405    HE   ARG  52           HE       ARG  52  -8.316  -2.266  17.470
  406   HH11  ARG  52          1HH1      ARG  52 -10.553  -0.132  15.805
  407   HH12  ARG  52          2HH1      ARG  52 -11.628  -0.007  17.164
  408   HH21  ARG  52          1HH2      ARG  52  -9.696  -2.073  19.250
  409   HH22  ARG  52          2HH2      ARG  52 -11.129  -1.090  19.139
  410    HA   PRO  53           HA       PRO  53  -4.596  -2.223   9.130
  411    HB2  PRO  53           2HB      PRO  53  -5.549   0.345   8.593
  412    HB3  PRO  53           1HB      PRO  53  -6.031  -1.140   7.775
  413    HG2  PRO  53           2HG      PRO  53  -7.406   0.365   9.941
  414    HG3  PRO  53           1HG      PRO  53  -8.100  -0.574   8.606
  415    HD2  PRO  53           2HD      PRO  53  -8.039  -1.498  11.143
  416    HD3  PRO  53           1HD      PRO  53  -7.891  -2.571   9.738
  417    H    SER  54           HN       SER  54  -2.628  -1.680   9.664
  418    HA   SER  54           HA       SER  54  -2.022   0.894  10.804
  419    HB2  SER  54           2HB      SER  54  -1.491  -1.767  12.059
  420    HB3  SER  54           1HB      SER  54  -0.460  -0.395  12.377
  421    HG   SER  54           HG       SER  54  -3.148   0.138  12.597
  422    H    TYR  55           HN       TYR  55  -1.700  -0.561   8.263
  423    HA   TYR  55           HA       TYR  55   1.225  -0.667   8.113
  424    HB2  TYR  55           2HB      TYR  55   0.919  -2.289   6.219
  425    HB3  TYR  55           1HB      TYR  55   0.440  -2.903   7.794
  426    HD1  TYR  55           1HD      TYR  55  -2.093  -2.769   8.363
  427    HD2  TYR  55           2HD      TYR  55  -0.544  -2.455   4.413
  428    HE1  TYR  55           1HE      TYR  55  -4.289  -3.399   7.458
  429    HE2  TYR  55           2HE      TYR  55  -2.741  -3.077   3.500
  430    HH   TYR  55           HH       TYR  55  -5.543  -3.011   5.237
  431    H    GLU  56           HN       GLU  56   2.192   0.571   6.636
  432    HA   GLU  56           HA       GLU  56   0.442   2.089   4.822
  433    HB2  GLU  56           2HB      GLU  56   2.793   3.072   6.436
  434    HB3  GLU  56           1HB      GLU  56   2.127   3.971   5.084
  435    HG2  GLU  56           2HG      GLU  56   1.090   4.973   6.857
  436    HG3  GLU  56           1HG      GLU  56  -0.108   3.771   6.387
  437    H    VAL  57           HN       VAL  57   1.268   2.672   2.825
  438    HA   VAL  57           HA       VAL  57   3.731   1.320   1.971
  439    HB   VAL  57           HB       VAL  57   1.511   2.584   0.336
  440   HG11  VAL  57          1HG1      VAL  57   3.954   1.070  -0.582
  441   HG12  VAL  57          2HG1      VAL  57   3.666   2.797  -0.787
  442   HG13  VAL  57          3HG1      VAL  57   2.635   1.629  -1.614
  443   HG21  VAL  57          3HG2      VAL  57   0.991   0.286  -0.337
  444   HG22  VAL  57          1HG2      VAL  57   0.846   0.495   1.409
  445   HG23  VAL  57          2HG2      VAL  57   2.259  -0.314   0.731
  446    H    PHE  58           HN       PHE  58   5.540   2.539   1.607
  447    HA   PHE  58           HA       PHE  58   5.218   5.450   1.586
  448    HB2  PHE  58           2HB      PHE  58   5.372   4.965   3.917
  449    HB3  PHE  58           1HB      PHE  58   6.688   3.827   3.664
  450    HD1  PHE  58           1HD      PHE  58   5.802   7.420   3.498
  451    HD2  PHE  58           2HD      PHE  58   8.906   4.520   3.797
  452    HE1  PHE  58           1HE      PHE  58   7.425   9.204   3.966
  453    HE2  PHE  58           2HE      PHE  58  10.535   6.303   4.262
  454    HZ   PHE  58           HZ       PHE  58   9.794   8.650   4.345
  455    H    VAL  59           HN       VAL  59   6.884   6.590   0.682
  456    HA   VAL  59           HA       VAL  59   9.404   5.238   0.071
  457    HB   VAL  59           HB       VAL  59   7.926   6.854  -2.013
  458   HG11  VAL  59          1HG1      VAL  59  10.530   5.347  -2.156
  459   HG12  VAL  59          2HG1      VAL  59  10.335   7.099  -2.155
  460   HG13  VAL  59          3HG1      VAL  59   9.738   6.146  -3.513
  461   HG21  VAL  59          3HG2      VAL  59   7.713   4.764  -3.282
  462   HG22  VAL  59          1HG2      VAL  59   6.867   4.667  -1.738
  463   HG23  VAL  59          2HG2      VAL  59   8.431   3.880  -1.937
  464    H    ASP  60           HN       ASP  60  11.132   6.613   0.260
  465    HA   ASP  60           HA       ASP  60  10.497   9.327   1.189
  466    HB2  ASP  60           2HB      ASP  60  11.826   7.816   2.707
  467    HB3  ASP  60           1HB      ASP  60  13.115   7.848   1.508
  468    H    LEU  61           HN       LEU  61  10.819  10.923  -0.174
  469    HA   LEU  61           HA       LEU  61  12.943  10.700  -2.186
  470    HB2  LEU  61           2HB      LEU  61  10.084  11.558  -2.653
  471    HB3  LEU  61           1HB      LEU  61  11.378  11.776  -3.819
  472    HG   LEU  61           HG       LEU  61  10.585   9.071  -2.749
  473   HD11  LEU  61          1HD1      LEU  61   8.670  10.084  -3.879
  474   HD12  LEU  61          2HD1      LEU  61   9.345   8.746  -4.812
  475   HD13  LEU  61          3HD1      LEU  61   9.678  10.413  -5.288
  476   HD21  LEU  61          3HD2      LEU  61  12.175   9.944  -5.159
  477   HD22  LEU  61          1HD2      LEU  61  11.751   8.277  -4.757
  478   HD23  LEU  61          2HD2      LEU  61  12.817   9.197  -3.694
  479    H    THR  62           HN       THR  62  12.943  12.006   0.319
  480    HA   THR  62           HA       THR  62  12.393  14.763   0.164
  481    HB   THR  62           HB       THR  62  14.108  14.922   2.037
  482    HG1  THR  62           1HG      THR  62  14.035  12.070   1.988
  483   HG21  THR  62          3HG2      THR  62  12.679  13.742   3.652
  484   HG22  THR  62          1HG2      THR  62  11.870  12.911   2.321
  485   HG23  THR  62          2HG2      THR  62  11.725  14.661   2.488
  486    H    GLU  63           HN       GLU  63  15.227  12.841  -0.675
  487    HA   GLU  63           HA       GLU  63  16.720  15.134  -1.554
  488    HB2  GLU  63           2HB      GLU  63  17.203  12.174  -1.762
  489    HB3  GLU  63           1HB      GLU  63  18.337  13.400  -2.314
  490    HG2  GLU  63           2HG      GLU  63  17.321  13.288   0.501
  491    HG3  GLU  63           1HG      GLU  63  18.756  12.427  -0.036
  492    H    ALA  64           HN       ALA  64  15.944  12.151  -3.266
  493    HA   ALA  64           HA       ALA  64  15.418  11.695  -5.433
  494    HB1  ALA  64           1HB      ALA  64  13.679  13.035  -6.457
  495    HB2  ALA  64           2HB      ALA  64  13.974  14.343  -5.311
  496    HB3  ALA  64           3HB      ALA  64  13.324  12.805  -4.745
  497    H    GLY  65           HN       GLY  65  15.017  13.560  -7.598
  498    HA2  GLY  65           2HA      GLY  65  17.415  15.175  -7.749
  499    HA3  GLY  65           1HA      GLY  65  17.324  13.824  -8.875
  500    H    GLU  66           HN       GLU  66  17.068  14.913 -10.750
  501    HA   GLU  66           HA       GLU  66  14.786  16.736 -10.952
  502    HB2  GLU  66           2HB      GLU  66  17.179  16.481 -12.774
  503    HB3  GLU  66           1HB      GLU  66  15.853  17.597 -12.988
  504    HG2  GLU  66           2HG      GLU  66  17.555  18.890 -12.076
  505    HG3  GLU  66           1HG      GLU  66  16.488  18.548 -10.716
  506    H    GLY  67           HN       GLY  67  13.317  16.461 -12.620
  507    HA2  GLY  67           2HA      GLY  67  12.177  15.346 -14.301
  508    HA3  GLY  67           1HA      GLY  67  13.570  14.296 -14.503
  509    H    SER  68           HN       SER  68  10.898  13.409 -14.573
  510    HA   SER  68           HA       SER  68  10.050  12.333 -12.105
  511    HB2  SER  68           2HB      SER  68   8.542  12.616 -14.026
  512    HB3  SER  68           1HB      SER  68   9.428  11.375 -14.905
  513    HG   SER  68           HG       SER  68   7.377  10.896 -13.566
  514    H    HIS  69           HN       HIS  69  10.375  10.411 -11.179
  515    HA   HIS  69           HA       HIS  69  12.338   8.609 -12.405
  516    HB2  HIS  69           2HB      HIS  69  12.565  10.030  -9.795
  517    HB3  HIS  69           1HB      HIS  69  13.190   8.388  -9.903
  518    HD1  HIS  69           1HD      HIS  69  13.720  11.840 -11.327
  519    HD2  HIS  69           2HD      HIS  69  15.546   8.105 -11.308
  520    HE1  HIS  69           1HE      HIS  69  15.984  12.188 -12.352
  521    HE2  HIS  69           2HE      HIS  69  16.939   9.869 -12.585
  522    H    THR  70           HN       THR  70  12.086   6.483 -12.012
  523    HA   THR  70           HA       THR  70   9.734   5.717 -10.400
  524    HB   THR  70           HB       THR  70  10.980   3.930 -12.468
  525    HG1  THR  70           1HG      THR  70   9.215   6.119 -12.932
  526   HG21  THR  70          3HG2      THR  70   8.735   3.055 -12.661
  527   HG22  THR  70          1HG2      THR  70   8.112   4.326 -11.607
  528   HG23  THR  70          2HG2      THR  70   9.187   3.094 -10.959
  529    H    VAL  71           HN       VAL  71  10.256   4.792  -8.502
  530    HA   VAL  71           HA       VAL  71  12.793   3.288  -8.328
  531    HB   VAL  71           HB       VAL  71  13.084   4.100  -6.020
  532   HG11  VAL  71          1HG1      VAL  71  14.238   5.236  -7.832
  533   HG12  VAL  71          2HG1      VAL  71  13.785   6.383  -6.570
  534   HG13  VAL  71          3HG1      VAL  71  12.852   6.304  -8.067
  535   HG21  VAL  71          3HG2      VAL  71  11.768   5.980  -5.185
  536   HG22  VAL  71          1HG2      VAL  71  10.742   4.581  -5.500
  537   HG23  VAL  71          2HG2      VAL  71  10.764   5.932  -6.634
  538    H    ASP  72           HN       ASP  72  12.877   1.768  -6.466
  539    HA   ASP  72           HA       ASP  72  10.597   0.088  -6.354
  540    HB2  ASP  72           2HB      ASP  72  13.173   0.182  -4.807
  541    HB3  ASP  72           1HB      ASP  72  11.888  -0.920  -4.328
  542    H    VAL  73           HN       VAL  73   9.094  -0.250  -4.749
  543    HA   VAL  73           HA       VAL  73   8.615   2.065  -3.053
  544    HB   VAL  73           HB       VAL  73   6.856  -0.316  -3.666
  545   HG11  VAL  73          1HG1      VAL  73   5.054   1.016  -2.654
  546   HG12  VAL  73          2HG1      VAL  73   6.241   2.226  -2.168
  547   HG13  VAL  73          3HG1      VAL  73   6.310   0.599  -1.488
  548   HG21  VAL  73          3HG2      VAL  73   7.232   1.110  -5.602
  549   HG22  VAL  73          1HG2      VAL  73   6.777   2.531  -4.660
  550   HG23  VAL  73          2HG2      VAL  73   5.577   1.287  -5.016
  551    H    GLU  74           HN       GLU  74   8.786   2.106  -0.921
  552    HA   GLU  74           HA       GLU  74   9.763  -0.230   0.500
  553    HB2  GLU  74           2HB      GLU  74   9.967   2.640   0.778
  554    HB3  GLU  74           1HB      GLU  74   9.430   1.918   2.287
  555    HG2  GLU  74           2HG      GLU  74  11.879   1.057   0.765
  556    HG3  GLU  74           1HG      GLU  74  11.880   2.188   2.119
  557    H    HIS  75           HN       HIS  75   8.770  -0.925   2.529
  558    HA   HIS  75           HA       HIS  75   5.904  -0.307   2.709
  559    HB2  HIS  75           2HB      HIS  75   7.026  -3.115   2.506
  560    HB3  HIS  75           1HB      HIS  75   5.350  -2.713   2.864
  561    HD1  HIS  75           1HD      HIS  75   3.922  -1.748   0.879
  562    HD2  HIS  75           2HD      HIS  75   7.737  -3.017  -0.172
  563    HE1  HIS  75           1HE      HIS  75   3.915  -1.893  -1.627
  564    HE2  HIS  75           2HE      HIS  75   6.272  -2.542  -2.256
  565    H    ARG  76           HN       ARG  76   4.969  -0.707   4.733
  566    HA   ARG  76           HA       ARG  76   6.554  -1.891   6.843
  567    HB2  ARG  76           2HB      ARG  76   6.303   0.072   8.343
  568    HB3  ARG  76           1HB      ARG  76   7.355   0.380   6.972
  569    HG2  ARG  76           2HG      ARG  76   5.393   1.470   5.842
  570    HG3  ARG  76           1HG      ARG  76   4.540   1.347   7.383
  571    HD2  ARG  76           2HD      ARG  76   5.606   3.546   7.080
  572    HD3  ARG  76           1HD      ARG  76   6.258   2.675   8.469
  573    HE   ARG  76           HE       ARG  76   7.722   2.350   5.984
  574   HH11  ARG  76          1HH1      ARG  76   7.424   4.179   8.971
  575   HH12  ARG  76          2HH1      ARG  76   9.095   4.671   8.966
  576   HH21  ARG  76          1HH2      ARG  76   9.877   3.000   5.975
  577   HH22  ARG  76          2HH2      ARG  76  10.494   3.988   7.263
  578    H    GLY  77           HN       GLY  77   5.261  -2.050   8.886
  579    HA2  GLY  77           2HA      GLY  77   3.149  -2.233   9.964
  580    HA3  GLY  77           1HA      GLY  77   2.367  -2.020   8.402
  581    H    PHE  78           HN       PHE  78   3.106  -3.814   6.778
  582    HA   PHE  78           HA       PHE  78   2.867  -6.394   8.140
  583    HB2  PHE  78           2HB      PHE  78   2.355  -7.313   5.893
  584    HB3  PHE  78           1HB      PHE  78   1.237  -6.043   6.367
  585    HD1  PHE  78           2HD      PHE  78   1.405  -3.802   5.322
  586    HD2  PHE  78           1HD      PHE  78   3.725  -7.106   3.974
  587    HE1  PHE  78           2HE      PHE  78   1.847  -2.625   3.208
  588    HE2  PHE  78           1HE      PHE  78   4.166  -5.936   1.856
  589    HZ   PHE  78           HZ       PHE  78   3.228  -3.691   1.469
  590    HA   PRO  79           HA       PRO  79   7.143  -7.079   7.360
  591    HB2  PRO  79           2HB      PRO  79   6.978  -9.839   7.982
  592    HB3  PRO  79           1HB      PRO  79   7.340  -8.514   9.086
  593    HG2  PRO  79           2HG      PRO  79   5.052 -10.109   9.154
  594    HG3  PRO  79           1HG      PRO  79   5.254  -8.552   9.971
  595    HD2  PRO  79           2HD      PRO  79   3.882  -9.182   7.396
  596    HD3  PRO  79           1HD      PRO  79   3.463  -7.981   8.638
  597    H    GLY  80           HN       GLY  80   8.551  -7.810   5.831
  598    HA2  GLY  80           2HA      GLY  80   7.476  -9.049   3.452
  599    HA3  GLY  80           1HA      GLY  80   9.137  -8.527   3.704
  600    H    ASP  81           HN       ASP  81   7.698 -10.541   6.073
  601    HA   ASP  81           HA       ASP  81   9.562 -12.671   5.625
  602    HB2  ASP  81           2HB      ASP  81   8.912 -12.120   7.893
  603    HB3  ASP  81           1HB      ASP  81   7.221 -12.375   7.507
  604    H    LEU  82           HN       LEU  82   6.269 -11.970   4.875
  605    HA   LEU  82           HA       LEU  82   5.645 -14.657   3.997
  606    HB2  LEU  82           2HB      LEU  82   4.075 -12.087   3.773
  607    HB3  LEU  82           1HB      LEU  82   3.469 -13.688   3.399
  608    HG   LEU  82           HG       LEU  82   4.398 -12.839   6.143
  609   HD11  LEU  82          1HD1      LEU  82   2.018 -12.756   6.718
  610   HD12  LEU  82          2HD1      LEU  82   1.604 -13.047   5.028
  611   HD13  LEU  82          3HD1      LEU  82   2.434 -11.560   5.487
  612   HD21  LEU  82          3HD2      LEU  82   4.545 -15.245   5.713
  613   HD22  LEU  82          1HD2      LEU  82   2.859 -15.258   5.200
  614   HD23  LEU  82          2HD2      LEU  82   3.266 -14.880   6.876
  615    H    ALA  83           HN       ALA  83   4.443 -14.692   1.751
  616    HA   ALA  83           HA       ALA  83   6.337 -13.731  -0.219
  617    HB1  ALA  83           1HB      ALA  83   5.416 -15.989  -0.434
  618    HB2  ALA  83           2HB      ALA  83   4.997 -14.992  -1.829
  619    HB3  ALA  83           3HB      ALA  83   3.794 -15.316  -0.579
  620    H    VAL  84           HN       VAL  84   6.180 -11.679  -0.851
  621    HA   VAL  84           HA       VAL  84   3.611 -10.312  -0.581
  622    HB   VAL  84           HB       VAL  84   6.329  -9.130  -1.205
  623   HG11  VAL  84          1HG1      VAL  84   4.493  -7.700  -1.885
  624   HG12  VAL  84          2HG1      VAL  84   5.304  -7.022  -0.473
  625   HG13  VAL  84          3HG1      VAL  84   3.757  -7.849  -0.290
  626   HG21  VAL  84          3HG2      VAL  84   4.907  -9.355   1.448
  627   HG22  VAL  84          1HG2      VAL  84   6.421  -8.497   1.155
  628   HG23  VAL  84          2HG2      VAL  84   6.347 -10.249   0.965
  629    H    THR  85           HN       THR  85   2.351  -9.971  -2.280
  630    HA   THR  85           HA       THR  85   3.564 -10.031  -4.971
  631    HB   THR  85           HB       THR  85   0.632 -10.365  -4.418
  632    HG1  THR  85           1HG      THR  85   2.081 -11.977  -3.302
  633   HG21  THR  85          3HG2      THR  85   0.690 -11.569  -6.568
  634   HG22  THR  85          1HG2      THR  85   2.426 -11.254  -6.677
  635   HG23  THR  85          2HG2      THR  85   1.281  -9.914  -6.720
  636    H    VAL  86           HN       VAL  86   3.374  -8.211  -6.169
  637    HA   VAL  86           HA       VAL  86   1.803  -6.020  -5.010
  638    HB   VAL  86           HB       VAL  86   4.581  -5.600  -6.083
  639   HG11  VAL  86          1HG1      VAL  86   3.164  -3.633  -6.032
  640   HG12  VAL  86          2HG1      VAL  86   4.453  -3.494  -4.835
  641   HG13  VAL  86          3HG1      VAL  86   2.816  -3.906  -4.323
  642   HG21  VAL  86          3HG2      VAL  86   3.814  -5.994  -3.197
  643   HG22  VAL  86          1HG2      VAL  86   5.401  -5.498  -3.785
  644   HG23  VAL  86          2HG2      VAL  86   4.776  -7.098  -4.179
  645    H    GLU  87           HN       GLU  87   1.049  -4.499  -6.436
  646    HA   GLU  87           HA       GLU  87   1.535  -4.950  -9.304
  647    HB2  GLU  87           2HB      GLU  87  -0.581  -3.370  -7.812
  648    HB3  GLU  87           1HB      GLU  87  -0.335  -3.228  -9.549
  649    HG2  GLU  87           2HG      GLU  87  -1.054  -5.761  -8.086
  650    HG3  GLU  87           1HG      GLU  87  -2.173  -4.743  -8.992
  651    HA   PRO  88           HA       PRO  88   4.378  -3.025 -10.712
  652    HB2  PRO  88           2HB      PRO  88   3.839  -0.152 -10.288
  653    HB3  PRO  88           1HB      PRO  88   4.369  -0.996 -11.743
  654    HG2  PRO  88           2HG      PRO  88   1.663  -0.331 -10.924
  655    HG3  PRO  88           1HG      PRO  88   2.213  -1.022 -12.463
  656    HD2  PRO  88           2HD      PRO  88   0.690  -2.421 -10.700
  657    HD3  PRO  88           1HD      PRO  88   1.922  -3.209 -11.716
  658    H    ARG  89           HN       ARG  89   6.211  -3.133  -9.764
  659    HA   ARG  89           HA       ARG  89   6.319  -2.793  -6.907
  660    HB2  ARG  89           2HB      ARG  89   8.521  -3.887  -7.108
  661    HB3  ARG  89           1HB      ARG  89   7.178  -4.818  -7.755
  662    HG2  ARG  89           2HG      ARG  89   7.805  -3.910 -10.016
  663    HG3  ARG  89           1HG      ARG  89   9.290  -3.324  -9.257
  664    HD2  ARG  89           2HD      ARG  89   9.741  -5.589  -8.467
  665    HD3  ARG  89           1HD      ARG  89   8.303  -6.156  -9.306
  666    HE   ARG  89           HE       ARG  89  10.102  -4.764 -11.043
  667   HH11  ARG  89          1HH1      ARG  89   9.521  -7.885  -9.532
  668   HH12  ARG  89          2HH1      ARG  89  10.339  -8.769 -10.784
  669   HH21  ARG  89          1HH2      ARG  89  11.184  -5.927 -12.649
  670   HH22  ARG  89          2HH2      ARG  89  11.251  -7.662 -12.577
  671    H    MET  90           HN       MET  90   7.348  -1.119  -9.671
  672    HA   MET  90           HA       MET  90   8.917   0.712  -7.998
  673    HB2  MET  90           2HB      MET  90   9.011   0.181 -10.971
  674    HB3  MET  90           1HB      MET  90   9.737   1.603 -10.241
  675    HG2  MET  90           2HG      MET  90  11.146   0.130  -8.855
  676    HG3  MET  90           1HG      MET  90  10.464  -1.259  -9.701
  677    HE1  MET  90           3HE      MET  90  13.087  -1.910 -10.198
  678    HE2  MET  90           1HE      MET  90  13.617  -0.409  -9.439
  679    HE3  MET  90           2HE      MET  90  14.186  -0.830 -11.055
  680    H    ALA  91           HN       ALA  91   8.317   2.833  -7.904
  681    HA   ALA  91           HA       ALA  91   5.742   3.484  -9.188
  682    HB1  ALA  91           1HB      ALA  91   5.519   3.134  -6.772
  683    HB2  ALA  91           2HB      ALA  91   5.185   4.806  -7.221
  684    HB3  ALA  91           3HB      ALA  91   6.730   4.383  -6.482
  685    H    ARG  92           HN       ARG  92   5.413   5.660  -9.780
  686    HA   ARG  92           HA       ARG  92   7.960   6.966 -10.438
  687    HB2  ARG  92           2HB      ARG  92   6.921   7.869 -12.378
  688    HB3  ARG  92           1HB      ARG  92   6.449   6.176 -12.319
  689    HG2  ARG  92           2HG      ARG  92   4.278   6.775 -11.445
  690    HG3  ARG  92           1HG      ARG  92   4.754   8.471 -11.359
  691    HD2  ARG  92           2HD      ARG  92   3.480   8.308 -13.312
  692    HD3  ARG  92           1HD      ARG  92   5.152   8.309 -13.870
  693    HE   ARG  92           HE       ARG  92   4.751   5.725 -13.787
  694   HH11  ARG  92          1HH1      ARG  92   2.513   8.207 -14.786
  695   HH12  ARG  92          2HH1      ARG  92   1.726   7.209 -15.971
  696   HH21  ARG  92          1HH2      ARG  92   3.658   4.361 -15.294
  697   HH22  ARG  92          2HH2      ARG  92   2.339   5.014 -16.218
  698    H    VAL  93           HN       VAL  93   8.236   9.138 -10.078
  699    HA   VAL  93           HA       VAL  93   6.023  10.616  -8.860
  700    HB   VAL  93           HB       VAL  93   7.404   9.797  -7.011
  701   HG11  VAL  93          1HG1      VAL  93   9.663  11.321  -8.303
  702   HG12  VAL  93          2HG1      VAL  93   9.532   9.567  -8.185
  703   HG13  VAL  93          3HG1      VAL  93   9.713  10.540  -6.724
  704   HG21  VAL  93          3HG2      VAL  93   6.307  11.940  -6.744
  705   HG22  VAL  93          1HG2      VAL  93   7.679  12.759  -7.492
  706   HG23  VAL  93          2HG2      VAL  93   7.874  11.957  -5.934
  707    H    GLN  94           HN       GLN  94   5.753  12.529  -9.801
  708    HA   GLN  94           HA       GLN  94   8.010  13.662 -11.301
  709    HB2  GLN  94           2HB      GLN  94   6.006  13.228 -12.637
  710    HB3  GLN  94           1HB      GLN  94   5.042  14.198 -11.530
  711    HG2  GLN  94           2HG      GLN  94   6.186  16.191 -12.170
  712    HG3  GLN  94           1HG      GLN  94   7.352  15.281 -13.123
  713   HE21  GLN  94          1HE2      GLN  94   5.663  17.436 -13.968
  714   HE22  GLN  94          2HE2      GLN  94   4.685  16.811 -15.244
  715    H    LEU  95           HN       LEU  95   9.025  15.279 -10.403
  716    HA   LEU  95           HA       LEU  95   7.657  16.803  -8.294
  717    HB2  LEU  95           2HB      LEU  95  10.596  16.327  -8.790
  718    HB3  LEU  95           1HB      LEU  95   9.968  17.416  -7.568
  719    HG   LEU  95           HG       LEU  95   9.510  14.431  -7.654
  720   HD11  LEU  95          1HD1      LEU  95  10.953  14.383  -5.681
  721   HD12  LEU  95          2HD1      LEU  95  11.242  16.116  -5.850
  722   HD13  LEU  95          3HD1      LEU  95  11.809  15.001  -7.093
  723   HD21  LEU  95          3HD2      LEU  95   8.699  16.503  -5.611
  724   HD22  LEU  95          1HD2      LEU  95   8.544  14.757  -5.411
  725   HD23  LEU  95          2HD2      LEU  95   7.618  15.586  -6.663
  726    H    GLU  96           HN       GLU  96   7.208  18.842  -8.660
  727    HA   GLU  96           HA       GLU  96   8.732  20.281 -10.726
  728    HB2  GLU  96           2HB      GLU  96   6.234  19.568 -11.213
  729    HB3  GLU  96           1HB      GLU  96   5.862  20.938 -10.180
  730    HG2  GLU  96           2HG      GLU  96   5.803  21.633 -12.467
  731    HG3  GLU  96           1HG      GLU  96   7.189  22.381 -11.674
  732    H    GLU  97           HN       GLU  97   9.219  22.425 -10.198
  733    HA   GLU  97           HA       GLU  97   9.325  22.917  -7.398
  734    HB2  GLU  97           2HB      GLU  97  10.236  24.440  -9.813
  735    HB3  GLU  97           1HB      GLU  97  10.266  25.182  -8.225
  736    HG2  GLU  97           2HG      GLU  97  12.426  24.332  -8.579
  737    HG3  GLU  97           1HG      GLU  97  11.648  23.210  -7.466
  738    H    ARG  98           HN       ARG  98   7.119  22.912  -6.874
  739    HA   ARG  98           HA       ARG  98   5.755  25.457  -7.480
  740    HB2  ARG  98           2HB      ARG  98   4.544  23.622  -8.485
  741    HB3  ARG  98           1HB      ARG  98   4.527  22.742  -6.973
  742    HG2  ARG  98           2HG      ARG  98   3.080  24.432  -5.997
  743    HG3  ARG  98           1HG      ARG  98   3.152  25.370  -7.491
  744    HD2  ARG  98           2HD      ARG  98   1.089  24.135  -7.450
  745    HD3  ARG  98           1HD      ARG  98   2.136  23.459  -8.693
  746    HE   ARG  98           HE       ARG  98   2.320  22.112  -6.150
  747   HH11  ARG  98          1HH1      ARG  98   0.604  22.260  -9.214
  748   HH12  ARG  98          2HH1      ARG  98   0.018  20.627  -9.100
  749   HH21  ARG  98          1HH2      ARG  98   1.556  19.992  -6.000
  750   HH22  ARG  98          2HH2      ARG  98   0.551  19.335  -7.268
  751    H    GLN  99           HN       GLN  99   4.856  26.536  -5.790
  752    HA   GLN  99           HA       GLN  99   5.974  25.789  -3.234
  753    HB2  GLN  99           2HB      GLN  99   6.196  28.099  -3.968
  754    HB3  GLN  99           1HB      GLN  99   4.443  28.254  -4.061
  755    HG2  GLN  99           2HG      GLN  99   4.234  27.953  -1.711
  756    HG3  GLN  99           1HG      GLN  99   5.950  27.592  -1.560
  757   HE21  GLN  99          1HE2      GLN  99   6.296  29.243  -0.102
  758   HE22  GLN  99          2HE2      GLN  99   6.312  30.908  -0.570
  759    H    THR 100           HN       THR 100   4.782  24.058  -2.580
  760    HA   THR 100           HA       THR 100   2.095  24.773  -1.609
  761    HB   THR 100           HB       THR 100   3.143  21.969  -2.079
  762    HG1  THR 100           1HG      THR 100   2.101  21.984  -3.986
  763   HG21  THR 100          3HG2      THR 100   0.795  21.315  -1.756
  764   HG22  THR 100          1HG2      THR 100   0.382  22.993  -1.409
  765   HG23  THR 100          2HG2      THR 100   1.454  22.107  -0.324
  766    H    VAL 101           HN       VAL 101   2.421  25.461   0.429
  767    HA   VAL 101           HA       VAL 101   4.679  24.520   1.957
  768    HB   VAL 101           HB       VAL 101   2.465  26.355   2.897
  769   HG11  VAL 101          1HG1      VAL 101   5.302  25.991   3.863
  770   HG12  VAL 101          2HG1      VAL 101   3.846  25.419   4.679
  771   HG13  VAL 101          3HG1      VAL 101   4.129  27.149   4.495
  772   HG21  VAL 101          3HG2      VAL 101   3.455  27.253   0.867
  773   HG22  VAL 101          1HG2      VAL 101   5.068  27.069   1.552
  774   HG23  VAL 101          2HG2      VAL 101   3.932  28.212   2.269
  775    H    SER 102           HN       SER 102   4.151  22.314   2.173
  776    HA   SER 102           HA       SER 102   1.890  21.546   3.776
  777    HB2  SER 102           2HB      SER 102   4.317  19.952   2.917
  778    HB3  SER 102           1HB      SER 102   2.849  19.288   3.632
  779    HG   SER 102           HG       SER 102   2.759  19.103   1.381
  780    H    VAL 103           HN       VAL 103   2.789  19.775   5.591
  781    HA   VAL 103           HA       VAL 103   4.185  21.520   7.477
  782    HB   VAL 103           HB       VAL 103   3.340  19.993   9.230
  783   HG11  VAL 103          1HG1      VAL 103   1.208  21.043   7.367
  784   HG12  VAL 103          2HG1      VAL 103   2.044  21.968   8.616
  785   HG13  VAL 103          3HG1      VAL 103   0.980  20.635   9.067
  786   HG21  VAL 103          3HG2      VAL 103   1.666  18.295   8.665
  787   HG22  VAL 103          1HG2      VAL 103   3.226  17.938   7.921
  788   HG23  VAL 103          2HG2      VAL 103   1.920  18.616   6.948
  789    HA   PRO 104           HA       PRO 104   7.833  18.998   7.464
  790    HB2  PRO 104           2HB      PRO 104   8.697  19.372  10.013
  791    HB3  PRO 104           1HB      PRO 104   8.833  20.614   8.764
  792    HG2  PRO 104           2HG      PRO 104   6.796  20.327  10.937
  793    HG3  PRO 104           1HG      PRO 104   7.623  21.787  10.361
  794    HD2  PRO 104           2HD      PRO 104   5.094  21.152   9.627
  795    HD3  PRO 104           1HD      PRO 104   6.210  22.029   8.562
  796    H    VAL 105           HN       VAL 105   8.748  17.053   8.436
  797    HA   VAL 105           HA       VAL 105   6.659  15.483   9.795
  798    HB   VAL 105           HB       VAL 105   7.574  13.479   8.677
  799   HG11  VAL 105          1HG1      VAL 105   6.716  15.700   6.818
  800   HG12  VAL 105          2HG1      VAL 105   5.659  14.603   7.710
  801   HG13  VAL 105          3HG1      VAL 105   6.701  13.978   6.433
  802   HG21  VAL 105          3HG2      VAL 105   9.854  14.206   8.283
  803   HG22  VAL 105          1HG2      VAL 105   9.296  15.473   7.191
  804   HG23  VAL 105          2HG2      VAL 105   9.099  13.774   6.749
  805    H    THR 106           HN       THR 106   7.215  14.043  11.373
  806    HA   THR 106           HA       THR 106  10.021  13.941  12.228
  807    HB   THR 106           HB       THR 106   7.741  14.220  14.175
  808    HG1  THR 106           1HG      THR 106   9.620  16.266  13.532
  809   HG21  THR 106          3HG2      THR 106   9.544  14.702  15.782
  810   HG22  THR 106          1HG2      THR 106  10.733  14.445  14.506
  811   HG23  THR 106          2HG2      THR 106   9.727  13.105  15.053
  812    H    VAL 107           HN       VAL 107  10.281  11.867  11.554
  813    HA   VAL 107           HA       VAL 107   8.254   9.876  12.032
  814    HB   VAL 107           HB       VAL 107   9.834   8.303  10.934
  815   HG11  VAL 107          1HG1      VAL 107   8.196   9.517   9.617
  816   HG12  VAL 107          2HG1      VAL 107   9.693   9.318   8.705
  817   HG13  VAL 107          3HG1      VAL 107   9.311  10.873   9.444
  818   HG21  VAL 107          3HG2      VAL 107  11.933   9.348  11.639
  819   HG22  VAL 107          1HG2      VAL 107  11.586  10.742  10.614
  820   HG23  VAL 107          2HG2      VAL 107  11.863   9.158   9.887
  821    H    GLU 108           HN       GLU 108   8.275   8.254  13.476
  822    HA   GLU 108           HA       GLU 108  10.137   8.482  15.703
  823    HB2  GLU 108           2HB      GLU 108   7.415   7.784  15.426
  824    HB3  GLU 108           1HB      GLU 108   8.236   6.323  15.957
  825    HG2  GLU 108           2HG      GLU 108   8.560   8.968  17.341
  826    HG3  GLU 108           1HG      GLU 108   7.304   7.809  17.764
  827    H    MET 109           HN       MET 109  11.129   6.527  16.619
  828    HA   MET 109           HA       MET 109  11.990   4.706  14.460
  829    HB2  MET 109           2HB      MET 109  13.479   5.616  16.928
  830    HB3  MET 109           1HB      MET 109  14.070   4.406  15.796
  831    HG2  MET 109           2HG      MET 109  14.093   6.065  14.016
  832    HG3  MET 109           1HG      MET 109  13.474   7.280  15.133
  833    HE1  MET 109           3HE      MET 109  16.102   4.461  15.935
  834    HE2  MET 109           1HE      MET 109  17.619   5.295  15.594
  835    HE3  MET 109           2HE      MET 109  16.508   4.914  14.278
  836    H    ILE 110           HN       ILE 110  12.266   2.502  14.930
  837    HA   ILE 110           HA       ILE 110  10.536   1.555  17.081
  838    HB   ILE 110           HB       ILE 110  10.721  -0.648  16.041
  839   HG12  ILE 110          2HG1      ILE 110  12.483   0.701  13.976
  840   HG13  ILE 110          1HG1      ILE 110  13.056  -0.407  15.220
  841   HG21  ILE 110          1HG2      ILE 110   8.982   0.827  15.261
  842   HG22  ILE 110          2HG2      ILE 110   9.605  -0.112  13.906
  843   HG23  ILE 110          3HG2      ILE 110  10.086   1.571  14.106
  844   HD11  ILE 110          3HD1      ILE 110  11.119  -1.080  13.012
  845   HD12  ILE 110          1HD1      ILE 110  11.716  -2.191  14.245
  846   HD13  ILE 110          2HD1      ILE 110  12.832  -1.509  13.064
  847    H    ASN 111           HN       ASN 111  11.274  -0.406  18.316
  848    HA   ASN 111           HA       ASN 111  14.132  -0.694  18.649
  849    HB2  ASN 111           2HB      ASN 111  13.670   1.285  20.035
  850    HB3  ASN 111           1HB      ASN 111  12.461   0.375  20.935
  851   HD21  ASN 111          1HD2      ASN 111  13.111  -1.050  22.500
  852   HD22  ASN 111          2HD2      ASN 111  14.756  -1.225  23.006
  853    H    LEU 112           HN       LEU 112  14.593  -2.702  19.102
  854    HA   LEU 112           HA       LEU 112  13.078  -4.250  20.980
  855    HB2  LEU 112           2HB      LEU 112  11.770  -4.624  18.916
  856    HB3  LEU 112           1HB      LEU 112  13.220  -5.185  18.106
  857    HG   LEU 112           HG       LEU 112  13.345  -7.088  19.676
  858   HD11  LEU 112          1HD1      LEU 112  12.235  -6.077  21.590
  859   HD12  LEU 112          2HD1      LEU 112  11.438  -7.581  21.129
  860   HD13  LEU 112          3HD1      LEU 112  10.715  -6.031  20.700
  861   HD21  LEU 112          3HD2      LEU 112  12.214  -7.360  17.540
  862   HD22  LEU 112          1HD2      LEU 112  10.703  -6.799  18.253
  863   HD23  LEU 112          2HD2      LEU 112  11.422  -8.318  18.790
  864    H    GLU 113           HN       GLU 113  14.998  -4.305  22.097
  865    HA   GLU 113           HA       GLU 113  17.406  -5.161  20.704
  866    HB2  GLU 113           2HB      GLU 113  18.630  -4.463  22.672
  867    HB3  GLU 113           1HB      GLU 113  17.529  -3.186  22.188
  868    HG2  GLU 113           2HG      GLU 113  17.043  -5.132  24.437
  869    HG3  GLU 113           1HG      GLU 113  17.668  -3.495  24.625
  870    H    HIS 114           HN       HIS 114  15.353  -6.197  23.423
  871    HA   HIS 114           HA       HIS 114  16.946  -8.624  23.618
  872    HB2  HIS 114           2HB      HIS 114  15.440  -9.216  25.539
  873    HB3  HIS 114           1HB      HIS 114  16.406  -7.770  25.759
  874    HD1  HIS 114           1HD      HIS 114  12.829  -8.829  25.074
  875    HD2  HIS 114           2HD      HIS 114  14.995  -5.521  26.376
  876    HE1  HIS 114           1HE      HIS 114  11.125  -7.190  25.931
  877    HE2  HIS 114           2HE      HIS 114  12.477  -5.306  26.923
  878    H    HIS 115           HN       HIS 115  16.594  -9.872  21.956
  879    HA   HIS 115           HA       HIS 115  14.148 -11.370  21.937
  880    HB2  HIS 115           2HB      HIS 115  13.609 -11.077  19.583
  881    HB3  HIS 115           1HB      HIS 115  13.563  -9.525  20.397
  882    HD1  HIS 115           1HD      HIS 115  14.532 -10.869  17.333
  883    HD2  HIS 115           2HD      HIS 115  16.350  -8.220  19.981
  884    HE1  HIS 115           1HE      HIS 115  16.206  -9.578  15.963
  885    HE2  HIS 115           2HE      HIS 115  17.264  -7.948  17.569
  886    H    HIS 116           HN       HIS 116  14.389 -13.370  20.678
  887    HA   HIS 116           HA       HIS 116  15.557 -15.289  20.310
  888    HB2  HIS 116           2HB      HIS 116  17.803 -13.359  19.743
  889    HB3  HIS 116           1HB      HIS 116  18.097 -15.091  19.833
  890    HD1  HIS 116           1HD      HIS 116  18.092 -16.162  17.624
  891    HD2  HIS 116           2HD      HIS 116  15.557 -12.862  17.731
  892    HE1  HIS 116           1HE      HIS 116  17.145 -15.956  15.300
  893    HE2  HIS 116           2HE      HIS 116  15.578 -13.980  15.393
  894    H    HIS 117           HN       HIS 117  16.511 -16.790  21.656
  895    HA   HIS 117           HA       HIS 117  18.012 -15.842  23.968
  896    HB2  HIS 117           2HB      HIS 117  16.531 -16.987  25.580
  897    HB3  HIS 117           1HB      HIS 117  15.720 -15.660  24.760
  898    HD1  HIS 117           1HD      HIS 117  15.837 -19.456  24.771
  899    HD2  HIS 117           2HD      HIS 117  13.440 -16.339  23.407
  900    HE1  HIS 117           1HE      HIS 117  13.720 -20.532  23.960
  901    HE2  HIS 117           2HE      HIS 117  12.360 -18.653  22.978
  902    H    HIS 118           HN       HIS 118  19.121 -17.466  25.110
  903    HA   HIS 118           HA       HIS 118  18.857 -20.227  24.250
  904    HB2  HIS 118           2HB      HIS 118  21.201 -20.524  23.673
  905    HB3  HIS 118           1HB      HIS 118  20.500 -19.292  22.633
  906    HD1  HIS 118           1HD      HIS 118  22.938 -19.723  25.481
  907    HD2  HIS 118           2HD      HIS 118  21.625 -16.761  22.861
  908    HE1  HIS 118           1HE      HIS 118  24.555 -17.816  25.740
  909    HE2  HIS 118           2HE      HIS 118  23.739 -16.027  24.157
  910    H    HIS 119           HN       HIS 119  20.306 -21.652  25.582
  911    HA   HIS 119           HA       HIS 119  20.907 -20.402  28.186
  912    HB2  HIS 119           2HB      HIS 119  19.066 -22.117  28.224
  913    HB3  HIS 119           1HB      HIS 119  20.240 -23.314  27.684
  914    HD1  HIS 119           1HD      HIS 119  21.733 -24.357  29.442
  915    HD2  HIS 119           2HD      HIS 119  19.549 -21.117  30.873
  916    HE1  HIS 119           1HE      HIS 119  22.045 -24.373  31.932
  917    HE2  HIS 119           2HE      HIS 119  20.907 -22.279  32.742
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1   6.162 -31.282  12.029
    2    H2   MET   1           H2       MET   1   6.659 -31.186  10.411
    3    H3   MET   1           H3       MET   1   5.075 -31.645  10.780
    4    HA   MET   1           HA       MET   1   4.545 -29.511  11.609
    5    HB2  MET   1           2HB      MET   1   7.472 -28.942  11.127
    6    HB3  MET   1           1HB      MET   1   6.280 -27.665  11.315
    7    HG2  MET   1           2HG      MET   1   7.372 -27.999  13.404
    8    HG3  MET   1           1HG      MET   1   5.710 -28.570  13.538
    9    HE1  MET   1           2HE      MET   1   9.444 -31.274  13.315
   10    HE2  MET   1           3HE      MET   1   9.491 -29.516  13.494
   11    HE3  MET   1           1HE      MET   1   8.949 -30.234  11.979
   12    HA   PRO   2           HA       PRO   2   3.792 -29.461   7.175
   13    HB2  PRO   2           2HB      PRO   2   1.364 -28.248   7.348
   14    HB3  PRO   2           1HB      PRO   2   1.599 -29.974   7.633
   15    HG2  PRO   2           2HG      PRO   2   1.340 -27.743   9.610
   16    HG3  PRO   2           1HG      PRO   2   0.626 -29.367   9.651
   17    HD2  PRO   2           2HD      PRO   2   2.829 -28.705  11.082
   18    HD3  PRO   2           1HD      PRO   2   2.562 -30.337  10.440
   19    H    THR   3           HN       THR   3   4.850 -28.002   6.012
   20    HA   THR   3           HA       THR   3   4.636 -25.168   6.697
   21    HB   THR   3           HB       THR   3   6.404 -26.333   4.593
   22    HG1  THR   3           1HG      THR   3   6.481 -26.961   7.158
   23   HG21  THR   3          3HG2      THR   3   6.631 -23.879   6.343
   24   HG22  THR   3          1HG2      THR   3   6.249 -23.906   4.622
   25   HG23  THR   3          2HG2      THR   3   7.848 -24.403   5.175
   26    H    PHE   4           HN       PHE   4   2.847 -27.138   5.254
   27    HA   PHE   4           HA       PHE   4   2.428 -25.976   2.665
   28    HB2  PHE   4           2HB      PHE   4   0.814 -27.985   4.198
   29    HB3  PHE   4           1HB      PHE   4   0.593 -27.580   2.514
   30    HD1  PHE   4           1HD      PHE   4   2.729 -27.899   1.012
   31    HD2  PHE   4           2HD      PHE   4   2.069 -29.827   4.748
   32    HE1  PHE   4           1HE      PHE   4   4.327 -29.660   0.378
   33    HE2  PHE   4           2HE      PHE   4   3.669 -31.590   4.123
   34    HZ   PHE   4           HZ       PHE   4   4.799 -31.506   1.936
   35    H    ASP   5           HN       ASP   5  -0.296 -25.948   2.450
   36    HA   ASP   5           HA       ASP   5  -2.160 -24.707   2.731
   37    HB2  ASP   5           2HB      ASP   5  -2.108 -25.781   4.999
   38    HB3  ASP   5           1HB      ASP   5  -1.246 -24.368   5.591
   39    H    HIS   6           HN       HIS   6  -0.053 -23.442   1.581
   40    HA   HIS   6           HA       HIS   6   0.297 -20.858   2.774
   41    HB2  HIS   6           2HB      HIS   6   1.478 -20.208   0.746
   42    HB3  HIS   6           1HB      HIS   6   2.047 -21.780   1.285
   43    HD1  HIS   6           1HD      HIS   6   1.131 -20.054  -1.691
   44    HD2  HIS   6           2HD      HIS   6   0.621 -23.938  -0.289
   45    HE1  HIS   6           1HE      HIS   6   0.686 -21.454  -3.724
   46    HE2  HIS   6           2HE      HIS   6   0.582 -23.823  -2.870
   47    H    GLY   7           HN       GLY   7  -1.489 -19.753   3.073
   48    HA2  GLY   7           2HA      GLY   7  -3.535 -19.675   1.007
   49    HA3  GLY   7           1HA      GLY   7  -3.648 -18.962   2.613
   50    H    ASN   8           HN       ASN   8  -4.543 -17.313   0.887
   51    HA   ASN   8           HA       ASN   8  -2.297 -15.522   0.250
   52    HB2  ASN   8           2HB      ASN   8  -4.974 -15.539  -1.143
   53    HB3  ASN   8           1HB      ASN   8  -3.562 -14.596  -1.577
   54   HD21  ASN   8          1HD2      ASN   8  -1.757 -16.880  -1.099
   55   HD22  ASN   8          2HD2      ASN   8  -1.954 -17.907  -2.480
   56    H    LEU   9           HN       LEU   9  -2.523 -13.393   0.722
   57    HA   LEU   9           HA       LEU   9  -4.978 -12.520   2.056
   58    HB2  LEU   9           2HB      LEU   9  -3.017 -13.128   3.638
   59    HB3  LEU   9           1HB      LEU   9  -2.251 -11.682   3.017
   60    HG   LEU   9           HG       LEU   9  -3.406 -11.387   5.195
   61   HD11  LEU   9          1HD1      LEU   9  -4.501  -9.276   4.650
   62   HD12  LEU   9          2HD1      LEU   9  -4.489  -9.718   2.942
   63   HD13  LEU   9          3HD1      LEU   9  -2.967  -9.457   3.795
   64   HD21  LEU   9          3HD2      LEU   9  -5.857 -11.215   5.210
   65   HD22  LEU   9          1HD2      LEU   9  -5.292 -12.850   4.864
   66   HD23  LEU   9          2HD2      LEU   9  -5.886 -11.828   3.555
   67    H    SER  10           HN       SER  10  -5.709 -10.724   1.151
   68    HA   SER  10           HA       SER  10  -3.866  -9.252  -0.610
   69    HB2  SER  10           2HB      SER  10  -6.883  -9.483  -0.757
   70    HB3  SER  10           1HB      SER  10  -5.871  -8.564  -1.871
   71    HG   SER  10           HG       SER  10  -4.873 -10.505  -2.503
   72    H    LEU  11           HN       LEU  11  -3.199  -7.405   0.200
   73    HA   LEU  11           HA       LEU  11  -4.630  -6.007   2.275
   74    HB2  LEU  11           2HB      LEU  11  -2.207  -5.190   0.658
   75    HB3  LEU  11           1HB      LEU  11  -2.818  -4.340   2.062
   76    HG   LEU  11           HG       LEU  11  -1.777  -7.175   2.121
   77   HD11  LEU  11          1HD1      LEU  11  -0.428  -4.598   2.923
   78   HD12  LEU  11          2HD1      LEU  11   0.005  -5.616   1.549
   79   HD13  LEU  11          3HD1      LEU  11   0.208  -6.222   3.193
   80   HD21  LEU  11          3HD2      LEU  11  -3.361  -6.704   3.902
   81   HD22  LEU  11          1HD2      LEU  11  -2.481  -5.234   4.324
   82   HD23  LEU  11          2HD2      LEU  11  -1.725  -6.811   4.555
   83    H    GLY  12           HN       GLY  12  -4.904  -6.205  -1.032
   84    HA2  GLY  12           2HA      GLY  12  -6.301  -5.094  -2.485
   85    HA3  GLY  12           1HA      GLY  12  -6.785  -4.056  -1.150
   86    H    GLU  13           HN       GLU  13  -6.702  -2.281  -2.642
   87    HA   GLU  13           HA       GLU  13  -4.092  -1.500  -3.606
   88    HB2  GLU  13           2HB      GLU  13  -5.253   0.512  -4.461
   89    HB3  GLU  13           1HB      GLU  13  -5.981  -0.983  -5.019
   90    HG2  GLU  13           2HG      GLU  13  -7.759  -0.743  -3.363
   91    HG3  GLU  13           1HG      GLU  13  -7.026   0.756  -2.797
   92    H    LEU  14           HN       LEU  14  -2.667  -0.635  -2.310
   93    HA   LEU  14           HA       LEU  14  -3.575   0.730   0.108
   94    HB2  LEU  14           2HB      LEU  14  -0.835  -0.216  -0.734
   95    HB3  LEU  14           1HB      LEU  14  -1.177   0.620   0.768
   96    HG   LEU  14           HG       LEU  14  -2.255  -2.083  -0.034
   97   HD11  LEU  14          1HD1      LEU  14   0.099  -2.159   0.526
   98   HD12  LEU  14          2HD1      LEU  14  -0.854  -2.891   1.817
   99   HD13  LEU  14          3HD1      LEU  14  -0.203  -1.264   2.015
  100   HD21  LEU  14          3HD2      LEU  14  -3.136  -2.158   2.259
  101   HD22  LEU  14          1HD2      LEU  14  -3.865  -0.860   1.313
  102   HD23  LEU  14          2HD2      LEU  14  -2.616  -0.488   2.503
  103    H    GLU  15           HN       GLU  15  -3.014   2.801   0.611
  104    HA   GLU  15           HA       GLU  15  -2.833   4.564  -1.614
  105    HB2  GLU  15           2HB      GLU  15  -2.708   5.158   1.351
  106    HB3  GLU  15           1HB      GLU  15  -2.979   6.343   0.078
  107    HG2  GLU  15           2HG      GLU  15  -5.081   5.332  -0.490
  108    HG3  GLU  15           1HG      GLU  15  -4.795   4.003   0.629
  109    H    LEU  16           HN       LEU  16  -1.113   5.491  -2.479
  110    HA   LEU  16           HA       LEU  16   1.508   4.780  -1.509
  111    HB2  LEU  16           2HB      LEU  16   0.662   4.900  -3.957
  112    HB3  LEU  16           1HB      LEU  16   0.897   6.626  -3.807
  113    HG   LEU  16           HG       LEU  16   2.761   5.505  -4.960
  114   HD11  LEU  16          1HD1      LEU  16   3.189   7.582  -3.763
  115   HD12  LEU  16          2HD1      LEU  16   4.589   6.510  -3.707
  116   HD13  LEU  16          3HD1      LEU  16   3.543   6.671  -2.295
  117   HD21  LEU  16          3HD2      LEU  16   2.685   3.364  -3.837
  118   HD22  LEU  16          1HD2      LEU  16   3.189   4.117  -2.323
  119   HD23  LEU  16          2HD2      LEU  16   4.293   4.078  -3.698
  120    H    THR  17           HN       THR  17   2.428   5.919   0.060
  121    HA   THR  17           HA       THR  17   1.809   8.774   0.312
  122    HB   THR  17           HB       THR  17   3.219   6.976   2.303
  123    HG1  THR  17           1HG      THR  17   0.842   6.633   1.680
  124   HG21  THR  17          3HG2      THR  17   2.639   8.760   3.905
  125   HG22  THR  17          1HG2      THR  17   1.987   9.721   2.577
  126   HG23  THR  17          2HG2      THR  17   3.709   9.339   2.627
  127    H    VAL  18           HN       VAL  18   3.305  10.283  -0.124
  128    HA   VAL  18           HA       VAL  18   5.954   9.342  -0.970
  129    HB   VAL  18           HB       VAL  18   4.548  11.920  -1.684
  130   HG11  VAL  18          1HG1      VAL  18   6.954  12.152  -1.752
  131   HG12  VAL  18          2HG1      VAL  18   6.304  12.131  -3.391
  132   HG13  VAL  18          3HG1      VAL  18   7.092  10.696  -2.736
  133   HG21  VAL  18          3HG2      VAL  18   4.922   9.404  -3.303
  134   HG22  VAL  18          1HG2      VAL  18   4.244  10.918  -3.904
  135   HG23  VAL  18          2HG2      VAL  18   3.401  10.008  -2.651
  136    H    LEU  19           HN       LEU  19   7.630   9.805   0.274
  137    HA   LEU  19           HA       LEU  19   7.378  11.942   2.254
  138    HB2  LEU  19           2HB      LEU  19   9.500   9.817   1.903
  139    HB3  LEU  19           1HB      LEU  19   9.481  11.015   3.181
  140    HG   LEU  19           HG       LEU  19   7.432   8.833   2.775
  141   HD11  LEU  19          1HD1      LEU  19   8.338   7.967   4.897
  142   HD12  LEU  19          2HD1      LEU  19   9.595   9.203   4.840
  143   HD13  LEU  19          3HD1      LEU  19   9.526   7.956   3.594
  144   HD21  LEU  19          3HD2      LEU  19   6.515   9.582   4.920
  145   HD22  LEU  19          1HD2      LEU  19   6.412  10.848   3.697
  146   HD23  LEU  19          2HD2      LEU  19   7.661  10.922   4.941
  147    H    TYR  20           HN       TYR  20   8.102  13.862   1.763
  148    HA   TYR  20           HA       TYR  20  10.561  14.222   0.280
  149    HB2  TYR  20           2HB      TYR  20   9.611  15.607  -1.451
  150    HB3  TYR  20           1HB      TYR  20   8.733  14.082  -1.456
  151    HD1  TYR  20           2HD      TYR  20   6.516  14.072  -0.006
  152    HD2  TYR  20           1HD      TYR  20   8.407  17.583  -1.499
  153    HE1  TYR  20           2HE      TYR  20   4.394  15.300   0.204
  154    HE2  TYR  20           1HE      TYR  20   6.291  18.818  -1.291
  155    HH   TYR  20           HH       TYR  20   3.712  17.754   0.498
  156    H    ASP  21           HN       ASP  21  11.040  16.658   0.170
  157    HA   ASP  21           HA       ASP  21  10.061  17.887   2.654
  158    HB2  ASP  21           2HB      ASP  21  12.559  17.469   2.361
  159    HB3  ASP  21           1HB      ASP  21  12.523  18.721   1.119
  160    H    GLU  22           HN       GLU  22   8.836  19.639   2.519
  161    HA   GLU  22           HA       GLU  22   8.030  20.540  -0.099
  162    HB2  GLU  22           2HB      GLU  22   6.382  21.924   1.260
  163    HB3  GLU  22           1HB      GLU  22   6.245  20.178   1.399
  164    HG2  GLU  22           2HG      GLU  22   7.441  20.244   3.520
  165    HG3  GLU  22           1HG      GLU  22   7.603  21.993   3.375
  166    H    GLU  23           HN       GLU  23  10.673  21.204   0.464
  167    HA   GLU  23           HA       GLU  23  10.916  23.893   1.356
  168    HB2  GLU  23           2HB      GLU  23  13.214  23.731   0.507
  169    HB3  GLU  23           1HB      GLU  23  12.786  22.351   1.503
  170    HG2  GLU  23           2HG      GLU  23  12.512  20.962  -0.426
  171    HG3  GLU  23           1HG      GLU  23  12.730  22.340  -1.504
  172    H    ARG  24           HN       ARG  24  10.501  22.391  -1.812
  173    HA   ARG  24           HA       ARG  24  10.028  24.986  -3.017
  174    HB2  ARG  24           2HB      ARG  24  12.558  24.486  -2.902
  175    HB3  ARG  24           1HB      ARG  24  12.244  23.318  -4.167
  176    HG2  ARG  24           2HG      ARG  24  12.835  25.102  -5.434
  177    HG3  ARG  24           1HG      ARG  24  11.098  25.383  -5.328
  178    HD2  ARG  24           2HD      ARG  24  13.189  26.643  -3.558
  179    HD3  ARG  24           1HD      ARG  24  12.418  27.424  -4.935
  180    HE   ARG  24           HE       ARG  24  10.911  26.550  -2.550
  181   HH11  ARG  24          1HH1      ARG  24  11.656  28.898  -5.033
  182   HH12  ARG  24          2HH1      ARG  24  10.508  30.072  -4.463
  183   HH21  ARG  24          1HH2      ARG  24   9.406  28.096  -1.768
  184   HH22  ARG  24          2HH2      ARG  24   9.237  29.622  -2.596
  185    H    TYR  25           HN       TYR  25   9.160  21.873  -2.781
  186    HA   TYR  25           HA       TYR  25   8.484  21.623  -5.628
  187    HB2  TYR  25           2HB      TYR  25   9.291  19.310  -3.862
  188    HB3  TYR  25           1HB      TYR  25   8.997  19.277  -5.595
  189    HD1  TYR  25           2HD      TYR  25  10.609  20.495  -7.122
  190    HD2  TYR  25           1HD      TYR  25  11.410  19.835  -2.996
  191    HE1  TYR  25           2HE      TYR  25  12.999  20.935  -7.518
  192    HE2  TYR  25           1HE      TYR  25  13.796  20.274  -3.378
  193    HH   TYR  25           HH       TYR  25  14.975  21.704  -6.195
  194    H    ASP  26           HN       ASP  26   6.467  21.030  -6.102
  195    HA   ASP  26           HA       ASP  26   4.720  20.042  -3.942
  196    HB2  ASP  26           2HB      ASP  26   4.138  21.626  -6.430
  197    HB3  ASP  26           1HB      ASP  26   2.887  20.618  -5.726
  198    H    ILE  27           HN       ILE  27   3.119  18.391  -4.636
  199    HA   ILE  27           HA       ILE  27   4.381  16.423  -6.374
  200    HB   ILE  27           HB       ILE  27   1.853  16.194  -4.721
  201   HG12  ILE  27          2HG1      ILE  27   4.653  15.177  -4.177
  202   HG13  ILE  27          1HG1      ILE  27   3.881  16.525  -3.350
  203   HG21  ILE  27          1HG2      ILE  27   3.474  14.080  -6.145
  204   HG22  ILE  27          2HG2      ILE  27   1.867  14.647  -6.603
  205   HG23  ILE  27          3HG2      ILE  27   2.094  13.776  -5.086
  206   HD11  ILE  27          3HD1      ILE  27   3.831  14.513  -1.999
  207   HD12  ILE  27          1HD1      ILE  27   2.968  13.657  -3.280
  208   HD13  ILE  27          2HD1      ILE  27   2.200  15.011  -2.449
  209    H    VAL  28           HN       VAL  28   4.012  16.616  -8.478
  210    HA   VAL  28           HA       VAL  28   1.594  17.865  -9.471
  211    HB   VAL  28           HB       VAL  28   3.909  16.657 -10.990
  212   HG11  VAL  28          1HG1      VAL  28   3.080  17.933 -12.895
  213   HG12  VAL  28          2HG1      VAL  28   1.706  18.484 -11.936
  214   HG13  VAL  28          3HG1      VAL  28   1.873  16.774 -12.333
  215   HG21  VAL  28          3HG2      VAL  28   3.318  19.521 -10.255
  216   HG22  VAL  28          1HG2      VAL  28   4.633  18.980 -11.301
  217   HG23  VAL  28          2HG2      VAL  28   4.612  18.517  -9.599
  218    H    GLU  29           HN       GLU  29   3.158  14.683  -9.728
  219    HA   GLU  29           HA       GLU  29   0.511  13.478  -9.878
  220    HB2  GLU  29           2HB      GLU  29   1.007  12.052 -11.738
  221    HB3  GLU  29           1HB      GLU  29   1.352  13.698 -12.247
  222    HG2  GLU  29           2HG      GLU  29   3.602  13.351 -12.341
  223    HG3  GLU  29           1HG      GLU  29   3.571  12.075 -11.125
  224    H    GLN  30           HN       GLN  30   0.617  11.131  -9.458
  225    HA   GLN  30           HA       GLN  30   3.084   9.980  -8.582
  226    HB2  GLN  30           2HB      GLN  30   2.634   9.677  -6.285
  227    HB3  GLN  30           1HB      GLN  30   2.269  11.370  -6.581
  228    HG2  GLN  30           2HG      GLN  30  -0.078  10.942  -6.565
  229    HG3  GLN  30           1HG      GLN  30   0.187   9.200  -6.542
  230   HE21  GLN  30          1HE2      GLN  30  -0.868   8.791  -4.671
  231   HE22  GLN  30          2HE2      GLN  30  -0.317   9.329  -3.124
  232    H    THR  31           HN       THR  31   2.609   7.718  -7.694
  233    HA   THR  31           HA       THR  31   0.675   6.421  -9.354
  234    HB   THR  31           HB       THR  31   2.200   5.238  -7.022
  235    HG1  THR  31           1HG      THR  31   3.195   6.330  -9.202
  236   HG21  THR  31          3HG2      THR  31   1.039   3.993  -9.523
  237   HG22  THR  31          1HG2      THR  31   0.393   3.827  -7.889
  238   HG23  THR  31          2HG2      THR  31   1.969   3.143  -8.289
  239    H    GLU  32           HN       GLU  32  -1.394   5.972  -8.862
  240    HA   GLU  32           HA       GLU  32  -2.651   7.253  -6.710
  241    HB2  GLU  32           2HB      GLU  32  -3.683   5.005  -8.450
  242    HB3  GLU  32           1HB      GLU  32  -4.670   6.062  -7.447
  243    HG2  GLU  32           2HG      GLU  32  -4.206   7.939  -8.799
  244    HG3  GLU  32           1HG      GLU  32  -2.911   7.096  -9.652
  245    H    THR  33           HN       THR  33  -2.924   3.776  -7.277
  246    HA   THR  33           HA       THR  33  -2.155   3.220  -4.524
  247    HB   THR  33           HB       THR  33  -4.172   1.626  -4.391
  248    HG1  THR  33           1HG      THR  33  -6.010   2.601  -5.632
  249   HG21  THR  33          3HG2      THR  33  -5.637   3.360  -3.495
  250   HG22  THR  33          1HG2      THR  33  -4.683   4.602  -4.308
  251   HG23  THR  33          2HG2      THR  33  -3.965   3.645  -3.012
  252    H    VAL  34           HN       VAL  34  -1.354   1.136  -4.223
  253    HA   VAL  34           HA       VAL  34  -1.198  -0.542  -6.644
  254    HB   VAL  34           HB       VAL  34   1.019  -1.371  -5.744
  255   HG11  VAL  34          1HG1      VAL  34   0.920   0.134  -7.646
  256   HG12  VAL  34          2HG1      VAL  34   2.295   0.543  -6.622
  257   HG13  VAL  34          3HG1      VAL  34   0.834   1.527  -6.569
  258   HG21  VAL  34          3HG2      VAL  34   0.824  -0.578  -3.458
  259   HG22  VAL  34          1HG2      VAL  34   0.774   1.093  -4.020
  260   HG23  VAL  34          2HG2      VAL  34   2.241   0.138  -4.229
  261    H    GLN  35           HN       GLN  35  -1.222  -2.797  -6.325
  262    HA   GLN  35           HA       GLN  35  -2.629  -3.514  -3.861
  263    HB2  GLN  35           2HB      GLN  35  -2.480  -4.940  -6.520
  264    HB3  GLN  35           1HB      GLN  35  -3.336  -5.547  -5.108
  265    HG2  GLN  35           2HG      GLN  35  -4.776  -3.574  -5.138
  266    HG3  GLN  35           1HG      GLN  35  -3.917  -2.981  -6.555
  267   HE21  GLN  35          1HE2      GLN  35  -4.727  -6.347  -5.993
  268   HE22  GLN  35          2HE2      GLN  35  -5.883  -6.481  -7.276
  269    H    VAL  36           HN       VAL  36  -1.941  -4.971  -2.480
  270    HA   VAL  36           HA       VAL  36   0.588  -6.374  -3.063
  271    HB   VAL  36           HB       VAL  36  -0.249  -5.286  -0.362
  272   HG11  VAL  36          1HG1      VAL  36   1.094  -7.307  -0.205
  273   HG12  VAL  36          2HG1      VAL  36   2.028  -5.905   0.319
  274   HG13  VAL  36          3HG1      VAL  36   2.305  -6.605  -1.276
  275   HG21  VAL  36          3HG2      VAL  36   1.594  -3.687  -0.639
  276   HG22  VAL  36          1HG2      VAL  36   0.345  -3.467  -1.867
  277   HG23  VAL  36          2HG2      VAL  36   1.856  -4.280  -2.279
  278    H    ASP  37           HN       ASP  37   0.408  -8.465  -3.011
  279    HA   ASP  37           HA       ASP  37  -1.706  -9.712  -1.369
  280    HB2  ASP  37           2HB      ASP  37  -0.483 -10.652  -3.980
  281    HB3  ASP  37           1HB      ASP  37  -1.540 -11.639  -2.977
  282    H    LEU  38           HN       LEU  38  -1.072 -11.182   0.108
  283    HA   LEU  38           HA       LEU  38   1.811 -11.799   0.199
  284    HB2  LEU  38           2HB      LEU  38  -0.157 -11.546   2.480
  285    HB3  LEU  38           1HB      LEU  38   1.538 -11.968   2.645
  286    HG   LEU  38           HG       LEU  38   0.512  -9.338   1.572
  287   HD11  LEU  38          1HD1      LEU  38   0.006  -9.597   3.938
  288   HD12  LEU  38          2HD1      LEU  38   1.279  -8.401   3.691
  289   HD13  LEU  38          3HD1      LEU  38   1.688 -10.020   4.261
  290   HD21  LEU  38          3HD2      LEU  38   2.672  -9.899   0.640
  291   HD22  LEU  38          1HD2      LEU  38   3.295 -10.285   2.245
  292   HD23  LEU  38          2HD2      LEU  38   2.863  -8.623   1.844
  293    H    GLU  39           HN       GLU  39   2.456 -13.870   0.434
  294    HA   GLU  39           HA       GLU  39   0.350 -15.907   0.732
  295    HB2  GLU  39           2HB      GLU  39   2.786 -15.843  -0.986
  296    HB3  GLU  39           1HB      GLU  39   2.245 -17.392  -0.354
  297    HG2  GLU  39           2HG      GLU  39   0.030 -16.971  -1.343
  298    HG3  GLU  39           1HG      GLU  39   0.664 -15.490  -2.050
  299    H    GLY  40           HN       GLY  40   0.681 -17.602   2.057
  300    HA2  GLY  40           2HA      GLY  40   2.910 -18.578   3.251
  301    HA3  GLY  40           1HA      GLY  40   2.526 -17.170   4.235
  302    HA   PRO  41           HA       PRO  41   0.206 -21.087   5.663
  303    HB2  PRO  41           2HB      PRO  41   1.321 -20.061   8.228
  304    HB3  PRO  41           1HB      PRO  41   1.176 -21.725   7.649
  305    HG2  PRO  41           2HG      PRO  41   3.538 -20.488   7.673
  306    HG3  PRO  41           1HG      PRO  41   3.090 -21.577   6.350
  307    HD2  PRO  41           2HD      PRO  41   3.157 -18.594   6.408
  308    HD3  PRO  41           1HD      PRO  41   3.569 -19.707   5.088
  309    H    ARG  42           HN       ARG  42  -1.886 -20.723   5.960
  310    HA   ARG  42           HA       ARG  42  -2.978 -18.193   6.324
  311    HB2  ARG  42           2HB      ARG  42  -4.187 -20.925   6.651
  312    HB3  ARG  42           1HB      ARG  42  -5.128 -19.451   6.856
  313    HG2  ARG  42           2HG      ARG  42  -4.440 -18.775   4.559
  314    HG3  ARG  42           1HG      ARG  42  -3.691 -20.359   4.376
  315    HD2  ARG  42           2HD      ARG  42  -6.590 -19.969   5.071
  316    HD3  ARG  42           1HD      ARG  42  -6.004 -20.117   3.415
  317    HE   ARG  42           HE       ARG  42  -5.011 -22.308   4.783
  318   HH11  ARG  42          1HH1      ARG  42  -8.172 -20.992   4.040
  319   HH12  ARG  42          2HH1      ARG  42  -8.942 -22.540   3.963
  320   HH21  ARG  42          1HH2      ARG  42  -6.013 -24.346   4.658
  321   HH22  ARG  42          2HH2      ARG  42  -7.723 -24.453   4.312
  322    H    GLY  43           HN       GLY  43  -2.070 -20.575   8.715
  323    HA2  GLY  43           2HA      GLY  43  -3.395 -19.593  10.960
  324    HA3  GLY  43           1HA      GLY  43  -1.821 -20.374  10.990
  325    H    VAL  44           HN       VAL  44  -0.387 -18.490   9.482
  326    HA   VAL  44           HA       VAL  44   0.213 -16.521  11.448
  327    HB   VAL  44           HB       VAL  44   1.093 -16.650   8.553
  328   HG11  VAL  44          1HG1      VAL  44   2.971 -15.252   9.273
  329   HG12  VAL  44          2HG1      VAL  44   2.271 -15.148  10.888
  330   HG13  VAL  44          3HG1      VAL  44   1.424 -14.443   9.510
  331   HG21  VAL  44          3HG2      VAL  44   3.152 -17.673   9.443
  332   HG22  VAL  44          1HG2      VAL  44   1.727 -18.675   9.714
  333   HG23  VAL  44          2HG2      VAL  44   2.410 -17.736  11.041
  334    H    LEU  45           HN       LEU  45  -1.423 -16.504   8.332
  335    HA   LEU  45           HA       LEU  45  -1.819 -13.749   8.066
  336    HB2  LEU  45           2HB      LEU  45  -3.575 -15.987   7.055
  337    HB3  LEU  45           1HB      LEU  45  -3.589 -14.334   6.473
  338    HG   LEU  45           HG       LEU  45  -1.282 -16.268   6.217
  339   HD11  LEU  45          1HD1      LEU  45  -3.148 -16.861   4.785
  340   HD12  LEU  45          2HD1      LEU  45  -1.809 -16.221   3.833
  341   HD13  LEU  45          3HD1      LEU  45  -3.217 -15.211   4.164
  342   HD21  LEU  45          3HD2      LEU  45  -0.526 -13.962   6.436
  343   HD22  LEU  45          1HD2      LEU  45  -1.622 -13.472   5.142
  344   HD23  LEU  45          2HD2      LEU  45  -0.280 -14.562   4.798
  345    H    THR  46           HN       THR  46  -3.641 -16.187   9.821
  346    HA   THR  46           HA       THR  46  -5.962 -14.653  10.318
  347    HB   THR  46           HB       THR  46  -4.794 -16.811  12.088
  348    HG1  THR  46           1HG      THR  46  -5.419 -17.082   9.596
  349   HG21  THR  46          3HG2      THR  46  -7.632 -15.850  11.687
  350   HG22  THR  46          1HG2      THR  46  -6.633 -15.570  13.111
  351   HG23  THR  46          2HG2      THR  46  -7.143 -17.208  12.703
  352    H    VAL  47           HN       VAL  47  -2.942 -15.073  12.135
  353    HA   VAL  47           HA       VAL  47  -3.659 -13.536  14.383
  354    HB   VAL  47           HB       VAL  47  -0.891 -13.931  13.231
  355   HG11  VAL  47          1HG1      VAL  47  -1.786 -13.180  16.010
  356   HG12  VAL  47          2HG1      VAL  47  -0.928 -12.146  14.866
  357   HG13  VAL  47          3HG1      VAL  47  -0.131 -13.567  15.545
  358   HG21  VAL  47          3HG2      VAL  47  -1.974 -16.066  13.604
  359   HG22  VAL  47          1HG2      VAL  47  -2.413 -15.583  15.242
  360   HG23  VAL  47          2HG2      VAL  47  -0.718 -15.804  14.812
  361    H    PHE  48           HN       PHE  48  -2.168 -12.680  11.308
  362    HA   PHE  48           HA       PHE  48  -1.673  -9.954  11.938
  363    HB2  PHE  48           2HB      PHE  48  -0.568 -11.248  10.096
  364    HB3  PHE  48           1HB      PHE  48  -2.088 -11.202   9.211
  365    HD1  PHE  48           2HD      PHE  48   0.575  -9.073  10.646
  366    HD2  PHE  48           1HD      PHE  48  -2.643  -9.367   7.875
  367    HE1  PHE  48           2HE      PHE  48   1.231  -6.917   9.660
  368    HE2  PHE  48           1HE      PHE  48  -1.991  -7.215   6.883
  369    HZ   PHE  48           HZ       PHE  48  -0.050  -5.988   7.776
  370    H    ARG  49           HN       ARG  49  -4.426 -11.714  10.708
  371    HA   ARG  49           HA       ARG  49  -5.906  -9.508   9.744
  372    HB2  ARG  49           2HB      ARG  49  -6.317 -12.382  10.252
  373    HB3  ARG  49           1HB      ARG  49  -7.765 -11.404  10.266
  374    HG2  ARG  49           2HG      ARG  49  -5.802 -11.254   8.014
  375    HG3  ARG  49           1HG      ARG  49  -7.061 -12.489   8.065
  376    HD2  ARG  49           2HD      ARG  49  -7.596  -9.529   8.258
  377    HD3  ARG  49           1HD      ARG  49  -7.644 -10.440   6.749
  378    HE   ARG  49           HE       ARG  49  -9.326 -11.439   8.904
  379   HH11  ARG  49          1HH1      ARG  49  -9.143  -9.426   6.025
  380   HH12  ARG  49          2HH1      ARG  49 -10.842  -9.571   5.678
  381   HH21  ARG  49          1HH2      ARG  49 -11.552 -11.603   8.439
  382   HH22  ARG  49          2HH2      ARG  49 -12.208 -10.807   7.039
  383    H    PHE  50           HN       PHE  50  -5.271 -10.624  12.909
  384    HA   PHE  50           HA       PHE  50  -7.647  -9.603  14.140
  385    HB2  PHE  50           2HB      PHE  50  -5.001 -10.598  15.138
  386    HB3  PHE  50           1HB      PHE  50  -6.111  -9.782  16.221
  387    HD1  PHE  50           1HD      PHE  50  -8.588 -10.727  16.138
  388    HD2  PHE  50           2HD      PHE  50  -5.100 -12.871  14.989
  389    HE1  PHE  50           1HE      PHE  50  -9.772 -12.848  16.520
  390    HE2  PHE  50           2HE      PHE  50  -6.278 -14.998  15.361
  391    HZ   PHE  50           HZ       PHE  50  -8.619 -14.990  16.126
  392    H    ALA  51           HN       ALA  51  -4.682  -8.257  13.070
  393    HA   ALA  51           HA       ALA  51  -4.839  -6.006  14.922
  394    HB1  ALA  51           1HB      ALA  51  -2.675  -7.107  14.672
  395    HB2  ALA  51           2HB      ALA  51  -2.603  -5.433  14.121
  396    HB3  ALA  51           3HB      ALA  51  -2.683  -6.746  12.947
  397    H    ARG  52           HN       ARG  52  -5.521  -4.046  14.355
  398    HA   ARG  52           HA       ARG  52  -6.458  -3.393  11.777
  399    HB2  ARG  52           2HB      ARG  52  -5.965  -1.929  14.318
  400    HB3  ARG  52           1HB      ARG  52  -6.126  -0.982  12.854
  401    HG2  ARG  52           2HG      ARG  52  -8.316  -2.133  12.457
  402    HG3  ARG  52           1HG      ARG  52  -8.142  -2.852  14.057
  403    HD2  ARG  52           2HD      ARG  52  -8.100  -0.654  15.080
  404    HD3  ARG  52           1HD      ARG  52  -8.167   0.111  13.491
  405    HE   ARG  52           HE       ARG  52 -10.369  -1.675  13.998
  406   HH11  ARG  52          1HH1      ARG  52  -9.175   1.594  14.451
  407   HH12  ARG  52          2HH1      ARG  52 -10.765   2.286  14.608
  408   HH21  ARG  52          1HH2      ARG  52 -12.455  -0.760  14.216
  409   HH22  ARG  52          2HH2      ARG  52 -12.621   0.954  14.463
  410    HA   PRO  53           HA       PRO  53  -2.964  -2.361   9.413
  411    HB2  PRO  53           2HB      PRO  53  -3.563   0.271   8.657
  412    HB3  PRO  53           1HB      PRO  53  -3.993  -1.203   7.792
  413    HG2  PRO  53           2HG      PRO  53  -5.634   0.462   9.627
  414    HG3  PRO  53           1HG      PRO  53  -6.133  -0.475   8.209
  415    HD2  PRO  53           2HD      PRO  53  -6.629  -1.311  10.716
  416    HD3  PRO  53           1HD      PRO  53  -6.250  -2.450   9.408
  417    H    SER  54           HN       SER  54  -1.074  -2.046  10.228
  418    HA   SER  54           HA       SER  54  -0.430   0.562  11.421
  419    HB2  SER  54           2HB      SER  54  -0.398  -1.215  13.143
  420    HB3  SER  54           1HB      SER  54   0.763  -2.108  12.175
  421    HG   SER  54           HG       SER  54   2.070  -0.087  12.341
  422    H    TYR  55           HN       TYR  55  -0.321  -1.079   8.809
  423    HA   TYR  55           HA       TYR  55   2.502  -0.721   8.160
  424    HB2  TYR  55           2HB      TYR  55   1.769  -1.960   6.011
  425    HB3  TYR  55           1HB      TYR  55   1.892  -2.879   7.504
  426    HD1  TYR  55           2HD      TYR  55  -0.434  -1.448   5.038
  427    HD2  TYR  55           1HD      TYR  55  -0.058  -3.815   8.548
  428    HE1  TYR  55           2HE      TYR  55  -2.747  -2.241   4.745
  429    HE2  TYR  55           1HE      TYR  55  -2.362  -4.616   8.268
  430    HH   TYR  55           HH       TYR  55  -4.409  -4.024   7.197
  431    H    GLU  56           HN       GLU  56   3.172   0.588   6.526
  432    HA   GLU  56           HA       GLU  56   1.167   2.187   5.118
  433    HB2  GLU  56           2HB      GLU  56   3.399   3.252   6.845
  434    HB3  GLU  56           1HB      GLU  56   2.674   4.216   5.566
  435    HG2  GLU  56           2HG      GLU  56   0.569   4.225   6.633
  436    HG3  GLU  56           1HG      GLU  56   1.060   2.972   7.771
  437    H    VAL  57           HN       VAL  57   1.964   3.189   3.207
  438    HA   VAL  57           HA       VAL  57   4.259   1.745   2.061
  439    HB   VAL  57           HB       VAL  57   1.904   3.041   0.662
  440   HG11  VAL  57          1HG1      VAL  57   3.910   3.090  -0.706
  441   HG12  VAL  57          2HG1      VAL  57   2.746   1.934  -1.349
  442   HG13  VAL  57          3HG1      VAL  57   4.148   1.362  -0.445
  443   HG21  VAL  57          3HG2      VAL  57   2.543   0.129   1.120
  444   HG22  VAL  57          1HG2      VAL  57   1.206   0.747   0.149
  445   HG23  VAL  57          2HG2      VAL  57   1.245   1.043   1.888
  446    H    PHE  58           HN       PHE  58   6.033   2.918   1.523
  447    HA   PHE  58           HA       PHE  58   5.722   5.842   1.368
  448    HB2  PHE  58           2HB      PHE  58   7.940   4.355   2.779
  449    HB3  PHE  58           1HB      PHE  58   7.854   6.098   2.571
  450    HD1  PHE  58           2HD      PHE  58   5.742   7.251   3.549
  451    HD2  PHE  58           1HD      PHE  58   7.119   3.389   4.688
  452    HE1  PHE  58           2HE      PHE  58   4.512   7.444   5.668
  453    HE2  PHE  58           1HE      PHE  58   5.892   3.574   6.810
  454    HZ   PHE  58           HZ       PHE  58   4.589   5.602   7.301
  455    H    VAL  59           HN       VAL  59   7.024   6.936  -0.019
  456    HA   VAL  59           HA       VAL  59   9.297   5.533  -1.237
  457    HB   VAL  59           HB       VAL  59   8.954   6.862  -3.324
  458   HG11  VAL  59          1HG1      VAL  59   8.275   4.528  -3.235
  459   HG12  VAL  59          2HG1      VAL  59   7.159   5.458  -4.235
  460   HG13  VAL  59          3HG1      VAL  59   6.699   4.994  -2.595
  461   HG21  VAL  59          3HG2      VAL  59   6.254   7.470  -2.120
  462   HG22  VAL  59          1HG2      VAL  59   6.753   7.837  -3.772
  463   HG23  VAL  59          2HG2      VAL  59   7.546   8.635  -2.413
  464    H    ASP  60           HN       ASP  60  11.173   6.671  -1.125
  465    HA   ASP  60           HA       ASP  60  10.990   9.398  -0.024
  466    HB2  ASP  60           2HB      ASP  60  12.091   7.678   1.450
  467    HB3  ASP  60           1HB      ASP  60  13.334   7.499   0.217
  468    H    LEU  61           HN       LEU  61  11.483  10.916  -1.410
  469    HA   LEU  61           HA       LEU  61  13.621  10.420  -3.346
  470    HB2  LEU  61           2HB      LEU  61  10.861  11.470  -3.931
  471    HB3  LEU  61           1HB      LEU  61  12.218  11.753  -5.010
  472    HG   LEU  61           HG       LEU  61  11.267   9.008  -4.185
  473   HD11  LEU  61          1HD1      LEU  61   9.548  10.135  -5.483
  474   HD12  LEU  61          2HD1      LEU  61  10.311   8.847  -6.418
  475   HD13  LEU  61          3HD1      LEU  61  10.737  10.533  -6.725
  476   HD21  LEU  61          3HD2      LEU  61  13.190   9.938  -6.310
  477   HD22  LEU  61          1HD2      LEU  61  12.663   8.273  -6.066
  478   HD23  LEU  61          2HD2      LEU  61  13.607   9.090  -4.822
  479    H    THR  62           HN       THR  62  13.674  11.756  -0.859
  480    HA   THR  62           HA       THR  62  13.612  14.579  -1.219
  481    HB   THR  62           HB       THR  62  15.093  14.583   0.846
  482    HG1  THR  62           1HG      THR  62  14.552  11.767   0.771
  483   HG21  THR  62          3HG2      THR  62  13.294  13.818   2.328
  484   HG22  THR  62          1HG2      THR  62  12.509  13.023   0.964
  485   HG23  THR  62          2HG2      THR  62  12.664  14.780   0.991
  486    H    GLU  63           HN       GLU  63  15.648  12.197  -2.384
  487    HA   GLU  63           HA       GLU  63  17.929  14.009  -2.703
  488    HB2  GLU  63           2HB      GLU  63  17.724  11.038  -3.194
  489    HB3  GLU  63           1HB      GLU  63  19.179  11.994  -3.323
  490    HG2  GLU  63           2HG      GLU  63  19.086  12.480  -0.980
  491    HG3  GLU  63           1HG      GLU  63  17.588  11.584  -0.837
  492    H    ALA  64           HN       ALA  64  15.187  13.481  -4.247
  493    HA   ALA  64           HA       ALA  64  16.336  13.249  -6.939
  494    HB1  ALA  64           1HB      ALA  64  14.538  11.667  -6.367
  495    HB2  ALA  64           2HB      ALA  64  14.090  12.728  -7.702
  496    HB3  ALA  64           3HB      ALA  64  13.450  13.026  -6.085
  497    H    GLY  65           HN       GLY  65  15.600  14.692  -8.600
  498    HA2  GLY  65           2HA      GLY  65  14.971  17.357  -7.539
  499    HA3  GLY  65           1HA      GLY  65  15.740  17.024  -9.085
  500    H    GLU  66           HN       GLU  66  14.428  17.800 -10.595
  501    HA   GLU  66           HA       GLU  66  11.580  17.907 -10.178
  502    HB2  GLU  66           2HB      GLU  66  11.527  19.124 -12.284
  503    HB3  GLU  66           1HB      GLU  66  12.748  19.787 -11.213
  504    HG2  GLU  66           2HG      GLU  66  13.493  17.774 -13.295
  505    HG3  GLU  66           1HG      GLU  66  13.277  19.467 -13.724
  506    H    GLY  67           HN       GLY  67  10.045  17.172 -11.784
  507    HA2  GLY  67           2HA      GLY  67   9.296  15.816 -13.528
  508    HA3  GLY  67           1HA      GLY  67  10.924  15.178 -13.701
  509    H    SER  68           HN       SER  68   8.746  13.523 -13.809
  510    HA   SER  68           HA       SER  68   8.201  12.316 -11.291
  511    HB2  SER  68           2HB      SER  68   6.703  12.084 -13.232
  512    HB3  SER  68           1HB      SER  68   7.929  11.130 -14.062
  513    HG   SER  68           HG       SER  68   6.185   9.998 -12.841
  514    H    HIS  69           HN       HIS  69   9.081  10.588 -10.337
  515    HA   HIS  69           HA       HIS  69  11.498   9.431 -11.544
  516    HB2  HIS  69           2HB      HIS  69  11.183  10.614  -8.797
  517    HB3  HIS  69           1HB      HIS  69  12.359   9.339  -9.089
  518    HD1  HIS  69           1HD      HIS  69  11.663  12.947  -9.858
  519    HD2  HIS  69           2HD      HIS  69  14.603  10.091 -10.561
  520    HE1  HIS  69           1HE      HIS  69  13.662  14.221 -10.693
  521    HE2  HIS  69           2HE      HIS  69  15.347  12.452 -11.311
  522    H    THR  70           HN       THR  70  11.767   7.275 -11.245
  523    HA   THR  70           HA       THR  70   9.596   5.907  -9.800
  524    HB   THR  70           HB       THR  70  11.193   4.822 -12.130
  525    HG1  THR  70           1HG      THR  70   8.672   6.137 -12.002
  526   HG21  THR  70          3HG2      THR  70   8.641   3.865 -10.826
  527   HG22  THR  70          1HG2      THR  70  10.229   3.112 -10.659
  528   HG23  THR  70          2HG2      THR  70   9.425   3.134 -12.228
  529    H    VAL  71           HN       VAL  71  10.230   4.971  -8.002
  530    HA   VAL  71           HA       VAL  71  12.826   3.586  -7.940
  531    HB   VAL  71           HB       VAL  71  13.063   4.203  -5.533
  532   HG11  VAL  71          1HG1      VAL  71  14.366   5.382  -7.192
  533   HG12  VAL  71          2HG1      VAL  71  13.858   6.503  -5.927
  534   HG13  VAL  71          3HG1      VAL  71  13.032   6.498  -7.486
  535   HG21  VAL  71          3HG2      VAL  71  10.739   4.768  -5.067
  536   HG22  VAL  71          1HG2      VAL  71  10.856   6.164  -6.139
  537   HG23  VAL  71          2HG2      VAL  71  11.807   6.111  -4.655
  538    H    ASP  72           HN       ASP  72  12.867   1.945  -6.097
  539    HA   ASP  72           HA       ASP  72  10.442   0.415  -6.222
  540    HB2  ASP  72           2HB      ASP  72  11.604  -1.301  -5.023
  541    HB3  ASP  72           1HB      ASP  72  12.738  -0.625  -6.183
  542    H    VAL  73           HN       VAL  73   8.961   0.058  -4.645
  543    HA   VAL  73           HA       VAL  73   8.611   2.180  -2.773
  544    HB   VAL  73           HB       VAL  73   7.065  -0.390  -3.127
  545   HG11  VAL  73          1HG1      VAL  73   6.739   0.538  -0.898
  546   HG12  VAL  73          2HG1      VAL  73   5.282   0.712  -1.873
  547   HG13  VAL  73          3HG1      VAL  73   6.331   2.103  -1.598
  548   HG21  VAL  73          3HG2      VAL  73   7.067   1.074  -5.100
  549   HG22  VAL  73          1HG2      VAL  73   6.461   2.398  -4.105
  550   HG23  VAL  73          2HG2      VAL  73   5.470   0.959  -4.358
  551    H    GLU  74           HN       GLU  74   9.091   2.274  -0.661
  552    HA   GLU  74           HA       GLU  74  10.428   0.000   0.567
  553    HB2  GLU  74           2HB      GLU  74  10.661   2.804   0.795
  554    HB3  GLU  74           1HB      GLU  74  10.050   2.242   2.343
  555    HG2  GLU  74           2HG      GLU  74  12.497   1.139   0.981
  556    HG3  GLU  74           1HG      GLU  74  12.519   2.388   2.223
  557    H    HIS  75           HN       HIS  75   9.706  -0.946   2.537
  558    HA   HIS  75           HA       HIS  75   6.789  -0.636   2.894
  559    HB2  HIS  75           2HB      HIS  75   8.314  -3.248   3.002
  560    HB3  HIS  75           1HB      HIS  75   6.572  -3.041   3.138
  561    HD1  HIS  75           1HD      HIS  75   5.259  -2.588   0.926
  562    HD2  HIS  75           2HD      HIS  75   9.333  -3.216   0.413
  563    HE1  HIS  75           1HE      HIS  75   5.579  -2.955  -1.540
  564    HE2  HIS  75           2HE      HIS  75   8.076  -3.154  -1.847
  565    H    ARG  76           HN       ARG  76   5.958  -0.937   4.947
  566    HA   ARG  76           HA       ARG  76   7.582  -1.955   7.085
  567    HB2  ARG  76           2HB      ARG  76   8.256   0.461   6.979
  568    HB3  ARG  76           1HB      ARG  76   6.580   0.895   7.293
  569    HG2  ARG  76           2HG      ARG  76   6.680  -0.289   9.431
  570    HG3  ARG  76           1HG      ARG  76   8.364  -0.704   9.116
  571    HD2  ARG  76           2HD      ARG  76   8.870   1.733   9.004
  572    HD3  ARG  76           1HD      ARG  76   7.207   2.051   9.500
  573    HE   ARG  76           HE       ARG  76   8.604   0.259  11.265
  574   HH11  ARG  76          1HH1      ARG  76   7.961   3.621  10.521
  575   HH12  ARG  76          2HH1      ARG  76   8.358   4.181  12.122
  576   HH21  ARG  76          1HH2      ARG  76   9.150   0.999  13.366
  577   HH22  ARG  76          2HH2      ARG  76   9.021   2.692  13.734
  578    H    GLY  77           HN       GLY  77   6.317  -2.679   8.803
  579    HA2  GLY  77           2HA      GLY  77   4.197  -2.326  10.063
  580    HA3  GLY  77           1HA      GLY  77   3.410  -2.246   8.494
  581    H    PHE  78           HN       PHE  78   4.156  -4.292   7.093
  582    HA   PHE  78           HA       PHE  78   3.367  -6.600   8.688
  583    HB2  PHE  78           2HB      PHE  78   3.095  -7.716   6.451
  584    HB3  PHE  78           1HB      PHE  78   2.060  -6.317   6.701
  585    HD1  PHE  78           1HD      PHE  78   2.474  -4.234   5.486
  586    HD2  PHE  78           2HD      PHE  78   4.811  -7.722   4.771
  587    HE1  PHE  78           1HE      PHE  78   3.286  -3.255   3.379
  588    HE2  PHE  78           2HE      PHE  78   5.628  -6.748   2.665
  589    HZ   PHE  78           HZ       PHE  78   4.867  -4.515   1.969
  590    HA   PRO  79           HA       PRO  79   7.409  -8.352   8.802
  591    HB2  PRO  79           2HB      PRO  79   6.231 -11.030   8.591
  592    HB3  PRO  79           1HB      PRO  79   7.065 -10.279   9.953
  593    HG2  PRO  79           2HG      PRO  79   4.413 -10.756   9.986
  594    HG3  PRO  79           1HG      PRO  79   5.136  -9.354  10.800
  595    HD2  PRO  79           2HD      PRO  79   3.718  -9.489   8.159
  596    HD3  PRO  79           1HD      PRO  79   3.593  -8.269   9.447
  597    H    GLY  80           HN       GLY  80   8.987  -9.146   7.465
  598    HA2  GLY  80           2HA      GLY  80   8.259  -9.459   4.672
  599    HA3  GLY  80           1HA      GLY  80   9.887  -9.354   5.326
  600    H    ASP  81           HN       ASP  81   8.046 -11.548   7.055
  601    HA   ASP  81           HA       ASP  81   9.502 -13.803   6.138
  602    HB2  ASP  81           2HB      ASP  81   7.291 -13.351   8.099
  603    HB3  ASP  81           1HB      ASP  81   7.730 -14.983   7.640
  604    H    LEU  82           HN       LEU  82   6.368 -12.462   5.495
  605    HA   LEU  82           HA       LEU  82   5.332 -14.798   4.181
  606    HB2  LEU  82           2HB      LEU  82   4.358 -11.939   4.152
  607    HB3  LEU  82           1HB      LEU  82   3.472 -13.321   3.535
  608    HG   LEU  82           HG       LEU  82   4.248 -12.908   6.426
  609   HD11  LEU  82          1HD1      LEU  82   1.843 -12.532   6.770
  610   HD12  LEU  82          2HD1      LEU  82   1.600 -12.590   5.023
  611   HD13  LEU  82          3HD1      LEU  82   2.573 -11.302   5.736
  612   HD21  LEU  82          3HD2      LEU  82   4.102 -15.270   5.804
  613   HD22  LEU  82          1HD2      LEU  82   2.498 -14.995   5.126
  614   HD23  LEU  82          2HD2      LEU  82   2.766 -14.803   6.858
  615    H    ALA  83           HN       ALA  83   4.769 -14.867   1.906
  616    HA   ALA  83           HA       ALA  83   6.868 -13.786   0.239
  617    HB1  ALA  83           1HB      ALA  83   5.790 -15.042  -1.571
  618    HB2  ALA  83           2HB      ALA  83   4.443 -15.428  -0.499
  619    HB3  ALA  83           3HB      ALA  83   6.053 -16.056  -0.153
  620    H    VAL  84           HN       VAL  84   6.784 -11.856  -0.669
  621    HA   VAL  84           HA       VAL  84   4.262 -10.390  -0.502
  622    HB   VAL  84           HB       VAL  84   7.018  -9.332  -1.135
  623   HG11  VAL  84          1HG1      VAL  84   4.492  -7.915  -0.306
  624   HG12  VAL  84          2HG1      VAL  84   5.231  -7.876  -1.906
  625   HG13  VAL  84          3HG1      VAL  84   6.068  -7.156  -0.530
  626   HG21  VAL  84          3HG2      VAL  84   7.015 -10.319   1.079
  627   HG22  VAL  84          1HG2      VAL  84   5.549  -9.429   1.499
  628   HG23  VAL  84          2HG2      VAL  84   7.055  -8.560   1.202
  629    H    THR  85           HN       THR  85   3.013 -10.213  -2.221
  630    HA   THR  85           HA       THR  85   4.256 -10.174  -4.896
  631    HB   THR  85           HB       THR  85   1.347 -10.726  -4.346
  632    HG1  THR  85           1HG      THR  85   2.770 -12.284  -3.279
  633   HG21  THR  85          3HG2      THR  85   1.472 -11.833  -6.545
  634   HG22  THR  85          1HG2      THR  85   3.165 -11.358  -6.667
  635   HG23  THR  85          2HG2      THR  85   1.903 -10.125  -6.631
  636    H    VAL  86           HN       VAL  86   3.894  -8.390  -6.124
  637    HA   VAL  86           HA       VAL  86   2.114  -6.326  -5.056
  638    HB   VAL  86           HB       VAL  86   4.951  -5.731  -5.883
  639   HG11  VAL  86          1HG1      VAL  86   3.430  -3.869  -6.199
  640   HG12  VAL  86          2HG1      VAL  86   4.529  -3.540  -4.858
  641   HG13  VAL  86          3HG1      VAL  86   2.865  -4.027  -4.536
  642   HG21  VAL  86          3HG2      VAL  86   3.828  -5.921  -3.096
  643   HG22  VAL  86          1HG2      VAL  86   5.438  -5.340  -3.518
  644   HG23  VAL  86          2HG2      VAL  86   5.000  -7.020  -3.824
  645    H    GLU  87           HN       GLU  87   1.212  -5.007  -6.563
  646    HA   GLU  87           HA       GLU  87   2.029  -5.385  -9.371
  647    HB2  GLU  87           2HB      GLU  87  -0.483  -5.497  -8.396
  648    HB3  GLU  87           1HB      GLU  87  -0.362  -3.753  -8.606
  649    HG2  GLU  87           2HG      GLU  87  -0.067  -3.935 -10.916
  650    HG3  GLU  87           1HG      GLU  87   0.316  -5.653 -10.819
  651    HA   PRO  88           HA       PRO  88   4.627  -2.978 -10.505
  652    HB2  PRO  88           2HB      PRO  88   3.556  -0.259  -9.984
  653    HB3  PRO  88           1HB      PRO  88   4.488  -0.856 -11.357
  654    HG2  PRO  88           2HG      PRO  88   1.630  -0.696 -11.108
  655    HG3  PRO  88           1HG      PRO  88   2.569  -1.319 -12.476
  656    HD2  PRO  88           2HD      PRO  88   0.936  -2.884 -10.911
  657    HD3  PRO  88           1HD      PRO  88   2.364  -3.511 -11.768
  658    H    ARG  89           HN       ARG  89   6.357  -2.862  -9.416
  659    HA   ARG  89           HA       ARG  89   6.151  -2.656  -6.511
  660    HB2  ARG  89           2HB      ARG  89   8.537  -3.577  -8.080
  661    HB3  ARG  89           1HB      ARG  89   8.087  -3.984  -6.428
  662    HG2  ARG  89           2HG      ARG  89   6.150  -5.213  -7.277
  663    HG3  ARG  89           1HG      ARG  89   6.656  -4.854  -8.925
  664    HD2  ARG  89           2HD      ARG  89   8.864  -5.931  -8.285
  665    HD3  ARG  89           1HD      ARG  89   8.015  -6.569  -6.881
  666    HE   ARG  89           HE       ARG  89   6.498  -7.160  -9.163
  667   HH11  ARG  89          1HH1      ARG  89   9.578  -8.057  -7.748
  668   HH12  ARG  89          2HH1      ARG  89   9.567  -9.650  -8.437
  669   HH21  ARG  89          1HH2      ARG  89   6.526  -9.232 -10.104
  670   HH22  ARG  89          2HH2      ARG  89   7.862 -10.302  -9.806
  671    H    MET  90           HN       MET  90   7.507  -1.138  -9.238
  672    HA   MET  90           HA       MET  90   8.874   0.826  -7.542
  673    HB2  MET  90           2HB      MET  90   9.109   0.321 -10.519
  674    HB3  MET  90           1HB      MET  90   9.944   1.601  -9.650
  675    HG2  MET  90           2HG      MET  90  11.103  -0.105  -8.304
  676    HG3  MET  90           1HG      MET  90  10.306  -1.361  -9.246
  677    HE1  MET  90           3HE      MET  90  13.354   1.628 -10.995
  678    HE2  MET  90           1HE      MET  90  12.861   1.609  -9.303
  679    HE3  MET  90           2HE      MET  90  11.710   2.087 -10.552
  680    H    ALA  91           HN       ALA  91   8.205   2.945  -7.582
  681    HA   ALA  91           HA       ALA  91   5.619   3.337  -8.938
  682    HB1  ALA  91           1HB      ALA  91   6.443   4.306  -6.202
  683    HB2  ALA  91           2HB      ALA  91   5.301   3.008  -6.552
  684    HB3  ALA  91           3HB      ALA  91   4.911   4.669  -6.999
  685    H    ARG  92           HN       ARG  92   5.103   5.379  -9.660
  686    HA   ARG  92           HA       ARG  92   7.416   7.151 -10.042
  687    HB2  ARG  92           2HB      ARG  92   6.179   7.989 -12.054
  688    HB3  ARG  92           1HB      ARG  92   6.651   6.299 -12.156
  689    HG2  ARG  92           2HG      ARG  92   4.390   5.615 -11.587
  690    HG3  ARG  92           1HG      ARG  92   3.906   7.303 -11.426
  691    HD2  ARG  92           2HD      ARG  92   5.044   6.161 -13.965
  692    HD3  ARG  92           1HD      ARG  92   3.320   6.159 -13.607
  693    HE   ARG  92           HE       ARG  92   3.765   8.723 -13.331
  694   HH11  ARG  92          1HH1      ARG  92   5.223   6.582 -15.696
  695   HH12  ARG  92          2HH1      ARG  92   5.300   7.802 -16.935
  696   HH21  ARG  92          1HH2      ARG  92   3.874  10.332 -14.959
  697   HH22  ARG  92          2HH2      ARG  92   4.553   9.925 -16.511
  698    H    VAL  93           HN       VAL  93   7.372   9.021  -9.058
  699    HA   VAL  93           HA       VAL  93   4.829  10.428  -8.756
  700    HB   VAL  93           HB       VAL  93   5.160   9.511  -6.558
  701   HG11  VAL  93          1HG1      VAL  93   7.177   9.896  -5.246
  702   HG12  VAL  93          2HG1      VAL  93   7.927  10.686  -6.632
  703   HG13  VAL  93          3HG1      VAL  93   7.518   8.971  -6.707
  704   HG21  VAL  93          3HG2      VAL  93   5.411  11.554  -5.198
  705   HG22  VAL  93          1HG2      VAL  93   4.343  11.780  -6.583
  706   HG23  VAL  93          2HG2      VAL  93   5.990  12.406  -6.632
  707    H    GLN  94           HN       GLN  94   4.980  12.616  -9.058
  708    HA   GLN  94           HA       GLN  94   7.570  13.459 -10.162
  709    HB2  GLN  94           2HB      GLN  94   5.800  13.367 -11.814
  710    HB3  GLN  94           1HB      GLN  94   4.772  14.380 -10.812
  711    HG2  GLN  94           2HG      GLN  94   6.213  16.264 -11.139
  712    HG3  GLN  94           1HG      GLN  94   7.394  15.268 -11.984
  713   HE21  GLN  94          1HE2      GLN  94   7.288  16.559 -13.793
  714   HE22  GLN  94          2HE2      GLN  94   5.937  16.536 -14.862
  715    H    LEU  95           HN       LEU  95   8.668  14.843  -9.026
  716    HA   LEU  95           HA       LEU  95   7.257  16.815  -7.369
  717    HB2  LEU  95           2HB      LEU  95  10.160  15.966  -7.343
  718    HB3  LEU  95           1HB      LEU  95   9.459  17.184  -6.297
  719    HG   LEU  95           HG       LEU  95   8.721  14.255  -6.304
  720   HD11  LEU  95          1HD1      LEU  95  10.357  15.877  -4.358
  721   HD12  LEU  95          2HD1      LEU  95  10.951  14.606  -5.426
  722   HD13  LEU  95          3HD1      LEU  95   9.838  14.207  -4.119
  723   HD21  LEU  95          3HD2      LEU  95   7.457  14.786  -4.284
  724   HD22  LEU  95          1HD2      LEU  95   6.844  15.683  -5.673
  725   HD23  LEU  95          2HD2      LEU  95   7.853  16.493  -4.474
  726    H    GLU  96           HN       GLU  96   7.290  18.910  -7.964
  727    HA   GLU  96           HA       GLU  96   9.167  19.701 -10.081
  728    HB2  GLU  96           2HB      GLU  96   7.042  19.194 -11.151
  729    HB3  GLU  96           1HB      GLU  96   6.191  20.231 -10.017
  730    HG2  GLU  96           2HG      GLU  96   7.291  22.182 -10.927
  731    HG3  GLU  96           1HG      GLU  96   8.241  21.167 -12.010
  732    H    GLU  97           HN       GLU  97   9.953  21.759  -9.942
  733    HA   GLU  97           HA       GLU  97   9.543  23.199  -7.492
  734    HB2  GLU  97           2HB      GLU  97  11.728  23.165  -8.728
  735    HB3  GLU  97           1HB      GLU  97  10.973  24.124  -9.994
  736    HG2  GLU  97           2HG      GLU  97  10.550  25.914  -8.373
  737    HG3  GLU  97           1HG      GLU  97  11.345  24.954  -7.125
  738    H    ARG  98           HN       ARG  98   7.312  23.539  -7.564
  739    HA   ARG  98           HA       ARG  98   6.442  25.654  -9.397
  740    HB2  ARG  98           2HB      ARG  98   5.771  23.301 -10.154
  741    HB3  ARG  98           1HB      ARG  98   4.726  23.260  -8.744
  742    HG2  ARG  98           2HG      ARG  98   3.414  23.866 -10.642
  743    HG3  ARG  98           1HG      ARG  98   3.584  25.294  -9.616
  744    HD2  ARG  98           2HD      ARG  98   3.883  25.862 -11.970
  745    HD3  ARG  98           1HD      ARG  98   5.371  26.121 -11.061
  746    HE   ARG  98           HE       ARG  98   5.130  23.546 -12.392
  747   HH11  ARG  98          1HH1      ARG  98   6.377  26.821 -12.502
  748   HH12  ARG  98          2HH1      ARG  98   7.548  26.474 -13.731
  749   HH21  ARG  98          1HH2      ARG  98   6.673  23.089 -14.033
  750   HH22  ARG  98          2HH2      ARG  98   7.719  24.361 -14.605
  751    H    GLN  99           HN       GLN  99   4.629  26.851  -8.620
  752    HA   GLN  99           HA       GLN  99   4.320  26.757  -5.734
  753    HB2  GLN  99           2HB      GLN  99   3.133  28.989  -6.299
  754    HB3  GLN  99           1HB      GLN  99   4.882  28.929  -6.335
  755    HG2  GLN  99           2HG      GLN  99   4.850  28.747  -8.743
  756    HG3  GLN  99           1HG      GLN  99   3.091  28.654  -8.741
  757   HE21  GLN  99          1HE2      GLN  99   2.841  30.677  -6.654
  758   HE22  GLN  99          2HE2      GLN  99   3.153  32.196  -7.424
  759    H    THR 100           HN       THR 100   2.868  24.940  -5.707
  760    HA   THR 100           HA       THR 100   0.298  25.359  -7.036
  761    HB   THR 100           HB       THR 100   1.094  22.914  -5.475
  762    HG1  THR 100           1HG      THR 100   2.666  23.038  -7.023
  763   HG21  THR 100          3HG2      THR 100  -0.521  21.814  -6.962
  764   HG22  THR 100          1HG2      THR 100  -0.837  23.356  -7.761
  765   HG23  THR 100          2HG2      THR 100  -1.275  23.133  -6.067
  766    H    VAL 101           HN       VAL 101   1.355  24.138  -3.960
  767    HA   VAL 101           HA       VAL 101   0.724  24.330  -1.828
  768    HB   VAL 101           HB       VAL 101   0.315  26.423  -0.874
  769   HG11  VAL 101          1HG1      VAL 101   1.934  27.905  -1.983
  770   HG12  VAL 101          2HG1      VAL 101   1.923  26.835  -3.386
  771   HG13  VAL 101          3HG1      VAL 101   2.516  26.248  -1.829
  772   HG21  VAL 101          3HG2      VAL 101  -1.633  27.123  -2.138
  773   HG22  VAL 101          1HG2      VAL 101  -0.629  27.419  -3.559
  774   HG23  VAL 101          2HG2      VAL 101  -0.423  28.406  -2.111
  775    H    SER 102           HN       SER 102  -1.773  24.690  -4.113
  776    HA   SER 102           HA       SER 102  -3.721  23.946  -2.040
  777    HB2  SER 102           2HB      SER 102  -4.182  26.153  -3.130
  778    HB3  SER 102           1HB      SER 102  -4.317  25.317  -4.676
  779    HG   SER 102           HG       SER 102  -5.866  24.392  -2.531
  780    H    VAL 103           HN       VAL 103  -3.769  21.784  -2.126
  781    HA   VAL 103           HA       VAL 103  -4.342  20.546  -4.720
  782    HB   VAL 103           HB       VAL 103  -2.974  18.534  -3.871
  783   HG11  VAL 103          1HG1      VAL 103  -2.313  19.882  -5.780
  784   HG12  VAL 103          2HG1      VAL 103  -0.902  19.455  -4.811
  785   HG13  VAL 103          3HG1      VAL 103  -1.588  21.078  -4.707
  786   HG21  VAL 103          3HG2      VAL 103  -1.752  20.720  -2.182
  787   HG22  VAL 103          1HG2      VAL 103  -1.086  19.103  -2.407
  788   HG23  VAL 103          2HG2      VAL 103  -2.630  19.314  -1.580
  789    HA   PRO 104           HA       PRO 104  -7.592  19.017  -1.884
  790    HB2  PRO 104           2HB      PRO 104  -9.073  18.758  -4.402
  791    HB3  PRO 104           1HB      PRO 104  -9.498  19.662  -2.947
  792    HG2  PRO 104           2HG      PRO 104  -8.791  20.887  -5.244
  793    HG3  PRO 104           1HG      PRO 104  -8.405  21.565  -3.652
  794    HD2  PRO 104           2HD      PRO 104  -6.642  20.049  -5.542
  795    HD3  PRO 104           1HD      PRO 104  -6.273  21.488  -4.566
  796    H    VAL 105           HN       VAL 105  -7.974  16.878  -1.464
  797    HA   VAL 105           HA       VAL 105  -7.499  14.946  -3.605
  798    HB   VAL 105           HB       VAL 105  -5.344  15.086  -2.550
  799   HG11  VAL 105          1HG1      VAL 105  -4.990  14.571  -0.186
  800   HG12  VAL 105          2HG1      VAL 105  -6.736  14.496   0.052
  801   HG13  VAL 105          3HG1      VAL 105  -5.973  16.018  -0.407
  802   HG21  VAL 105          3HG2      VAL 105  -6.773  12.578  -1.684
  803   HG22  VAL 105          1HG2      VAL 105  -5.029  12.767  -1.859
  804   HG23  VAL 105          2HG2      VAL 105  -6.075  12.880  -3.277
  805    H    THR 106           HN       THR 106  -9.290  13.838  -3.735
  806    HA   THR 106           HA       THR 106 -10.064  12.007  -1.773
  807    HB   THR 106           HB       THR 106 -11.028  14.007  -0.643
  808    HG1  THR 106           1HG      THR 106 -13.127  13.048  -0.363
  809   HG21  THR 106          3HG2      THR 106 -13.009  15.093  -1.605
  810   HG22  THR 106          1HG2      THR 106 -12.798  14.162  -3.086
  811   HG23  THR 106          2HG2      THR 106 -11.580  15.344  -2.608
  812    H    VAL 107           HN       VAL 107 -12.438  11.159  -2.441
  813    HA   VAL 107           HA       VAL 107 -12.200  10.641  -5.309
  814    HB   VAL 107           HB       VAL 107 -12.352   8.753  -3.681
  815   HG11  VAL 107          1HG1      VAL 107 -13.886   9.692  -2.076
  816   HG12  VAL 107          2HG1      VAL 107 -14.544   8.186  -2.720
  817   HG13  VAL 107          3HG1      VAL 107 -15.168   9.734  -3.287
  818   HG21  VAL 107          3HG2      VAL 107 -14.571   8.909  -5.712
  819   HG22  VAL 107          1HG2      VAL 107 -13.973   7.426  -4.967
  820   HG23  VAL 107          2HG2      VAL 107 -12.914   8.381  -6.006
  821    H    GLU 108           HN       GLU 108 -13.217  13.163  -4.239
  822    HA   GLU 108           HA       GLU 108 -15.767  13.202  -5.672
  823    HB2  GLU 108           2HB      GLU 108 -16.316  13.149  -3.285
  824    HB3  GLU 108           1HB      GLU 108 -15.263  14.527  -2.997
  825    HG2  GLU 108           2HG      GLU 108 -17.576  15.213  -3.039
  826    HG3  GLU 108           1HG      GLU 108 -16.699  15.918  -4.394
  827    H    MET 109           HN       MET 109 -15.906  14.810  -7.088
  828    HA   MET 109           HA       MET 109 -14.005  17.046  -6.856
  829    HB2  MET 109           2HB      MET 109 -13.397  15.510  -8.704
  830    HB3  MET 109           1HB      MET 109 -14.988  15.756  -9.412
  831    HG2  MET 109           2HG      MET 109 -14.477  18.146  -9.683
  832    HG3  MET 109           1HG      MET 109 -12.866  17.857  -9.026
  833    HE1  MET 109           3HE      MET 109 -14.989  15.573 -11.450
  834    HE2  MET 109           1HE      MET 109 -14.408  16.130 -13.020
  835    HE3  MET 109           2HE      MET 109 -15.336  17.216 -11.989
  836    H    ILE 110           HN       ILE 110 -15.396  18.498  -5.941
  837    HA   ILE 110           HA       ILE 110 -17.503  19.504  -7.640
  838    HB   ILE 110           HB       ILE 110 -18.665  17.747  -6.403
  839   HG12  ILE 110          2HG1      ILE 110 -20.465  19.144  -5.408
  840   HG13  ILE 110          1HG1      ILE 110 -19.414  20.546  -5.543
  841   HG21  ILE 110          1HG2      ILE 110 -18.979  17.910  -3.983
  842   HG22  ILE 110          2HG2      ILE 110 -17.836  19.252  -3.931
  843   HG23  ILE 110          3HG2      ILE 110 -17.291  17.644  -4.417
  844   HD11  ILE 110          3HD1      ILE 110 -21.002  20.515  -7.363
  845   HD12  ILE 110          1HD1      ILE 110 -20.482  18.894  -7.819
  846   HD13  ILE 110          2HD1      ILE 110 -19.374  20.256  -7.988
  847    H    ASN 111           HN       ASN 111 -17.717  21.626  -7.461
  848    HA   ASN 111           HA       ASN 111 -17.148  22.970  -4.933
  849    HB2  ASN 111           2HB      ASN 111 -15.095  23.174  -6.372
  850    HB3  ASN 111           1HB      ASN 111 -16.077  23.977  -7.589
  851   HD21  ASN 111          1HD2      ASN 111 -13.758  24.982  -6.210
  852   HD22  ASN 111          2HD2      ASN 111 -14.259  26.419  -5.386
  853    H    LEU 112           HN       LEU 112 -19.352  23.203  -4.687
  854    HA   LEU 112           HA       LEU 112 -20.894  24.261  -6.920
  855    HB2  LEU 112           2HB      LEU 112 -21.711  22.328  -5.573
  856    HB3  LEU 112           1HB      LEU 112 -21.841  23.393  -4.188
  857    HG   LEU 112           HG       LEU 112 -23.546  24.712  -5.320
  858   HD11  LEU 112          1HD1      LEU 112 -23.212  22.752  -7.591
  859   HD12  LEU 112          2HD1      LEU 112 -22.785  24.463  -7.616
  860   HD13  LEU 112          3HD1      LEU 112 -24.475  23.979  -7.466
  861   HD21  LEU 112          3HD2      LEU 112 -25.316  23.010  -5.386
  862   HD22  LEU 112          1HD2      LEU 112 -24.257  22.819  -3.988
  863   HD23  LEU 112          2HD2      LEU 112 -24.083  21.747  -5.377
  864    H    GLU 113           HN       GLU 113 -21.168  26.342  -7.164
  865    HA   GLU 113           HA       GLU 113 -20.368  28.226  -5.180
  866    HB2  GLU 113           2HB      GLU 113 -21.141  29.912  -6.849
  867    HB3  GLU 113           1HB      GLU 113 -19.989  28.748  -7.489
  868    HG2  GLU 113           2HG      GLU 113 -21.823  27.499  -8.514
  869    HG3  GLU 113           1HG      GLU 113 -22.975  28.671  -7.876
  870    H    HIS 114           HN       HIS 114 -21.617  28.214  -3.391
  871    HA   HIS 114           HA       HIS 114 -24.294  29.327  -3.736
  872    HB2  HIS 114           2HB      HIS 114 -23.627  26.787  -2.312
  873    HB3  HIS 114           1HB      HIS 114 -24.876  27.821  -1.634
  874    HD1  HIS 114           1HD      HIS 114 -25.301  24.935  -2.898
  875    HD2  HIS 114           2HD      HIS 114 -26.103  28.589  -4.724
  876    HE1  HIS 114           1HE      HIS 114 -27.042  24.456  -4.654
  877    HE2  HIS 114           2HE      HIS 114 -27.348  26.638  -5.884
  878    H    HIS 115           HN       HIS 115 -21.756  30.479  -3.061
  879    HA   HIS 115           HA       HIS 115 -21.576  30.933  -0.277
  880    HB2  HIS 115           2HB      HIS 115 -20.188  32.922  -0.884
  881    HB3  HIS 115           1HB      HIS 115 -19.642  31.421  -1.609
  882    HD1  HIS 115           1HD      HIS 115 -19.438  31.357  -4.129
  883    HD2  HIS 115           2HD      HIS 115 -21.378  34.772  -2.747
  884    HE1  HIS 115           1HE      HIS 115 -19.623  32.887  -6.115
  885    HE2  HIS 115           2HE      HIS 115 -20.624  35.014  -5.213
  886    H    HIS 116           HN       HIS 116 -22.877  31.989   0.989
  887    HA   HIS 116           HA       HIS 116 -24.744  33.920  -0.220
  888    HB2  HIS 116           2HB      HIS 116 -26.522  33.055   1.261
  889    HB3  HIS 116           1HB      HIS 116 -25.941  31.827   0.144
  890    HD1  HIS 116           1HD      HIS 116 -26.488  32.494   3.702
  891    HD2  HIS 116           2HD      HIS 116 -24.226  29.847   1.422
  892    HE1  HIS 116           1HE      HIS 116 -25.798  30.655   5.276
  893    HE2  HIS 116           2HE      HIS 116 -24.269  29.176   3.918
  894    H    HIS 117           HN       HIS 117 -25.128  35.743   0.891
  895    HA   HIS 117           HA       HIS 117 -23.372  36.268   3.125
  896    HB2  HIS 117           2HB      HIS 117 -24.175  38.612   2.930
  897    HB3  HIS 117           1HB      HIS 117 -23.499  37.980   1.436
  898    HD1  HIS 117           1HD      HIS 117 -25.206  37.482  -0.517
  899    HD2  HIS 117           2HD      HIS 117 -26.807  39.427   2.801
  900    HE1  HIS 117           1HE      HIS 117 -27.411  38.431  -1.275
  901    HE2  HIS 117           2HE      HIS 117 -28.326  39.673   0.723
  902    H    HIS 118           HN       HIS 118 -23.963  35.600   5.036
  903    HA   HIS 118           HA       HIS 118 -26.775  35.527   5.791
  904    HB2  HIS 118           2HB      HIS 118 -25.368  33.581   6.319
  905    HB3  HIS 118           1HB      HIS 118 -24.293  34.601   7.266
  906    HD1  HIS 118           1HD      HIS 118 -24.853  34.916   9.678
  907    HD2  HIS 118           2HD      HIS 118 -28.000  33.264   7.510
  908    HE1  HIS 118           1HE      HIS 118 -26.587  34.259  11.381
  909    HE2  HIS 118           2HE      HIS 118 -28.358  33.050  10.063
  910    H    HIS 119           HN       HIS 119 -27.703  36.890   7.258
  911    HA   HIS 119           HA       HIS 119 -25.925  38.860   8.523
  912    HB2  HIS 119           2HB      HIS 119 -27.496  40.619   8.171
  913    HB3  HIS 119           1HB      HIS 119 -27.277  39.814   6.627
  914    HD1  HIS 119           1HD      HIS 119 -29.309  37.946   6.134
  915    HD2  HIS 119           2HD      HIS 119 -30.072  41.051   8.797
  916    HE1  HIS 119           1HE      HIS 119 -31.812  38.119   6.279
  917    HE2  HIS 119           2HE      HIS 119 -32.257  40.056   7.830
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1   2.002 -32.708  -6.098
    2    H2   MET   1           H2       MET   1   1.802 -31.043  -5.848
    3    H3   MET   1           H3       MET   1   1.033 -31.800  -7.158
    4    HA   MET   1           HA       MET   1  -0.269 -33.145  -5.596
    5    HB2  MET   1           2HB      MET   1   1.019 -31.283  -3.588
    6    HB3  MET   1           1HB      MET   1  -0.357 -32.323  -3.245
    7    HG2  MET   1           2HG      MET   1   0.975 -34.291  -3.643
    8    HG3  MET   1           1HG      MET   1   2.350 -33.298  -4.129
    9    HE1  MET   1           2HE      MET   1   2.525 -35.608  -1.910
   10    HE2  MET   1           3HE      MET   1   3.537 -34.803  -0.708
   11    HE3  MET   1           1HE      MET   1   3.895 -34.624  -2.425
   12    HA   PRO   2           HA       PRO   2  -2.973 -29.775  -6.734
   13    HB2  PRO   2           2HB      PRO   2  -5.195 -31.570  -6.277
   14    HB3  PRO   2           1HB      PRO   2  -4.542 -30.997  -7.811
   15    HG2  PRO   2           2HG      PRO   2  -4.367 -33.586  -6.979
   16    HG3  PRO   2           1HG      PRO   2  -3.194 -32.828  -8.072
   17    HD2  PRO   2           2HD      PRO   2  -3.000 -33.306  -5.116
   18    HD3  PRO   2           1HD      PRO   2  -1.764 -33.528  -6.375
   19    H    THR   3           HN       THR   3  -2.397 -30.854  -3.757
   20    HA   THR   3           HA       THR   3  -4.721 -29.912  -2.353
   21    HB   THR   3           HB       THR   3  -3.240 -30.148  -0.334
   22    HG1  THR   3           1HG      THR   3  -1.271 -29.781  -1.677
   23   HG21  THR   3          3HG2      THR   3  -3.337 -32.540  -2.180
   24   HG22  THR   3          1HG2      THR   3  -4.621 -32.022  -1.087
   25   HG23  THR   3          2HG2      THR   3  -3.085 -32.594  -0.435
   26    H    PHE   4           HN       PHE   4  -4.662 -28.054  -0.877
   27    HA   PHE   4           HA       PHE   4  -3.610 -25.731  -2.034
   28    HB2  PHE   4           2HB      PHE   4  -4.821 -26.329   0.621
   29    HB3  PHE   4           1HB      PHE   4  -4.210 -24.735   0.250
   30    HD1  PHE   4           2HD      PHE   4  -6.693 -27.287  -0.724
   31    HD2  PHE   4           1HD      PHE   4  -5.434 -23.235  -1.090
   32    HE1  PHE   4           2HE      PHE   4  -8.827 -26.722  -1.812
   33    HE2  PHE   4           1HE      PHE   4  -7.564 -22.666  -2.176
   34    HZ   PHE   4           HZ       PHE   4  -9.264 -24.408  -2.538
   35    H    ASP   5           HN       ASP   5  -1.879 -24.456  -1.483
   36    HA   ASP   5           HA       ASP   5   0.042 -25.487   0.442
   37    HB2  ASP   5           2HB      ASP   5   0.736 -26.527  -1.662
   38    HB3  ASP   5           1HB      ASP   5   0.714 -24.959  -2.466
   39    H    HIS   6           HN       HIS   6  -0.131 -23.806   1.708
   40    HA   HIS   6           HA       HIS   6   0.328 -21.752   2.580
   41    HB2  HIS   6           2HB      HIS   6   1.260 -20.955  -0.195
   42    HB3  HIS   6           1HB      HIS   6   1.461 -20.006   1.270
   43    HD1  HIS   6           1HD      HIS   6   4.026 -20.288   0.194
   44    HD2  HIS   6           2HD      HIS   6   2.344 -23.520   2.195
   45    HE1  HIS   6           1HE      HIS   6   5.950 -21.803   0.780
   46    HE2  HIS   6           2HE      HIS   6   4.866 -23.857   1.766
   47    H    GLY   7           HN       GLY   7  -0.921 -19.961   2.921
   48    HA2  GLY   7           2HA      GLY   7  -3.309 -19.798   1.231
   49    HA3  GLY   7           1HA      GLY   7  -3.153 -19.164   2.865
   50    H    ASN   8           HN       ASN   8  -4.245 -17.483   1.196
   51    HA   ASN   8           HA       ASN   8  -2.149 -15.480   0.796
   52    HB2  ASN   8           2HB      ASN   8  -3.854 -14.936  -1.305
   53    HB3  ASN   8           1HB      ASN   8  -2.275 -15.695  -1.440
   54   HD21  ASN   8          1HD2      ASN   8  -2.130 -17.826  -1.977
   55   HD22  ASN   8          2HD2      ASN   8  -3.498 -18.797  -2.395
   56    H    LEU   9           HN       LEU   9  -2.750 -13.435   1.263
   57    HA   LEU   9           HA       LEU   9  -5.575 -12.966   1.929
   58    HB2  LEU   9           2HB      LEU   9  -4.286 -13.463   3.986
   59    HB3  LEU   9           1HB      LEU   9  -3.215 -12.124   3.617
   60    HG   LEU   9           HG       LEU   9  -5.151 -10.574   3.802
   61   HD11  LEU   9          1HD1      LEU   9  -6.606 -13.020   4.807
   62   HD12  LEU   9          2HD1      LEU   9  -6.927 -12.184   3.287
   63   HD13  LEU   9          3HD1      LEU   9  -7.219 -11.366   4.823
   64   HD21  LEU   9          3HD2      LEU   9  -3.647 -10.931   5.692
   65   HD22  LEU   9          1HD2      LEU   9  -4.635 -12.290   6.227
   66   HD23  LEU   9          2HD2      LEU   9  -5.302 -10.658   6.239
   67    H    SER  10           HN       SER  10  -6.340 -11.136   1.116
   68    HA   SER  10           HA       SER  10  -4.529  -9.466  -0.418
   69    HB2  SER  10           2HB      SER  10  -7.550  -9.381  -0.231
   70    HB3  SER  10           1HB      SER  10  -6.547  -8.553  -1.424
   71    HG   SER  10           HG       SER  10  -5.759 -10.852  -1.846
   72    H    LEU  11           HN       LEU  11  -3.621  -7.755   0.545
   73    HA   LEU  11           HA       LEU  11  -4.950  -6.282   2.643
   74    HB2  LEU  11           2HB      LEU  11  -2.493  -5.635   0.996
   75    HB3  LEU  11           1HB      LEU  11  -3.077  -4.654   2.327
   76    HG   LEU  11           HG       LEU  11  -2.117  -7.510   2.579
   77   HD11  LEU  11          1HD1      LEU  11  -0.294  -5.999   2.010
   78   HD12  LEU  11          2HD1      LEU  11  -0.169  -6.527   3.688
   79   HD13  LEU  11          3HD1      LEU  11  -0.772  -4.913   3.316
   80   HD21  LEU  11          3HD2      LEU  11  -2.879  -5.462   4.661
   81   HD22  LEU  11          1HD2      LEU  11  -2.151  -7.031   4.993
   82   HD23  LEU  11          2HD2      LEU  11  -3.760  -6.942   4.276
   83    H    GLY  12           HN       GLY  12  -4.793  -6.326  -0.772
   84    HA2  GLY  12           2HA      GLY  12  -6.299  -5.349  -2.246
   85    HA3  GLY  12           1HA      GLY  12  -6.905  -4.350  -0.930
   86    H    GLU  13           HN       GLU  13  -6.851  -2.571  -2.429
   87    HA   GLU  13           HA       GLU  13  -4.209  -1.625  -3.163
   88    HB2  GLU  13           2HB      GLU  13  -5.417   0.275  -4.208
   89    HB3  GLU  13           1HB      GLU  13  -5.934  -1.293  -4.809
   90    HG2  GLU  13           2HG      GLU  13  -7.860  -1.143  -3.195
   91    HG3  GLU  13           1HG      GLU  13  -7.390   0.535  -2.924
   92    H    LEU  14           HN       LEU  14  -3.010  -0.530  -1.836
   93    HA   LEU  14           HA       LEU  14  -4.271   0.840   0.441
   94    HB2  LEU  14           2HB      LEU  14  -1.461  -0.220   0.121
   95    HB3  LEU  14           1HB      LEU  14  -2.060   0.626   1.534
   96    HG   LEU  14           HG       LEU  14  -3.113  -2.023   0.537
   97   HD11  LEU  14          1HD1      LEU  14  -1.967  -2.979   2.460
   98   HD12  LEU  14          2HD1      LEU  14  -1.309  -1.394   2.868
   99   HD13  LEU  14          3HD1      LEU  14  -0.822  -2.193   1.374
  100   HD21  LEU  14          3HD2      LEU  14  -3.655  -0.496   3.083
  101   HD22  LEU  14          1HD2      LEU  14  -4.283  -2.093   2.677
  102   HD23  LEU  14          2HD2      LEU  14  -4.779  -0.686   1.735
  103    H    GLU  15           HN       GLU  15  -3.518   2.895   1.056
  104    HA   GLU  15           HA       GLU  15  -2.732   4.543  -1.172
  105    HB2  GLU  15           2HB      GLU  15  -3.260   5.219   1.726
  106    HB3  GLU  15           1HB      GLU  15  -2.933   6.406   0.472
  107    HG2  GLU  15           2HG      GLU  15  -4.938   5.724  -0.719
  108    HG3  GLU  15           1HG      GLU  15  -5.260   4.498   0.504
  109    H    LEU  16           HN       LEU  16  -0.800   5.370  -1.600
  110    HA   LEU  16           HA       LEU  16   1.432   4.428   0.028
  111    HB2  LEU  16           2HB      LEU  16   1.372   3.972  -2.411
  112    HB3  LEU  16           1HB      LEU  16   1.407   5.697  -2.715
  113    HG   LEU  16           HG       LEU  16   3.633   4.470  -1.136
  114   HD11  LEU  16          1HD1      LEU  16   3.352   3.009  -3.084
  115   HD12  LEU  16          2HD1      LEU  16   4.829   3.967  -3.196
  116   HD13  LEU  16          3HD1      LEU  16   3.410   4.416  -4.144
  117   HD21  LEU  16          3HD2      LEU  16   3.494   6.909  -1.411
  118   HD22  LEU  16          1HD2      LEU  16   3.505   6.705  -3.161
  119   HD23  LEU  16          2HD2      LEU  16   4.917   6.238  -2.211
  120    H    THR  17           HN       THR  17   2.747   5.731   1.133
  121    HA   THR  17           HA       THR  17   2.124   8.598   1.157
  122    HB   THR  17           HB       THR  17   3.732   7.017   3.178
  123    HG1  THR  17           1HG      THR  17   1.170   6.829   2.731
  124   HG21  THR  17          3HG2      THR  17   2.444   9.748   3.322
  125   HG22  THR  17          1HG2      THR  17   4.171   9.430   3.183
  126   HG23  THR  17          2HG2      THR  17   3.298   8.942   4.637
  127    H    VAL  18           HN       VAL  18   3.573  10.038   0.420
  128    HA   VAL  18           HA       VAL  18   6.181   9.006  -0.461
  129    HB   VAL  18           HB       VAL  18   4.710  11.486  -1.379
  130   HG11  VAL  18          1HG1      VAL  18   7.135  11.750  -1.514
  131   HG12  VAL  18          2HG1      VAL  18   6.422  11.627  -3.122
  132   HG13  VAL  18          3HG1      VAL  18   7.258  10.240  -2.422
  133   HG21  VAL  18          3HG2      VAL  18   3.609   9.452  -2.130
  134   HG22  VAL  18          1HG2      VAL  18   5.136   8.848  -2.775
  135   HG23  VAL  18          2HG2      VAL  18   4.383  10.278  -3.484
  136    H    LEU  19           HN       LEU  19   7.925   9.624   0.601
  137    HA   LEU  19           HA       LEU  19   7.737  11.912   2.424
  138    HB2  LEU  19           2HB      LEU  19   9.853   9.763   2.212
  139    HB3  LEU  19           1HB      LEU  19   9.778  11.012   3.443
  140    HG   LEU  19           HG       LEU  19   7.736   8.824   3.055
  141   HD11  LEU  19          1HD1      LEU  19   8.616   7.914   5.137
  142   HD12  LEU  19          2HD1      LEU  19   9.861   9.164   5.163
  143   HD13  LEU  19          3HD1      LEU  19   9.850   7.955   3.878
  144   HD21  LEU  19          3HD2      LEU  19   7.992  10.931   5.199
  145   HD22  LEU  19          1HD2      LEU  19   6.831   9.604   5.197
  146   HD23  LEU  19          2HD2      LEU  19   6.745  10.854   3.956
  147    H    TYR  20           HN       TYR  20   8.545  13.773   1.798
  148    HA   TYR  20           HA       TYR  20  10.829  13.932   0.012
  149    HB2  TYR  20           2HB      TYR  20   9.665  15.206  -1.711
  150    HB3  TYR  20           1HB      TYR  20   8.895  13.636  -1.527
  151    HD1  TYR  20           1HD      TYR  20   6.866  13.639   0.215
  152    HD2  TYR  20           2HD      TYR  20   8.301  17.063  -1.863
  153    HE1  TYR  20           1HE      TYR  20   4.703  14.746   0.559
  154    HE2  TYR  20           2HE      TYR  20   6.135  18.183  -1.521
  155    HH   TYR  20           HH       TYR  20   3.891  17.190   0.693
  156    H    ASP  21           HN       ASP  21  11.061  16.431  -0.580
  157    HA   ASP  21           HA       ASP  21  10.812  17.876   1.957
  158    HB2  ASP  21           2HB      ASP  21  13.042  17.707   0.742
  159    HB3  ASP  21           1HB      ASP  21  12.351  18.742  -0.502
  160    H    GLU  22           HN       GLU  22   8.923  18.909   2.122
  161    HA   GLU  22           HA       GLU  22   7.347  19.621  -0.147
  162    HB2  GLU  22           2HB      GLU  22   6.993  20.490   2.723
  163    HB3  GLU  22           1HB      GLU  22   5.781  20.564   1.454
  164    HG2  GLU  22           2HG      GLU  22   5.950  18.059   1.294
  165    HG3  GLU  22           1HG      GLU  22   6.927  18.116   2.763
  166    H    GLU  23           HN       GLU  23   9.620  21.295   1.861
  167    HA   GLU  23           HA       GLU  23   8.857  23.931   1.169
  168    HB2  GLU  23           2HB      GLU  23  11.362  22.746   2.355
  169    HB3  GLU  23           1HB      GLU  23  11.127  24.471   2.128
  170    HG2  GLU  23           2HG      GLU  23  10.665  23.754   4.409
  171    HG3  GLU  23           1HG      GLU  23   9.259  24.465   3.634
  172    H    ARG  24           HN       ARG  24  10.144  21.576  -0.744
  173    HA   ARG  24           HA       ARG  24  11.739  23.469  -2.320
  174    HB2  ARG  24           2HB      ARG  24  11.748  20.467  -2.180
  175    HB3  ARG  24           1HB      ARG  24  12.544  21.348  -3.473
  176    HG2  ARG  24           2HG      ARG  24  13.147  21.622  -0.540
  177    HG3  ARG  24           1HG      ARG  24  14.095  20.698  -1.706
  178    HD2  ARG  24           2HD      ARG  24  14.515  22.761  -2.972
  179    HD3  ARG  24           1HD      ARG  24  13.601  23.674  -1.772
  180    HE   ARG  24           HE       ARG  24  15.332  22.861  -0.144
  181   HH11  ARG  24          1HH1      ARG  24  16.030  23.302  -3.556
  182   HH12  ARG  24          2HH1      ARG  24  17.735  23.515  -3.302
  183   HH21  ARG  24          1HH2      ARG  24  17.565  23.168   0.189
  184   HH22  ARG  24          2HH2      ARG  24  18.620  23.413  -1.181
  185    H    TYR  25           HN       TYR  25   9.747  20.582  -3.093
  186    HA   TYR  25           HA       TYR  25   8.804  22.070  -5.456
  187    HB2  TYR  25           2HB      TYR  25   9.442  19.118  -5.422
  188    HB3  TYR  25           1HB      TYR  25   9.075  20.121  -6.820
  189    HD1  TYR  25           2HD      TYR  25  10.758  21.953  -7.452
  190    HD2  TYR  25           1HD      TYR  25  11.658  18.829  -4.701
  191    HE1  TYR  25           2HE      TYR  25  13.159  22.378  -7.756
  192    HE2  TYR  25           1HE      TYR  25  14.060  19.254  -5.002
  193    HH   TYR  25           HH       TYR  25  15.572  20.245  -6.628
  194    H    ASP  26           HN       ASP  26   6.846  21.103  -6.453
  195    HA   ASP  26           HA       ASP  26   5.059  20.008  -4.381
  196    HB2  ASP  26           2HB      ASP  26   4.554  21.847  -6.691
  197    HB3  ASP  26           1HB      ASP  26   3.257  20.803  -6.126
  198    H    ILE  27           HN       ILE  27   3.373  18.551  -5.156
  199    HA   ILE  27           HA       ILE  27   4.571  16.562  -6.915
  200    HB   ILE  27           HB       ILE  27   2.046  16.383  -5.262
  201   HG12  ILE  27          2HG1      ILE  27   4.830  15.341  -4.669
  202   HG13  ILE  27          1HG1      ILE  27   4.076  16.726  -3.885
  203   HG21  ILE  27          1HG2      ILE  27   2.252  13.970  -5.599
  204   HG22  ILE  27          2HG2      ILE  27   3.666  14.231  -6.619
  205   HG23  ILE  27          3HG2      ILE  27   2.086  14.819  -7.136
  206   HD11  ILE  27          3HD1      ILE  27   3.092  13.886  -3.753
  207   HD12  ILE  27          1HD1      ILE  27   2.366  15.275  -2.943
  208   HD13  ILE  27          2HD1      ILE  27   3.983  14.735  -2.490
  209    H    VAL  28           HN       VAL  28   4.146  16.627  -9.000
  210    HA   VAL  28           HA       VAL  28   1.706  17.861  -9.995
  211    HB   VAL  28           HB       VAL  28   3.943  16.550 -11.558
  212   HG11  VAL  28          1HG1      VAL  28   1.837  16.729 -12.794
  213   HG12  VAL  28          2HG1      VAL  28   3.077  17.793 -13.458
  214   HG13  VAL  28          3HG1      VAL  28   1.788  18.461 -12.455
  215   HG21  VAL  28          3HG2      VAL  28   4.750  18.841 -11.955
  216   HG22  VAL  28          1HG2      VAL  28   4.807  18.403 -10.249
  217   HG23  VAL  28          2HG2      VAL  28   3.523  19.453 -10.847
  218    H    GLU  29           HN       GLU  29   3.294  14.697 -10.021
  219    HA   GLU  29           HA       GLU  29   0.662  13.445 -10.150
  220    HB2  GLU  29           2HB      GLU  29   1.463  13.484 -12.479
  221    HB3  GLU  29           1HB      GLU  29   2.952  12.691 -11.983
  222    HG2  GLU  29           2HG      GLU  29   1.707  10.711 -11.330
  223    HG3  GLU  29           1HG      GLU  29   0.195  11.506 -11.764
  224    H    GLN  30           HN       GLN  30   0.685  11.267  -9.333
  225    HA   GLN  30           HA       GLN  30   3.083  10.437  -7.899
  226    HB2  GLN  30           2HB      GLN  30   1.931  12.075  -6.424
  227    HB3  GLN  30           1HB      GLN  30   0.471  11.100  -6.508
  228    HG2  GLN  30           2HG      GLN  30   1.858   9.222  -5.501
  229    HG3  GLN  30           1HG      GLN  30   3.070  10.459  -5.155
  230   HE21  GLN  30          1HE2      GLN  30   2.562  12.110  -3.683
  231   HE22  GLN  30          2HE2      GLN  30   1.280  11.937  -2.540
  232    H    THR  31           HN       THR  31   2.930   8.233  -7.156
  233    HA   THR  31           HA       THR  31   0.776   6.652  -8.310
  234    HB   THR  31           HB       THR  31   3.061   5.694  -6.570
  235    HG1  THR  31           1HG      THR  31   3.303   6.827  -8.896
  236   HG21  THR  31          3HG2      THR  31   2.652   3.542  -7.645
  237   HG22  THR  31          1HG2      THR  31   1.350   4.249  -8.603
  238   HG23  THR  31          2HG2      THR  31   1.186   4.118  -6.853
  239    H    GLU  32           HN       GLU  32  -1.093   6.859  -7.187
  240    HA   GLU  32           HA       GLU  32  -1.053   7.746  -4.470
  241    HB2  GLU  32           2HB      GLU  32  -3.525   6.843  -5.917
  242    HB3  GLU  32           1HB      GLU  32  -3.363   8.083  -4.682
  243    HG2  GLU  32           2HG      GLU  32  -3.510   9.476  -6.427
  244    HG3  GLU  32           1HG      GLU  32  -1.793   9.121  -6.606
  245    H    THR  33           HN       THR  33  -2.253   4.777  -6.035
  246    HA   THR  33           HA       THR  33  -2.200   3.517  -3.382
  247    HB   THR  33           HB       THR  33  -4.194   2.144  -4.201
  248    HG1  THR  33           1HG      THR  33  -4.955   4.307  -5.783
  249   HG21  THR  33          3HG2      THR  33  -4.380   3.843  -2.445
  250   HG22  THR  33          1HG2      THR  33  -5.812   3.830  -3.474
  251   HG23  THR  33          2HG2      THR  33  -4.597   5.091  -3.673
  252    H    VAL  34           HN       VAL  34  -1.749   1.316  -3.320
  253    HA   VAL  34           HA       VAL  34  -0.811   0.120  -5.840
  254    HB   VAL  34           HB       VAL  34   0.976  -1.025  -4.509
  255   HG11  VAL  34          1HG1      VAL  34   1.529   0.840  -5.905
  256   HG12  VAL  34          2HG1      VAL  34   2.451   0.952  -4.404
  257   HG13  VAL  34          3HG1      VAL  34   1.037   1.979  -4.651
  258   HG21  VAL  34          3HG2      VAL  34  -0.029  -0.727  -2.284
  259   HG22  VAL  34          1HG2      VAL  34   0.246   1.010  -2.399
  260   HG23  VAL  34          2HG2      VAL  34   1.616  -0.099  -2.349
  261    H    GLN  35           HN       GLN  35  -1.091  -2.098  -6.046
  262    HA   GLN  35           HA       GLN  35  -3.075  -3.252  -4.250
  263    HB2  GLN  35           2HB      GLN  35  -2.009  -4.142  -6.935
  264    HB3  GLN  35           1HB      GLN  35  -3.169  -5.068  -5.989
  265    HG2  GLN  35           2HG      GLN  35  -4.805  -3.358  -6.163
  266    HG3  GLN  35           1HG      GLN  35  -3.640  -2.238  -6.865
  267   HE21  GLN  35          1HE2      GLN  35  -3.040  -2.477  -9.014
  268   HE22  GLN  35          2HE2      GLN  35  -3.932  -3.465 -10.116
  269    H    VAL  36           HN       VAL  36  -2.514  -4.533  -2.672
  270    HA   VAL  36           HA       VAL  36   0.046  -5.993  -2.846
  271    HB   VAL  36           HB       VAL  36  -1.160  -4.908  -0.302
  272   HG11  VAL  36          1HG1      VAL  36   0.241  -6.863   0.012
  273   HG12  VAL  36          2HG1      VAL  36   1.037  -5.425   0.654
  274   HG13  VAL  36          3HG1      VAL  36   1.545  -6.096  -0.896
  275   HG21  VAL  36          3HG2      VAL  36  -0.475  -3.044  -1.701
  276   HG22  VAL  36          1HG2      VAL  36   1.111  -3.781  -1.931
  277   HG23  VAL  36          2HG2      VAL  36   0.621  -3.224  -0.331
  278    H    ASP  37           HN       ASP  37  -0.195  -8.090  -2.808
  279    HA   ASP  37           HA       ASP  37  -2.262  -9.296  -1.085
  280    HB2  ASP  37           2HB      ASP  37  -2.929  -9.358  -3.533
  281    HB3  ASP  37           1HB      ASP  37  -1.505 -10.349  -3.824
  282    H    LEU  38           HN       LEU  38  -1.412 -10.907   0.201
  283    HA   LEU  38           HA       LEU  38   1.334 -11.709  -0.436
  284    HB2  LEU  38           2HB      LEU  38   1.590 -11.759   2.167
  285    HB3  LEU  38           1HB      LEU  38   1.854 -10.293   1.248
  286    HG   LEU  38           HG       LEU  38  -0.563  -9.686   1.809
  287   HD11  LEU  38          1HD1      LEU  38  -0.135 -11.857   3.853
  288   HD12  LEU  38          2HD1      LEU  38  -1.317 -11.876   2.543
  289   HD13  LEU  38          3HD1      LEU  38  -1.461 -10.693   3.844
  290   HD21  LEU  38          3HD2      LEU  38   1.473  -9.885   4.017
  291   HD22  LEU  38          1HD2      LEU  38   0.093  -8.786   3.971
  292   HD23  LEU  38          2HD2      LEU  38   1.393  -8.620   2.790
  293    H    GLU  39           HN       GLU  39   1.992 -13.733   0.069
  294    HA   GLU  39           HA       GLU  39  -0.115 -15.588   0.958
  295    HB2  GLU  39           2HB      GLU  39   2.045 -16.069  -1.099
  296    HB3  GLU  39           1HB      GLU  39   0.932 -17.291  -0.502
  297    HG2  GLU  39           2HG      GLU  39  -0.942 -16.049  -1.407
  298    HG3  GLU  39           1HG      GLU  39   0.160 -14.801  -1.968
  299    H    GLY  40           HN       GLY  40   0.767 -17.647   1.741
  300    HA2  GLY  40           2HA      GLY  40   3.116 -18.503   2.526
  301    HA3  GLY  40           1HA      GLY  40   2.988 -17.105   3.583
  302    HA   PRO  41           HA       PRO  41   1.305 -20.690   6.008
  303    HB2  PRO  41           2HB      PRO  41   2.218 -18.812   8.124
  304    HB3  PRO  41           1HB      PRO  41   2.446 -20.559   7.997
  305    HG2  PRO  41           2HG      PRO  41   4.461 -18.890   7.523
  306    HG3  PRO  41           1HG      PRO  41   4.242 -20.353   6.541
  307    HD2  PRO  41           2HD      PRO  41   3.603 -17.507   5.881
  308    HD3  PRO  41           1HD      PRO  41   4.262 -18.785   4.839
  309    H    ARG  42           HN       ARG  42  -0.821 -20.637   6.134
  310    HA   ARG  42           HA       ARG  42  -2.509 -18.453   6.216
  311    HB2  ARG  42           2HB      ARG  42  -2.862 -21.291   7.118
  312    HB3  ARG  42           1HB      ARG  42  -4.166 -20.128   7.275
  313    HG2  ARG  42           2HG      ARG  42  -4.188 -19.772   4.882
  314    HG3  ARG  42           1HG      ARG  42  -2.806 -20.853   4.685
  315    HD2  ARG  42           2HD      ARG  42  -4.069 -22.743   5.353
  316    HD3  ARG  42           1HD      ARG  42  -5.384 -21.739   5.957
  317    HE   ARG  42           HE       ARG  42  -5.395 -21.102   3.366
  318   HH11  ARG  42          1HH1      ARG  42  -5.163 -24.230   4.915
  319   HH12  ARG  42          2HH1      ARG  42  -6.080 -25.054   3.692
  320   HH21  ARG  42          1HH2      ARG  42  -6.623 -22.171   1.753
  321   HH22  ARG  42          2HH2      ARG  42  -6.943 -23.879   1.906
  322    H    GLY  43           HN       GLY  43  -0.903 -20.036   8.887
  323    HA2  GLY  43           2HA      GLY  43  -2.461 -19.071  11.003
  324    HA3  GLY  43           1HA      GLY  43  -0.769 -19.528  11.115
  325    H    VAL  44           HN       VAL  44   0.508 -17.685   9.590
  326    HA   VAL  44           HA       VAL  44   0.595 -15.440  11.289
  327    HB   VAL  44           HB       VAL  44   1.679 -15.636   8.471
  328   HG11  VAL  44          1HG1      VAL  44   2.413 -13.819  10.762
  329   HG12  VAL  44          2HG1      VAL  44   1.602 -13.349   9.267
  330   HG13  VAL  44          3HG1      VAL  44   3.270 -13.919   9.225
  331   HG21  VAL  44          3HG2      VAL  44   3.822 -16.224   9.556
  332   HG22  VAL  44          1HG2      VAL  44   2.567 -17.445   9.793
  333   HG23  VAL  44          2HG2      VAL  44   2.974 -16.334  11.101
  334    H    LEU  45           HN       LEU  45  -0.855 -15.982   8.132
  335    HA   LEU  45           HA       LEU  45  -1.631 -13.362   7.543
  336    HB2  LEU  45           2HB      LEU  45  -3.069 -15.906   6.781
  337    HB3  LEU  45           1HB      LEU  45  -3.217 -14.353   5.981
  338    HG   LEU  45           HG       LEU  45  -0.731 -16.063   6.058
  339   HD11  LEU  45          1HD1      LEU  45  -2.681 -15.480   3.836
  340   HD12  LEU  45          2HD1      LEU  45  -2.460 -17.025   4.661
  341   HD13  LEU  45          3HD1      LEU  45  -1.164 -16.363   3.665
  342   HD21  LEU  45          3HD2      LEU  45  -0.203 -13.693   5.993
  343   HD22  LEU  45          1HD2      LEU  45  -1.296 -13.473   4.627
  344   HD23  LEU  45          2HD2      LEU  45   0.156 -14.458   4.444
  345    H    THR  46           HN       THR  46  -3.424 -15.956   9.180
  346    HA   THR  46           HA       THR  46  -5.826 -14.461   9.419
  347    HB   THR  46           HB       THR  46  -4.994 -16.840  11.095
  348    HG1  THR  46           1HG      THR  46  -4.807 -17.537   9.006
  349   HG21  THR  46          3HG2      THR  46  -7.717 -15.838  10.253
  350   HG22  THR  46          1HG2      THR  46  -7.014 -15.671  11.862
  351   HG23  THR  46          2HG2      THR  46  -7.394 -17.273  11.227
  352    H    VAL  47           HN       VAL  47  -3.155 -15.120  11.691
  353    HA   VAL  47           HA       VAL  47  -4.309 -13.868  13.932
  354    HB   VAL  47           HB       VAL  47  -1.388 -14.216  13.227
  355   HG11  VAL  47          1HG1      VAL  47  -0.948 -13.894  15.620
  356   HG12  VAL  47          2HG1      VAL  47  -2.647 -13.495  15.869
  357   HG13  VAL  47          3HG1      VAL  47  -1.634 -12.451  14.875
  358   HG21  VAL  47          3HG2      VAL  47  -1.482 -16.112  14.765
  359   HG22  VAL  47          1HG2      VAL  47  -2.606 -16.319  13.422
  360   HG23  VAL  47          2HG2      VAL  47  -3.205 -15.833  15.009
  361    H    PHE  48           HN       PHE  48  -2.217 -12.623  11.369
  362    HA   PHE  48           HA       PHE  48  -1.945  -9.999  12.372
  363    HB2  PHE  48           2HB      PHE  48  -0.462 -10.966  10.664
  364    HB3  PHE  48           1HB      PHE  48  -1.798 -11.010   9.522
  365    HD1  PHE  48           1HD      PHE  48   0.338  -8.722  11.500
  366    HD2  PHE  48           2HD      PHE  48  -2.298  -9.155   8.189
  367    HE1  PHE  48           1HE      PHE  48   0.941  -6.463  10.730
  368    HE2  PHE  48           2HE      PHE  48  -1.699  -6.899   7.412
  369    HZ   PHE  48           HZ       PHE  48  -0.078  -5.550   8.681
  370    H    ARG  49           HN       ARG  49  -4.360 -11.570  10.396
  371    HA   ARG  49           HA       ARG  49  -5.711  -9.366   9.366
  372    HB2  ARG  49           2HB      ARG  49  -5.886 -11.931   8.895
  373    HB3  ARG  49           1HB      ARG  49  -7.113 -11.898  10.152
  374    HG2  ARG  49           2HG      ARG  49  -7.591  -9.801   8.290
  375    HG3  ARG  49           1HG      ARG  49  -7.396 -11.321   7.430
  376    HD2  ARG  49           2HD      ARG  49  -9.729 -11.002   7.972
  377    HD3  ARG  49           1HD      ARG  49  -9.082 -12.342   8.918
  378    HE   ARG  49           HE       ARG  49  -8.908  -9.919  10.381
  379   HH11  ARG  49          1HH1      ARG  49 -11.220 -12.328   9.305
  380   HH12  ARG  49          2HH1      ARG  49 -12.327 -12.026  10.614
  381   HH21  ARG  49          1HH2      ARG  49 -10.353  -9.552  12.124
  382   HH22  ARG  49          2HH2      ARG  49 -11.819 -10.481  12.235
  383    H    PHE  50           HN       PHE  50  -5.606 -10.560  12.585
  384    HA   PHE  50           HA       PHE  50  -8.209  -9.602  13.351
  385    HB2  PHE  50           2HB      PHE  50  -5.890 -10.799  14.837
  386    HB3  PHE  50           1HB      PHE  50  -7.318 -10.199  15.655
  387    HD1  PHE  50           2HD      PHE  50  -9.569 -11.087  14.270
  388    HD2  PHE  50           1HD      PHE  50  -5.821 -13.063  14.682
  389    HE1  PHE  50           2HE      PHE  50 -10.667 -13.254  13.871
  390    HE2  PHE  50           1HE      PHE  50  -6.911 -15.228  14.284
  391    HZ   PHE  50           HZ       PHE  50  -9.338 -15.327  13.876
  392    H    ALA  51           HN       ALA  51  -5.051  -8.305  13.174
  393    HA   ALA  51           HA       ALA  51  -5.588  -6.231  15.142
  394    HB1  ALA  51           1HB      ALA  51  -3.115  -6.745  13.494
  395    HB2  ALA  51           2HB      ALA  51  -3.384  -7.284  15.151
  396    HB3  ALA  51           3HB      ALA  51  -3.270  -5.561  14.793
  397    H    ARG  52           HN       ARG  52  -5.390  -3.994  14.623
  398    HA   ARG  52           HA       ARG  52  -6.475  -3.304  12.058
  399    HB2  ARG  52           2HB      ARG  52  -5.703  -1.699  14.479
  400    HB3  ARG  52           1HB      ARG  52  -6.331  -0.980  13.015
  401    HG2  ARG  52           2HG      ARG  52  -8.330  -2.541  13.309
  402    HG3  ARG  52           1HG      ARG  52  -7.715  -2.797  14.945
  403    HD2  ARG  52           2HD      ARG  52  -8.510  -0.164  13.712
  404    HD3  ARG  52           1HD      ARG  52  -9.400  -1.054  14.945
  405    HE   ARG  52           HE       ARG  52  -7.158  -0.699  16.245
  406   HH11  ARG  52          1HH1      ARG  52  -8.808   1.561  14.147
  407   HH12  ARG  52          2HH1      ARG  52  -8.225   2.966  14.976
  408   HH21  ARG  52          1HH2      ARG  52  -6.361   1.149  17.338
  409   HH22  ARG  52          2HH2      ARG  52  -6.839   2.730  16.804
  410    HA   PRO  53           HA       PRO  53  -2.826  -2.447   9.920
  411    HB2  PRO  53           2HB      PRO  53  -3.774   0.084   8.854
  412    HB3  PRO  53           1HB      PRO  53  -3.522  -1.451   8.025
  413    HG2  PRO  53           2HG      PRO  53  -5.990  -0.419   8.494
  414    HG3  PRO  53           1HG      PRO  53  -5.669  -2.159   8.394
  415    HD2  PRO  53           2HD      PRO  53  -6.080  -0.441  10.801
  416    HD3  PRO  53           1HD      PRO  53  -6.610  -2.109  10.496
  417    H    SER  54           HN       SER  54  -1.002  -1.862  10.836
  418    HA   SER  54           HA       SER  54  -0.591   0.962  11.462
  419    HB2  SER  54           2HB      SER  54   0.631  -1.528  12.628
  420    HB3  SER  54           1HB      SER  54   1.271   0.074  12.895
  421    HG   SER  54           HG       SER  54  -1.366   0.058  13.370
  422    H    TYR  55           HN       TYR  55  -0.334  -1.073   9.116
  423    HA   TYR  55           HA       TYR  55   2.475  -0.716   8.438
  424    HB2  TYR  55           2HB      TYR  55   1.920  -2.264   6.534
  425    HB3  TYR  55           1HB      TYR  55   1.708  -2.962   8.135
  426    HD1  TYR  55           2HD      TYR  55   0.000  -1.811   5.099
  427    HD2  TYR  55           1HD      TYR  55  -0.502  -3.519   8.966
  428    HE1  TYR  55           2HE      TYR  55  -2.303  -2.441   4.519
  429    HE2  TYR  55           1HE      TYR  55  -2.803  -4.154   8.390
  430    HH   TYR  55           HH       TYR  55  -4.004  -4.087   5.239
  431    H    GLU  56           HN       GLU  56   3.168   0.544   6.799
  432    HA   GLU  56           HA       GLU  56   1.155   1.889   5.143
  433    HB2  GLU  56           2HB      GLU  56   3.433   3.285   6.559
  434    HB3  GLU  56           1HB      GLU  56   2.312   4.034   5.433
  435    HG2  GLU  56           2HG      GLU  56   0.464   3.546   6.980
  436    HG3  GLU  56           1HG      GLU  56   1.620   2.862   8.121
  437    H    VAL  57           HN       VAL  57   1.963   2.694   3.152
  438    HA   VAL  57           HA       VAL  57   4.387   1.311   2.228
  439    HB   VAL  57           HB       VAL  57   2.195   2.583   0.572
  440   HG11  VAL  57          1HG1      VAL  57   3.146   1.265  -1.259
  441   HG12  VAL  57          2HG1      VAL  57   4.423   0.704  -0.180
  442   HG13  VAL  57          3HG1      VAL  57   4.305   2.415  -0.594
  443   HG21  VAL  57          3HG2      VAL  57   2.565  -0.331   1.261
  444   HG22  VAL  57          1HG2      VAL  57   1.356   0.331   0.161
  445   HG23  VAL  57          2HG2      VAL  57   1.295   0.726   1.880
  446    H    PHE  58           HN       PHE  58   6.148   2.507   1.563
  447    HA   PHE  58           HA       PHE  58   5.791   5.431   1.533
  448    HB2  PHE  58           2HB      PHE  58   7.968   3.898   2.968
  449    HB3  PHE  58           1HB      PHE  58   7.975   5.639   2.729
  450    HD1  PHE  58           1HD      PHE  58   5.996   6.952   3.703
  451    HD2  PHE  58           2HD      PHE  58   6.994   2.974   4.837
  452    HE1  PHE  58           1HE      PHE  58   4.770   7.250   5.815
  453    HE2  PHE  58           2HE      PHE  58   5.767   3.260   6.948
  454    HZ   PHE  58           HZ       PHE  58   4.653   5.400   7.439
  455    H    VAL  59           HN       VAL  59   7.129   6.599   0.231
  456    HA   VAL  59           HA       VAL  59   9.326   5.215  -1.140
  457    HB   VAL  59           HB       VAL  59   7.512   7.234  -2.461
  458   HG11  VAL  59          1HG1      VAL  59   8.795   6.741  -4.482
  459   HG12  VAL  59          2HG1      VAL  59   9.831   5.659  -3.553
  460   HG13  VAL  59          3HG1      VAL  59   9.829   7.390  -3.207
  461   HG21  VAL  59          3HG2      VAL  59   7.784   4.274  -2.935
  462   HG22  VAL  59          1HG2      VAL  59   6.853   5.381  -3.942
  463   HG23  VAL  59          2HG2      VAL  59   6.375   5.104  -2.267
  464    H    ASP  60           HN       ASP  60  11.179   6.370  -1.168
  465    HA   ASP  60           HA       ASP  60  11.159   8.875   0.355
  466    HB2  ASP  60           2HB      ASP  60  13.407   6.946  -0.252
  467    HB3  ASP  60           1HB      ASP  60  13.624   8.468   0.604
  468    H    LEU  61           HN       LEU  61  11.107  10.642  -0.845
  469    HA   LEU  61           HA       LEU  61  12.800  10.760  -3.250
  470    HB2  LEU  61           2HB      LEU  61   9.957  11.727  -2.954
  471    HB3  LEU  61           1HB      LEU  61  10.992  12.119  -4.314
  472    HG   LEU  61           HG       LEU  61  10.178   9.311  -3.555
  473   HD11  LEU  61          1HD1      LEU  61   8.241  10.587  -4.280
  474   HD12  LEU  61          2HD1      LEU  61   8.707   9.406  -5.504
  475   HD13  LEU  61          3HD1      LEU  61   9.109  11.111  -5.723
  476   HD21  LEU  61          3HD2      LEU  61  11.580  10.429  -5.979
  477   HD22  LEU  61          1HD2      LEU  61  11.037   8.761  -5.791
  478   HD23  LEU  61          2HD2      LEU  61  12.291   9.404  -4.734
  479    H    THR  62           HN       THR  62  13.077  11.735  -0.447
  480    HA   THR  62           HA       THR  62  12.717  14.536  -0.354
  481    HB   THR  62           HB       THR  62  14.900  13.096   1.142
  482    HG1  THR  62           1HG      THR  62  13.310  12.419   2.636
  483   HG21  THR  62          3HG2      THR  62  14.246  14.649   2.931
  484   HG22  THR  62          1HG2      THR  62  12.991  15.316   1.885
  485   HG23  THR  62          2HG2      THR  62  14.692  15.511   1.457
  486    H    GLU  63           HN       GLU  63  15.155  12.469  -1.696
  487    HA   GLU  63           HA       GLU  63  17.018  14.679  -2.131
  488    HB2  GLU  63           2HB      GLU  63  17.271  11.718  -2.641
  489    HB3  GLU  63           1HB      GLU  63  18.536  12.885  -2.934
  490    HG2  GLU  63           2HG      GLU  63  18.772  13.329  -0.659
  491    HG3  GLU  63           1HG      GLU  63  17.282  12.494  -0.272
  492    H    ALA  64           HN       ALA  64  14.349  13.748  -3.620
  493    HA   ALA  64           HA       ALA  64  15.427  13.743  -6.348
  494    HB1  ALA  64           1HB      ALA  64  12.642  13.106  -5.373
  495    HB2  ALA  64           2HB      ALA  64  13.885  11.930  -5.799
  496    HB3  ALA  64           3HB      ALA  64  13.208  12.985  -7.038
  497    H    GLY  65           HN       GLY  65  14.916  15.310  -7.822
  498    HA2  GLY  65           2HA      GLY  65  13.472  17.644  -6.745
  499    HA3  GLY  65           1HA      GLY  65  14.833  17.756  -7.851
  500    H    GLU  66           HN       GLU  66  14.119  18.536  -9.697
  501    HA   GLU  66           HA       GLU  66  11.423  18.365 -10.554
  502    HB2  GLU  66           2HB      GLU  66  13.917  19.215 -12.025
  503    HB3  GLU  66           1HB      GLU  66  12.281  19.419 -12.635
  504    HG2  GLU  66           2HG      GLU  66  11.743  20.900 -10.814
  505    HG3  GLU  66           1HG      GLU  66  13.326  20.623 -10.085
  506    H    GLY  67           HN       GLY  67  10.696  17.529 -12.634
  507    HA2  GLY  67           2HA      GLY  67  10.750  16.051 -14.441
  508    HA3  GLY  67           1HA      GLY  67  12.272  15.406 -13.840
  509    H    SER  68           HN       SER  68  10.481  13.630 -14.695
  510    HA   SER  68           HA       SER  68   8.944  12.650 -12.449
  511    HB2  SER  68           2HB      SER  68   8.102  12.305 -14.729
  512    HB3  SER  68           1HB      SER  68   9.523  11.339 -15.110
  513    HG   SER  68           HG       SER  68   8.198   9.793 -14.494
  514    H    HIS  69           HN       HIS  69   9.481  11.048 -11.131
  515    HA   HIS  69           HA       HIS  69  12.133   9.829 -11.479
  516    HB2  HIS  69           2HB      HIS  69  10.950  10.960  -8.937
  517    HB3  HIS  69           1HB      HIS  69  12.360   9.906  -8.966
  518    HD1  HIS  69           1HD      HIS  69  14.579  10.907  -9.840
  519    HD2  HIS  69           2HD      HIS  69  11.391  13.583  -9.830
  520    HE1  HIS  69           1HE      HIS  69  15.591  13.181 -10.239
  521    HE2  HIS  69           2HE      HIS  69  13.615  14.734 -10.468
  522    H    THR  70           HN       THR  70  12.065   7.718 -11.542
  523    HA   THR  70           HA       THR  70   9.763   6.348 -10.302
  524    HB   THR  70           HB       THR  70  11.380   5.324 -12.639
  525    HG1  THR  70           1HG      THR  70   9.880   7.416 -12.722
  526   HG21  THR  70          3HG2      THR  70   8.633   4.605 -11.606
  527   HG22  THR  70          1HG2      THR  70  10.093   3.645 -11.386
  528   HG23  THR  70          2HG2      THR  70   9.434   3.886 -13.004
  529    H    VAL  71           HN       VAL  71  10.331   5.249  -8.558
  530    HA   VAL  71           HA       VAL  71  12.940   3.901  -8.475
  531    HB   VAL  71           HB       VAL  71  13.282   4.613  -6.133
  532   HG11  VAL  71          1HG1      VAL  71  14.417   5.816  -7.923
  533   HG12  VAL  71          2HG1      VAL  71  14.003   6.904  -6.597
  534   HG13  VAL  71          3HG1      VAL  71  13.040   6.909  -8.076
  535   HG21  VAL  71          3HG2      VAL  71  10.962   5.094  -5.555
  536   HG22  VAL  71          1HG2      VAL  71  10.969   6.478  -6.648
  537   HG23  VAL  71          2HG2      VAL  71  11.998   6.480  -5.217
  538    H    ASP  72           HN       ASP  72  13.058   2.376  -6.564
  539    HA   ASP  72           HA       ASP  72  10.826   0.632  -6.602
  540    HB2  ASP  72           2HB      ASP  72  13.276   0.702  -4.841
  541    HB3  ASP  72           1HB      ASP  72  12.052  -0.556  -4.728
  542    H    VAL  73           HN       VAL  73   9.464  -0.000  -4.916
  543    HA   VAL  73           HA       VAL  73   8.751   2.218  -3.142
  544    HB   VAL  73           HB       VAL  73   7.127  -0.202  -3.959
  545   HG11  VAL  73          1HG1      VAL  73   5.232   1.003  -2.975
  546   HG12  VAL  73          2HG1      VAL  73   6.332   2.264  -2.415
  547   HG13  VAL  73          3HG1      VAL  73   6.465   0.626  -1.772
  548   HG21  VAL  73          3HG2      VAL  73   7.539   1.313  -5.825
  549   HG22  VAL  73          1HG2      VAL  73   6.956   2.673  -4.863
  550   HG23  VAL  73          2HG2      VAL  73   5.849   1.380  -5.325
  551    H    GLU  74           HN       GLU  74   8.801   2.048  -0.965
  552    HA   GLU  74           HA       GLU  74   9.773  -0.486   0.154
  553    HB2  GLU  74           2HB      GLU  74  10.017   2.369   1.071
  554    HB3  GLU  74           1HB      GLU  74  10.309   1.027   2.167
  555    HG2  GLU  74           2HG      GLU  74  11.773   1.510  -0.419
  556    HG3  GLU  74           1HG      GLU  74  12.375   1.904   1.192
  557    H    HIS  75           HN       HIS  75   8.889  -1.271   2.128
  558    HA   HIS  75           HA       HIS  75   6.243  -0.184   2.809
  559    HB2  HIS  75           2HB      HIS  75   5.436  -2.554   3.109
  560    HB3  HIS  75           1HB      HIS  75   5.717  -2.070   1.443
  561    HD1  HIS  75           1HD      HIS  75   6.994  -4.384   4.100
  562    HD2  HIS  75           2HD      HIS  75   7.774  -3.408   0.135
  563    HE1  HIS  75           1HE      HIS  75   8.497  -6.206   3.238
  564    HE2  HIS  75           2HE      HIS  75   9.089  -5.502   0.888
  565    H    ARG  76           HN       ARG  76   5.583  -0.485   4.943
  566    HA   ARG  76           HA       ARG  76   7.493  -1.688   6.802
  567    HB2  ARG  76           2HB      ARG  76   7.878   0.857   6.451
  568    HB3  ARG  76           1HB      ARG  76   6.385   1.056   7.354
  569    HG2  ARG  76           2HG      ARG  76   7.364  -0.079   9.266
  570    HG3  ARG  76           1HG      ARG  76   8.852  -0.353   8.356
  571    HD2  ARG  76           2HD      ARG  76   8.978   2.160   8.075
  572    HD3  ARG  76           1HD      ARG  76   7.692   2.265   9.275
  573    HE   ARG  76           HE       ARG  76   9.569   0.745  10.515
  574   HH11  ARG  76          1HH1      ARG  76   9.636   3.853   8.918
  575   HH12  ARG  76          2HH1      ARG  76  10.922   4.488   9.899
  576   HH21  ARG  76          1HH2      ARG  76  11.293   1.554  11.796
  577   HH22  ARG  76          2HH2      ARG  76  11.907   3.158  11.498
  578    H    GLY  77           HN       GLY  77   6.525  -2.276   8.814
  579    HA2  GLY  77           2HA      GLY  77   4.522  -2.271  10.236
  580    HA3  GLY  77           1HA      GLY  77   3.569  -2.200   8.757
  581    H    PHE  78           HN       PHE  78   3.699  -4.067   7.289
  582    HA   PHE  78           HA       PHE  78   4.019  -6.569   8.693
  583    HB2  PHE  78           2HB      PHE  78   3.371  -7.589   6.494
  584    HB3  PHE  78           1HB      PHE  78   2.190  -6.453   7.129
  585    HD1  PHE  78           1HD      PHE  78   1.822  -4.305   6.047
  586    HD2  PHE  78           2HD      PHE  78   4.601  -7.117   4.477
  587    HE1  PHE  78           1HE      PHE  78   1.853  -3.079   3.913
  588    HE2  PHE  78           2HE      PHE  78   4.640  -5.892   2.345
  589    HZ   PHE  78           HZ       PHE  78   3.266  -3.873   2.059
  590    HA   PRO  79           HA       PRO  79   8.214  -7.037   7.482
  591    HB2  PRO  79           2HB      PRO  79   8.635  -9.544   8.294
  592    HB3  PRO  79           1HB      PRO  79   8.255  -8.260   9.450
  593    HG2  PRO  79           2HG      PRO  79   6.492 -10.408   8.351
  594    HG3  PRO  79           1HG      PRO  79   6.557  -9.737   9.988
  595    HD2  PRO  79           2HD      PRO  79   4.715  -9.023   8.021
  596    HD3  PRO  79           1HD      PRO  79   5.091  -8.079   9.476
  597    H    GLY  80           HN       GLY  80   9.648  -8.121   6.037
  598    HA2  GLY  80           2HA      GLY  80   8.368  -9.320   3.730
  599    HA3  GLY  80           1HA      GLY  80  10.082  -8.972   3.916
  600    H    ASP  81           HN       ASP  81   8.059 -10.815   6.106
  601    HA   ASP  81           HA       ASP  81   9.889 -13.049   6.028
  602    HB2  ASP  81           2HB      ASP  81   8.750 -12.168   8.133
  603    HB3  ASP  81           1HB      ASP  81   7.269 -12.871   7.505
  604    H    LEU  82           HN       LEU  82   6.582 -12.315   5.182
  605    HA   LEU  82           HA       LEU  82   6.131 -14.950   4.039
  606    HB2  LEU  82           2HB      LEU  82   4.295 -12.554   4.040
  607    HB3  LEU  82           1HB      LEU  82   3.856 -14.225   3.754
  608    HG   LEU  82           HG       LEU  82   4.830 -13.117   6.386
  609   HD11  LEU  82          1HD1      LEU  82   2.608 -12.289   5.759
  610   HD12  LEU  82          2HD1      LEU  82   2.549 -13.378   7.143
  611   HD13  LEU  82          3HD1      LEU  82   2.060 -13.953   5.550
  612   HD21  LEU  82          3HD2      LEU  82   3.766 -15.839   5.647
  613   HD22  LEU  82          1HD2      LEU  82   4.119 -15.286   7.284
  614   HD23  LEU  82          2HD2      LEU  82   5.424 -15.452   6.109
  615    H    ALA  83           HN       ALA  83   4.907 -14.815   1.811
  616    HA   ALA  83           HA       ALA  83   6.636 -13.344  -0.001
  617    HB1  ALA  83           1HB      ALA  83   5.504 -14.584  -1.768
  618    HB2  ALA  83           2HB      ALA  83   4.359 -15.231  -0.594
  619    HB3  ALA  83           3HB      ALA  83   6.063 -15.675  -0.500
  620    H    VAL  84           HN       VAL  84   6.141 -11.247  -0.075
  621    HA   VAL  84           HA       VAL  84   3.314 -10.457  -0.102
  622    HB   VAL  84           HB       VAL  84   5.762  -8.719   0.282
  623   HG11  VAL  84          1HG1      VAL  84   4.145  -7.042   1.072
  624   HG12  VAL  84          2HG1      VAL  84   2.827  -8.127   0.634
  625   HG13  VAL  84          3HG1      VAL  84   3.886  -7.478  -0.618
  626   HG21  VAL  84          3HG2      VAL  84   5.477 -10.315   2.121
  627   HG22  VAL  84          1HG2      VAL  84   3.814  -9.766   2.337
  628   HG23  VAL  84          2HG2      VAL  84   5.154  -8.659   2.642
  629    H    THR  85           HN       THR  85   2.390  -9.863  -1.957
  630    HA   THR  85           HA       THR  85   4.169  -9.212  -4.202
  631    HB   THR  85           HB       THR  85   1.282  -9.949  -4.501
  632    HG1  THR  85           1HG      THR  85   2.000 -11.766  -3.514
  633   HG21  THR  85          3HG2      THR  85   3.676 -10.269  -6.312
  634   HG22  THR  85          1HG2      THR  85   2.458  -8.999  -6.430
  635   HG23  THR  85          2HG2      THR  85   2.010 -10.682  -6.714
  636    H    VAL  86           HN       VAL  86   4.170  -7.267  -4.906
  637    HA   VAL  86           HA       VAL  86   1.903  -5.433  -4.426
  638    HB   VAL  86           HB       VAL  86   4.308  -4.079  -5.308
  639   HG11  VAL  86          1HG1      VAL  86   2.773  -3.931  -2.707
  640   HG12  VAL  86          2HG1      VAL  86   2.455  -3.001  -4.171
  641   HG13  VAL  86          3HG1      VAL  86   3.953  -2.751  -3.276
  642   HG21  VAL  86          3HG2      VAL  86   4.685  -5.775  -2.837
  643   HG22  VAL  86          1HG2      VAL  86   5.703  -4.404  -3.285
  644   HG23  VAL  86          2HG2      VAL  86   5.618  -5.813  -4.338
  645    H    GLU  87           HN       GLU  87   1.285  -4.149  -6.458
  646    HA   GLU  87           HA       GLU  87   3.633  -4.216  -8.174
  647    HB2  GLU  87           2HB      GLU  87   1.920  -5.820  -9.075
  648    HB3  GLU  87           1HB      GLU  87   0.909  -4.416  -9.397
  649    HG2  GLU  87           2HG      GLU  87   2.544  -3.502 -10.894
  650    HG3  GLU  87           1HG      GLU  87   3.684  -4.785 -10.493
  651    HA   PRO  88           HA       PRO  88   4.018  -1.133  -9.832
  652    HB2  PRO  88           2HB      PRO  88   5.197   0.779  -8.336
  653    HB3  PRO  88           1HB      PRO  88   3.490   0.849  -8.750
  654    HG2  PRO  88           2HG      PRO  88   4.698   0.424  -6.146
  655    HG3  PRO  88           1HG      PRO  88   2.987   0.667  -6.535
  656    HD2  PRO  88           2HD      PRO  88   4.486  -1.869  -6.134
  657    HD3  PRO  88           1HD      PRO  88   2.742  -1.551  -5.967
  658    H    ARG  89           HN       ARG  89   6.038  -1.819 -10.509
  659    HA   ARG  89           HA       ARG  89   7.613  -3.258  -8.539
  660    HB2  ARG  89           2HB      ARG  89   8.218  -2.644 -11.453
  661    HB3  ARG  89           1HB      ARG  89   9.232  -3.637 -10.415
  662    HG2  ARG  89           2HG      ARG  89   7.099  -5.022 -10.043
  663    HG3  ARG  89           1HG      ARG  89   6.514  -4.211 -11.496
  664    HD2  ARG  89           2HD      ARG  89   8.552  -4.939 -12.671
  665    HD3  ARG  89           1HD      ARG  89   9.029  -5.838 -11.238
  666    HE   ARG  89           HE       ARG  89   6.423  -6.493 -12.361
  667   HH11  ARG  89          1HH1      ARG  89   9.825  -7.314 -12.066
  668   HH12  ARG  89          2HH1      ARG  89   9.610  -8.940 -12.657
  669   HH21  ARG  89          1HH2      ARG  89   6.137  -8.627 -13.099
  670   HH22  ARG  89          2HH2      ARG  89   7.508  -9.685 -13.238
  671    H    MET  90           HN       MET  90   7.764  -0.381 -10.461
  672    HA   MET  90           HA       MET  90   9.188   0.931  -8.278
  673    HB2  MET  90           2HB      MET  90   9.760   1.262 -11.235
  674    HB3  MET  90           1HB      MET  90  10.275   2.424 -10.020
  675    HG2  MET  90           2HG      MET  90  11.591   0.663  -8.922
  676    HG3  MET  90           1HG      MET  90  11.104  -0.465 -10.188
  677    HE1  MET  90           3HE      MET  90  14.911   0.248 -10.888
  678    HE2  MET  90           1HE      MET  90  13.708  -0.994 -10.551
  679    HE3  MET  90           2HE      MET  90  14.119   0.191  -9.312
  680    H    ALA  91           HN       ALA  91   8.588   3.244  -8.179
  681    HA   ALA  91           HA       ALA  91   5.920   3.640  -9.383
  682    HB1  ALA  91           1HB      ALA  91   5.775   3.231  -6.978
  683    HB2  ALA  91           2HB      ALA  91   5.296   4.882  -7.373
  684    HB3  ALA  91           3HB      ALA  91   6.886   4.566  -6.678
  685    H    ARG  92           HN       ARG  92   5.398   5.678 -10.130
  686    HA   ARG  92           HA       ARG  92   7.748   7.375 -10.559
  687    HB2  ARG  92           2HB      ARG  92   6.856   8.035 -12.647
  688    HB3  ARG  92           1HB      ARG  92   6.647   6.295 -12.566
  689    HG2  ARG  92           2HG      ARG  92   4.292   6.610 -11.978
  690    HG3  ARG  92           1HG      ARG  92   4.510   8.359 -12.063
  691    HD2  ARG  92           2HD      ARG  92   5.375   7.863 -14.463
  692    HD3  ARG  92           1HD      ARG  92   4.517   6.336 -14.268
  693    HE   ARG  92           HE       ARG  92   3.116   8.894 -13.838
  694   HH11  ARG  92          1HH1      ARG  92   3.458   5.875 -15.603
  695   HH12  ARG  92          2HH1      ARG  92   1.995   6.112 -16.521
  696   HH21  ARG  92          1HH2      ARG  92   1.201   9.183 -14.998
  697   HH22  ARG  92          2HH2      ARG  92   0.689   7.981 -16.153
  698    H    VAL  93           HN       VAL  93   7.795   9.259  -9.641
  699    HA   VAL  93           HA       VAL  93   5.296  10.750  -9.240
  700    HB   VAL  93           HB       VAL  93   7.546  10.574  -7.215
  701   HG11  VAL  93          1HG1      VAL  93   4.981  12.159  -7.130
  702   HG12  VAL  93          2HG1      VAL  93   6.603  12.819  -7.326
  703   HG13  VAL  93          3HG1      VAL  93   6.152  12.025  -5.819
  704   HG21  VAL  93          3HG2      VAL  93   5.866   9.583  -5.731
  705   HG22  VAL  93          1HG2      VAL  93   6.120   8.600  -7.175
  706   HG23  VAL  93          2HG2      VAL  93   4.690   9.624  -7.046
  707    H    GLN  94           HN       GLN  94   5.437  12.690 -10.201
  708    HA   GLN  94           HA       GLN  94   8.143  13.637 -10.853
  709    HB2  GLN  94           2HB      GLN  94   7.101  14.942 -12.688
  710    HB3  GLN  94           1HB      GLN  94   6.941  13.204 -12.873
  711    HG2  GLN  94           2HG      GLN  94   4.638  13.297 -12.181
  712    HG3  GLN  94           1HG      GLN  94   4.776  15.018 -11.836
  713   HE21  GLN  94          1HE2      GLN  94   2.994  13.639 -13.658
  714   HE22  GLN  94          2HE2      GLN  94   3.280  14.334 -15.207
  715    H    LEU  95           HN       LEU  95   8.852  15.473 -10.097
  716    HA   LEU  95           HA       LEU  95   6.975  17.173  -8.584
  717    HB2  LEU  95           2HB      LEU  95   9.929  16.748  -8.096
  718    HB3  LEU  95           1HB      LEU  95   8.859  17.762  -7.143
  719    HG   LEU  95           HG       LEU  95   8.646  14.756  -7.383
  720   HD11  LEU  95          1HD1      LEU  95   9.427  14.738  -5.059
  721   HD12  LEU  95          2HD1      LEU  95   9.669  16.483  -5.132
  722   HD13  LEU  95          3HD1      LEU  95  10.635  15.416  -6.150
  723   HD21  LEU  95          3HD2      LEU  95   7.026  14.947  -5.563
  724   HD22  LEU  95          1HD2      LEU  95   6.484  15.830  -6.991
  725   HD23  LEU  95          2HD2      LEU  95   7.162  16.704  -5.616
  726    H    GLU  96           HN       GLU  96   6.992  19.330  -8.973
  727    HA   GLU  96           HA       GLU  96   9.117  20.402 -10.689
  728    HB2  GLU  96           2HB      GLU  96   6.155  20.915 -11.004
  729    HB3  GLU  96           1HB      GLU  96   7.404  21.870 -11.788
  730    HG2  GLU  96           2HG      GLU  96   8.213  19.654 -12.776
  731    HG3  GLU  96           1HG      GLU  96   6.653  19.013 -12.266
  732    H    GLU  97           HN       GLU  97   9.748  22.472 -10.268
  733    HA   GLU  97           HA       GLU  97   9.431  23.465  -7.648
  734    HB2  GLU  97           2HB      GLU  97  11.092  23.978  -9.827
  735    HB3  GLU  97           1HB      GLU  97  10.196  25.475  -9.623
  736    HG2  GLU  97           2HG      GLU  97  11.609  24.124  -7.348
  737    HG3  GLU  97           1HG      GLU  97  12.408  25.279  -8.411
  738    H    ARG  98           HN       ARG  98   8.040  24.972  -6.812
  739    HA   ARG  98           HA       ARG  98   5.572  25.210  -8.191
  740    HB2  ARG  98           2HB      ARG  98   4.895  26.511  -6.182
  741    HB3  ARG  98           1HB      ARG  98   5.474  24.899  -5.842
  742    HG2  ARG  98           2HG      ARG  98   7.566  25.766  -5.063
  743    HG3  ARG  98           1HG      ARG  98   7.116  27.401  -5.555
  744    HD2  ARG  98           2HD      ARG  98   6.853  26.830  -3.084
  745    HD3  ARG  98           1HD      ARG  98   5.468  27.566  -3.888
  746    HE   ARG  98           HE       ARG  98   5.290  24.735  -4.003
  747   HH11  ARG  98          1HH1      ARG  98   4.878  27.418  -1.771
  748   HH12  ARG  98          2HH1      ARG  98   3.689  26.587  -0.808
  749   HH21  ARG  98          1HH2      ARG  98   3.745  23.665  -2.771
  750   HH22  ARG  98          2HH2      ARG  98   3.051  24.434  -1.367
  751    H    GLN  99           HN       GLN  99   4.488  27.543  -7.798
  752    HA   GLN  99           HA       GLN  99   5.415  28.974  -9.996
  753    HB2  GLN  99           2HB      GLN  99   3.083  28.959  -9.029
  754    HB3  GLN  99           1HB      GLN  99   3.663  30.090  -7.814
  755    HG2  GLN  99           2HG      GLN  99   4.144  31.736  -9.486
  756    HG3  GLN  99           1HG      GLN  99   3.778  30.591 -10.778
  757   HE21  GLN  99          1HE2      GLN  99   2.168  31.881 -11.648
  758   HE22  GLN  99          2HE2      GLN  99   0.638  32.097 -10.869
  759    H    THR 100           HN       THR 100   5.675  29.771  -6.544
  760    HA   THR 100           HA       THR 100   8.311  30.757  -6.947
  761    HB   THR 100           HB       THR 100   7.200  32.732  -7.774
  762    HG1  THR 100           1HG      THR 100   9.074  32.975  -6.411
  763   HG21  THR 100          3HG2      THR 100   5.741  32.798  -5.129
  764   HG22  THR 100          1HG2      THR 100   5.024  32.528  -6.718
  765   HG23  THR 100          2HG2      THR 100   5.733  34.095  -6.324
  766    H    VAL 101           HN       VAL 101   9.173  29.685  -5.314
  767    HA   VAL 101           HA       VAL 101   8.035  29.314  -2.768
  768    HB   VAL 101           HB       VAL 101  10.462  28.917  -2.038
  769   HG11  VAL 101          1HG1      VAL 101   9.318  27.337  -4.336
  770   HG12  VAL 101          2HG1      VAL 101   8.962  27.104  -2.624
  771   HG13  VAL 101          3HG1      VAL 101  10.581  26.775  -3.241
  772   HG21  VAL 101          3HG2      VAL 101  11.540  30.281  -3.759
  773   HG22  VAL 101          1HG2      VAL 101  10.923  29.201  -5.005
  774   HG23  VAL 101          2HG2      VAL 101  12.095  28.609  -3.828
  775    H    SER 102           HN       SER 102   7.296  31.079  -1.761
  776    HA   SER 102           HA       SER 102   9.143  33.336  -1.390
  777    HB2  SER 102           2HB      SER 102   6.810  34.498  -0.886
  778    HB3  SER 102           1HB      SER 102   7.408  34.307  -2.535
  779    HG   SER 102           HG       SER 102   6.113  32.452  -2.736
  780    H    VAL 103           HN       VAL 103   8.545  30.788   0.210
  781    HA   VAL 103           HA       VAL 103   8.002  32.117   2.773
  782    HB   VAL 103           HB       VAL 103   6.328  30.451   2.365
  783   HG11  VAL 103          1HG1      VAL 103   8.562  28.469   1.964
  784   HG12  VAL 103          2HG1      VAL 103   7.491  29.098   0.711
  785   HG13  VAL 103          3HG1      VAL 103   6.838  28.089   2.002
  786   HG21  VAL 103          3HG2      VAL 103   8.346  29.427   4.354
  787   HG22  VAL 103          1HG2      VAL 103   6.644  28.963   4.291
  788   HG23  VAL 103          2HG2      VAL 103   7.091  30.630   4.658
  789    HA   PRO 104           HA       PRO 104  12.396  31.344   3.442
  790    HB2  PRO 104           2HB      PRO 104  11.771  32.630   6.027
  791    HB3  PRO 104           1HB      PRO 104  12.960  33.087   4.804
  792    HG2  PRO 104           2HG      PRO 104  10.732  34.526   5.183
  793    HG3  PRO 104           1HG      PRO 104  11.429  34.297   3.569
  794    HD2  PRO 104           2HD      PRO 104   9.081  32.928   4.827
  795    HD3  PRO 104           1HD      PRO 104   9.284  33.527   3.167
  796    H    VAL 105           HN       VAL 105  13.270  29.553   4.317
  797    HA   VAL 105           HA       VAL 105  11.607  28.044   6.204
  798    HB   VAL 105           HB       VAL 105  14.015  27.061   4.663
  799   HG11  VAL 105          1HG1      VAL 105  13.517  25.740   6.633
  800   HG12  VAL 105          2HG1      VAL 105  13.107  24.839   5.173
  801   HG13  VAL 105          3HG1      VAL 105  11.834  25.591   6.132
  802   HG21  VAL 105          3HG2      VAL 105  12.267  27.769   3.112
  803   HG22  VAL 105          1HG2      VAL 105  11.085  26.795   3.986
  804   HG23  VAL 105          2HG2      VAL 105  12.413  26.010   3.131
  805    H    THR 106           HN       THR 106  12.080  28.658   8.239
  806    HA   THR 106           HA       THR 106  14.856  28.934   9.078
  807    HB   THR 106           HB       THR 106  12.359  29.143  10.772
  808    HG1  THR 106           1HG      THR 106  13.720  31.024   9.142
  809   HG21  THR 106          3HG2      THR 106  14.402  28.770  12.048
  810   HG22  THR 106          1HG2      THR 106  13.822  30.418  12.286
  811   HG23  THR 106          2HG2      THR 106  15.187  30.111  11.210
  812    H    VAL 107           HN       VAL 107  15.901  27.080   9.420
  813    HA   VAL 107           HA       VAL 107  14.413  24.764  10.437
  814    HB   VAL 107           HB       VAL 107  17.226  24.805   9.330
  815   HG11  VAL 107          1HG1      VAL 107  15.274  22.544   9.773
  816   HG12  VAL 107          2HG1      VAL 107  16.729  22.868  10.716
  817   HG13  VAL 107          3HG1      VAL 107  16.864  22.394   9.023
  818   HG21  VAL 107          3HG2      VAL 107  14.654  24.169   7.891
  819   HG22  VAL 107          1HG2      VAL 107  16.278  23.982   7.233
  820   HG23  VAL 107          2HG2      VAL 107  15.666  25.588   7.623
  821    H    GLU 108           HN       GLU 108  15.008  23.706  12.321
  822    HA   GLU 108           HA       GLU 108  16.619  25.204  14.195
  823    HB2  GLU 108           2HB      GLU 108  15.046  22.645  14.424
  824    HB3  GLU 108           1HB      GLU 108  16.017  23.286  15.740
  825    HG2  GLU 108           2HG      GLU 108  14.664  25.381  15.609
  826    HG3  GLU 108           1HG      GLU 108  13.614  24.553  14.457
  827    H    MET 109           HN       MET 109  18.004  24.132  11.925
  828    HA   MET 109           HA       MET 109  19.526  21.856  12.795
  829    HB2  MET 109           2HB      MET 109  19.128  22.368  10.386
  830    HB3  MET 109           1HB      MET 109  20.114  23.811  10.559
  831    HG2  MET 109           2HG      MET 109  22.059  22.475  11.046
  832    HG3  MET 109           1HG      MET 109  21.091  21.002  11.016
  833    HE1  MET 109           3HE      MET 109  23.785  21.424   9.320
  834    HE2  MET 109           1HE      MET 109  23.302  20.682   7.793
  835    HE3  MET 109           2HE      MET 109  22.833  19.938   9.324
  836    H    ILE 110           HN       ILE 110  21.468  21.855  13.820
  837    HA   ILE 110           HA       ILE 110  22.075  24.252  15.280
  838    HB   ILE 110           HB       ILE 110  23.576  21.630  15.338
  839   HG12  ILE 110          2HG1      ILE 110  21.287  22.565  17.085
  840   HG13  ILE 110          1HG1      ILE 110  21.148  21.363  15.811
  841   HG21  ILE 110          1HG2      ILE 110  24.243  22.381  17.588
  842   HG22  ILE 110          2HG2      ILE 110  23.409  23.911  17.311
  843   HG23  ILE 110          3HG2      ILE 110  24.807  23.476  16.325
  844   HD11  ILE 110          3HD1      ILE 110  21.276  20.322  17.996
  845   HD12  ILE 110          1HD1      ILE 110  22.830  21.101  18.286
  846   HD13  ILE 110          2HD1      ILE 110  22.676  19.895  17.009
  847    H    ASN 111           HN       ASN 111  22.624  25.494  13.357
  848    HA   ASN 111           HA       ASN 111  25.502  25.235  12.757
  849    HB2  ASN 111           2HB      ASN 111  23.291  26.374  11.030
  850    HB3  ASN 111           1HB      ASN 111  25.004  26.560  10.675
  851   HD21  ASN 111          1HD2      ASN 111  25.637  23.839  11.630
  852   HD22  ASN 111          2HD2      ASN 111  25.083  22.780  10.380
  853    H    LEU 112           HN       LEU 112  23.444  26.760  14.644
  854    HA   LEU 112           HA       LEU 112  24.976  29.232  14.711
  855    HB2  LEU 112           2HB      LEU 112  22.898  29.461  13.214
  856    HB3  LEU 112           1HB      LEU 112  21.960  29.298  14.682
  857    HG   LEU 112           HG       LEU 112  24.031  31.462  14.396
  858   HD11  LEU 112          1HD1      LEU 112  22.250  32.950  13.637
  859   HD12  LEU 112          2HD1      LEU 112  21.135  31.586  13.564
  860   HD13  LEU 112          3HD1      LEU 112  22.528  31.645  12.484
  861   HD21  LEU 112          3HD2      LEU 112  22.593  32.604  16.026
  862   HD22  LEU 112          1HD2      LEU 112  23.173  31.054  16.637
  863   HD23  LEU 112          2HD2      LEU 112  21.518  31.205  16.048
  864    H    GLU 113           HN       GLU 113  25.720  29.149  16.735
  865    HA   GLU 113           HA       GLU 113  24.313  27.780  18.827
  866    HB2  GLU 113           2HB      GLU 113  26.786  27.772  18.634
  867    HB3  GLU 113           1HB      GLU 113  26.803  29.495  18.974
  868    HG2  GLU 113           2HG      GLU 113  27.388  28.136  20.927
  869    HG3  GLU 113           1HG      GLU 113  25.941  29.108  21.190
  870    H    HIS 114           HN       HIS 114  23.888  28.797  20.937
  871    HA   HIS 114           HA       HIS 114  22.838  30.300  22.270
  872    HB2  HIS 114           2HB      HIS 114  23.836  32.223  20.189
  873    HB3  HIS 114           1HB      HIS 114  22.711  32.758  21.432
  874    HD1  HIS 114           1HD      HIS 114  26.261  32.170  20.801
  875    HD2  HIS 114           2HD      HIS 114  23.766  32.437  24.123
  876    HE1  HIS 114           1HE      HIS 114  27.783  32.534  22.774
  877    HE2  HIS 114           2HE      HIS 114  26.238  32.878  24.740
  878    H    HIS 115           HN       HIS 115  21.633  28.768  20.075
  879    HA   HIS 115           HA       HIS 115  19.325  30.285  19.251
  880    HB2  HIS 115           2HB      HIS 115  20.275  28.330  17.956
  881    HB3  HIS 115           1HB      HIS 115  19.665  27.273  19.225
  882    HD1  HIS 115           1HD      HIS 115  17.407  26.330  18.756
  883    HD2  HIS 115           2HD      HIS 115  18.038  29.940  16.785
  884    HE1  HIS 115           1HE      HIS 115  15.350  26.714  17.362
  885    HE2  HIS 115           2HE      HIS 115  15.679  28.986  16.324
  886    H    HIS 116           HN       HIS 116  20.290  28.309  21.917
  887    HA   HIS 116           HA       HIS 116  17.672  27.883  22.994
  888    HB2  HIS 116           2HB      HIS 116  20.439  27.645  24.171
  889    HB3  HIS 116           1HB      HIS 116  18.986  27.355  25.121
  890    HD1  HIS 116           1HD      HIS 116  21.424  25.404  23.742
  891    HD2  HIS 116           2HD      HIS 116  17.295  25.440  23.211
  892    HE1  HIS 116           1HE      HIS 116  20.821  23.103  22.910
  893    HE2  HIS 116           2HE      HIS 116  18.304  23.110  22.708
  894    H    HIS 117           HN       HIS 117  16.524  29.078  24.367
  895    HA   HIS 117           HA       HIS 117  17.679  31.441  25.621
  896    HB2  HIS 117           2HB      HIS 117  16.899  32.178  23.371
  897    HB3  HIS 117           1HB      HIS 117  15.286  31.607  23.771
  898    HD1  HIS 117           1HD      HIS 117  13.762  33.275  24.832
  899    HD2  HIS 117           2HD      HIS 117  17.762  34.390  25.094
  900    HE1  HIS 117           1HE      HIS 117  13.757  35.600  25.773
  901    HE2  HIS 117           2HE      HIS 117  16.161  36.339  25.664
  902    H    HIS 118           HN       HIS 118  14.600  29.849  24.879
  903    HA   HIS 118           HA       HIS 118  14.109  29.053  27.562
  904    HB2  HIS 118           2HB      HIS 118  13.484  31.687  27.191
  905    HB3  HIS 118           1HB      HIS 118  11.972  30.927  26.713
  906    HD1  HIS 118           1HD      HIS 118  13.707  32.175  29.605
  907    HD2  HIS 118           2HD      HIS 118  10.975  29.120  28.882
  908    HE1  HIS 118           1HE      HIS 118  12.697  31.621  31.839
  909    HE2  HIS 118           2HE      HIS 118  10.917  29.905  31.346
  910    H    HIS 119           HN       HIS 119  11.485  28.440  27.518
  911    HA   HIS 119           HA       HIS 119  11.017  27.297  24.851
  912    HB2  HIS 119           2HB      HIS 119  10.575  26.035  27.550
  913    HB3  HIS 119           1HB      HIS 119   9.793  25.435  26.090
  914    HD1  HIS 119           1HD      HIS 119  11.572  24.774  24.099
  915    HD2  HIS 119           2HD      HIS 119  13.016  24.961  27.998
  916    HE1  HIS 119           1HE      HIS 119  13.726  23.473  24.092
  917    HE2  HIS 119           2HE      HIS 119  14.441  23.404  26.509
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1  -6.212 -31.030   9.000
    2    H2   MET   1           H2       MET   1  -4.649 -30.779   9.610
    3    H3   MET   1           H3       MET   1  -4.981 -32.157   8.680
    4    HA   MET   1           HA       MET   1  -5.458 -30.735   6.765
    5    HB2  MET   1           2HB      MET   1  -4.484 -28.590   8.662
    6    HB3  MET   1           1HB      MET   1  -4.611 -28.372   6.924
    7    HG2  MET   1           2HG      MET   1  -7.017 -28.776   7.054
    8    HG3  MET   1           1HG      MET   1  -6.880 -28.972   8.801
    9    HE1  MET   1           2HE      MET   1  -8.846 -26.897   7.247
   10    HE2  MET   1           3HE      MET   1  -8.712 -25.510   8.328
   11    HE3  MET   1           1HE      MET   1  -8.834 -27.139   8.993
   12    HA   PRO   2           HA       PRO   2  -1.153 -31.539   5.903
   13    HB2  PRO   2           2HB      PRO   2  -1.357 -30.032   3.429
   14    HB3  PRO   2           1HB      PRO   2  -1.236 -31.777   3.648
   15    HG2  PRO   2           2HG      PRO   2  -3.481 -30.540   2.728
   16    HG3  PRO   2           1HG      PRO   2  -3.509 -32.069   3.627
   17    HD2  PRO   2           2HD      PRO   2  -4.061 -29.286   4.593
   18    HD3  PRO   2           1HD      PRO   2  -4.901 -30.803   4.984
   19    H    THR   3           HN       THR   3   0.808 -30.253   5.009
   20    HA   THR   3           HA       THR   3   0.906 -27.711   6.411
   21    HB   THR   3           HB       THR   3   3.148 -29.056   4.957
   22    HG1  THR   3           1HG      THR   3   2.890 -30.594   6.409
   23   HG21  THR   3          3HG2      THR   3   3.126 -27.152   7.300
   24   HG22  THR   3          1HG2      THR   3   3.591 -26.752   5.646
   25   HG23  THR   3          2HG2      THR   3   4.565 -27.881   6.588
   26    H    PHE   4           HN       PHE   4  -0.292 -28.489   3.742
   27    HA   PHE   4           HA       PHE   4   0.909 -26.566   1.943
   28    HB2  PHE   4           2HB      PHE   4  -1.028 -28.795   1.694
   29    HB3  PHE   4           1HB      PHE   4  -1.080 -27.528   0.487
   30    HD1  PHE   4           1HD      PHE   4   0.944 -30.218   1.939
   31    HD2  PHE   4           2HD      PHE   4   0.660 -27.281  -1.130
   32    HE1  PHE   4           1HE      PHE   4   2.824 -31.275   0.757
   33    HE2  PHE   4           2HE      PHE   4   2.538 -28.336  -2.318
   34    HZ   PHE   4           HZ       PHE   4   3.623 -30.332  -1.374
   35    H    ASP   5           HN       ASP   5  -1.360 -25.813   0.519
   36    HA   ASP   5           HA       ASP   5  -2.937 -24.225   0.381
   37    HB2  ASP   5           2HB      ASP   5  -4.198 -25.736   1.903
   38    HB3  ASP   5           1HB      ASP   5  -3.533 -24.866   3.274
   39    H    HIS   6           HN       HIS   6  -0.508 -23.293   0.578
   40    HA   HIS   6           HA       HIS   6  -0.022 -21.327   2.495
   41    HB2  HIS   6           2HB      HIS   6   1.190 -20.109   0.605
   42    HB3  HIS   6           1HB      HIS   6   1.738 -21.744   0.951
   43    HD1  HIS   6           1HD      HIS   6   0.463 -19.611  -1.771
   44    HD2  HIS   6           2HD      HIS   6   0.872 -23.688  -1.023
   45    HE1  HIS   6           1HE      HIS   6   0.229 -20.742  -4.001
   46    HE2  HIS   6           2HE      HIS   6   0.672 -23.180  -3.551
   47    H    GLY   7           HN       GLY   7  -1.269 -19.724   3.101
   48    HA2  GLY   7           2HA      GLY   7  -3.709 -19.220   1.744
   49    HA3  GLY   7           1HA      GLY   7  -3.137 -18.412   3.198
   50    H    ASN   8           HN       ASN   8  -4.483 -17.284   0.961
   51    HA   ASN   8           HA       ASN   8  -2.433 -15.344   0.083
   52    HB2  ASN   8           2HB      ASN   8  -5.019 -16.135  -1.274
   53    HB3  ASN   8           1HB      ASN   8  -4.056 -14.757  -1.753
   54   HD21  ASN   8          1HD2      ASN   8  -2.547 -17.724  -0.725
   55   HD22  ASN   8          2HD2      ASN   8  -1.957 -18.179  -2.285
   56    H    LEU   9           HN       LEU   9  -3.115 -13.155   0.067
   57    HA   LEU   9           HA       LEU   9  -5.606 -12.502   1.430
   58    HB2  LEU   9           2HB      LEU   9  -3.919 -12.784   3.221
   59    HB3  LEU   9           1HB      LEU   9  -2.928 -11.559   2.454
   60    HG   LEU   9           HG       LEU   9  -4.691  -9.883   2.855
   61   HD11  LEU   9          1HD1      LEU   9  -6.088 -12.129   4.304
   62   HD12  LEU   9          2HD1      LEU   9  -6.630 -11.349   2.818
   63   HD13  LEU   9          3HD1      LEU   9  -6.570 -10.434   4.325
   64   HD21  LEU   9          3HD2      LEU   9  -4.429  -9.750   5.287
   65   HD22  LEU   9          1HD2      LEU   9  -2.909 -10.152   4.487
   66   HD23  LEU   9          2HD2      LEU   9  -3.833 -11.410   5.310
   67    H    SER  10           HN       SER  10  -6.527 -10.885   0.432
   68    HA   SER  10           HA       SER  10  -4.971  -9.300  -1.450
   69    HB2  SER  10           2HB      SER  10  -7.974  -9.411  -1.074
   70    HB3  SER  10           1HB      SER  10  -7.102  -8.710  -2.437
   71    HG   SER  10           HG       SER  10  -6.297 -10.825  -2.892
   72    H    LEU  11           HN       LEU  11  -4.032  -7.584  -0.495
   73    HA   LEU  11           HA       LEU  11  -5.371  -6.037   1.539
   74    HB2  LEU  11           2HB      LEU  11  -2.863  -5.505  -0.058
   75    HB3  LEU  11           1HB      LEU  11  -3.431  -4.492   1.253
   76    HG   LEU  11           HG       LEU  11  -2.602  -7.385   1.547
   77   HD11  LEU  11          1HD1      LEU  11  -1.152  -4.837   2.253
   78   HD12  LEU  11          2HD1      LEU  11  -0.687  -5.993   1.009
   79   HD13  LEU  11          3HD1      LEU  11  -0.638  -6.461   2.709
   80   HD21  LEU  11          3HD2      LEU  11  -2.708  -6.930   3.939
   81   HD22  LEU  11          1HD2      LEU  11  -4.279  -6.665   3.181
   82   HD23  LEU  11          2HD2      LEU  11  -3.263  -5.289   3.613
   83    H    GLY  12           HN       GLY  12  -4.938  -5.985  -1.898
   84    HA2  GLY  12           2HA      GLY  12  -6.162  -4.812  -3.488
   85    HA3  GLY  12           1HA      GLY  12  -6.927  -3.901  -2.186
   86    H    GLU  13           HN       GLU  13  -6.602  -1.928  -3.250
   87    HA   GLU  13           HA       GLU  13  -3.868  -1.113  -3.760
   88    HB2  GLU  13           2HB      GLU  13  -6.472   0.389  -4.010
   89    HB3  GLU  13           1HB      GLU  13  -4.895   1.044  -4.437
   90    HG2  GLU  13           2HG      GLU  13  -4.635  -0.799  -6.069
   91    HG3  GLU  13           1HG      GLU  13  -6.292  -1.290  -5.712
   92    H    LEU  14           HN       LEU  14  -2.637  -0.467  -2.169
   93    HA   LEU  14           HA       LEU  14  -3.824   0.867   0.150
   94    HB2  LEU  14           2HB      LEU  14  -1.013  -0.133  -0.331
   95    HB3  LEU  14           1HB      LEU  14  -1.563   0.632   1.147
   96    HG   LEU  14           HG       LEU  14  -2.602  -1.980   0.047
   97   HD11  LEU  14          1HD1      LEU  14  -0.305  -2.153   0.870
   98   HD12  LEU  14          2HD1      LEU  14  -1.436  -3.008   1.919
   99   HD13  LEU  14          3HD1      LEU  14  -0.801  -1.436   2.402
  100   HD21  LEU  14          3HD2      LEU  14  -3.734  -2.168   2.219
  101   HD22  LEU  14          1HD2      LEU  14  -4.308  -0.783   1.292
  102   HD23  LEU  14          2HD2      LEU  14  -3.189  -0.543   2.632
  103    H    GLU  15           HN       GLU  15  -3.120   2.916   0.833
  104    HA   GLU  15           HA       GLU  15  -2.685   4.690  -1.367
  105    HB2  GLU  15           2HB      GLU  15  -2.769   5.289   1.599
  106    HB3  GLU  15           1HB      GLU  15  -2.845   6.481   0.306
  107    HG2  GLU  15           2HG      GLU  15  -4.926   5.431  -0.492
  108    HG3  GLU  15           1HG      GLU  15  -4.863   4.328   0.880
  109    H    LEU  16           HN       LEU  16  -0.861   5.427  -2.144
  110    HA   LEU  16           HA       LEU  16   1.645   4.738  -0.849
  111    HB2  LEU  16           2HB      LEU  16   1.131   4.460  -3.332
  112    HB3  LEU  16           1HB      LEU  16   1.238   6.201  -3.459
  113    HG   LEU  16           HG       LEU  16   3.283   4.972  -4.194
  114   HD11  LEU  16          1HD1      LEU  16   4.882   6.428  -3.088
  115   HD12  LEU  16          2HD1      LEU  16   3.682   6.825  -1.859
  116   HD13  LEU  16          3HD1      LEU  16   3.422   7.310  -3.535
  117   HD21  LEU  16          3HD2      LEU  16   3.267   3.181  -2.573
  118   HD22  LEU  16          1HD2      LEU  16   3.532   4.333  -1.265
  119   HD23  LEU  16          2HD2      LEU  16   4.784   4.079  -2.482
  120    H    THR  17           HN       THR  17   2.406   6.055   0.643
  121    HA   THR  17           HA       THR  17   1.824   8.919   0.517
  122    HB   THR  17           HB       THR  17   3.246   7.359   2.690
  123    HG1  THR  17           1HG      THR  17   0.846   6.984   2.103
  124   HG21  THR  17          3HG2      THR  17   2.709   9.304   4.088
  125   HG22  THR  17          1HG2      THR  17   2.017  10.117   2.684
  126   HG23  THR  17          2HG2      THR  17   3.741   9.750   2.729
  127    H    VAL  18           HN       VAL  18   3.278  10.389  -0.130
  128    HA   VAL  18           HA       VAL  18   6.006   9.454  -0.693
  129    HB   VAL  18           HB       VAL  18   4.537  11.829  -1.850
  130   HG11  VAL  18          1HG1      VAL  18   6.435  11.974  -3.405
  131   HG12  VAL  18          2HG1      VAL  18   7.255  10.703  -2.497
  132   HG13  VAL  18          3HG1      VAL  18   6.908  12.252  -1.730
  133   HG21  VAL  18          3HG2      VAL  18   3.638   9.708  -2.640
  134   HG22  VAL  18          1HG2      VAL  18   5.253   9.187  -3.115
  135   HG23  VAL  18          2HG2      VAL  18   4.492  10.556  -3.931
  136    H    LEU  19           HN       LEU  19   7.542  10.119   0.639
  137    HA   LEU  19           HA       LEU  19   7.101  12.489   2.290
  138    HB2  LEU  19           2HB      LEU  19   9.390  10.509   2.291
  139    HB3  LEU  19           1HB      LEU  19   9.135  11.783   3.466
  140    HG   LEU  19           HG       LEU  19   7.334   9.393   3.049
  141   HD11  LEU  19          1HD1      LEU  19   9.464   8.807   4.076
  142   HD12  LEU  19          2HD1      LEU  19   8.141   8.671   5.231
  143   HD13  LEU  19          3HD1      LEU  19   9.230  10.056   5.298
  144   HD21  LEU  19          3HD2      LEU  19   6.158  10.172   5.036
  145   HD22  LEU  19          1HD2      LEU  19   6.095  11.383   3.756
  146   HD23  LEU  19          2HD2      LEU  19   7.203  11.592   5.115
  147    H    TYR  20           HN       TYR  20   7.801  14.404   1.585
  148    HA   TYR  20           HA       TYR  20  10.169  14.488  -0.132
  149    HB2  TYR  20           2HB      TYR  20   9.085  15.942  -1.739
  150    HB3  TYR  20           1HB      TYR  20   8.164  14.450  -1.593
  151    HD1  TYR  20           2HD      TYR  20   6.061  14.506  -0.090
  152    HD2  TYR  20           1HD      TYR  20   8.044  18.014  -1.461
  153    HE1  TYR  20           2HE      TYR  20   4.030  15.822   0.348
  154    HE2  TYR  20           1HE      TYR  20   6.019  19.335  -1.027
  155    HH   TYR  20           HH       TYR  20   3.581  18.962  -0.844
  156    H    ASP  21           HN       ASP  21  10.935  16.754  -0.459
  157    HA   ASP  21           HA       ASP  21  10.963  18.108   2.105
  158    HB2  ASP  21           2HB      ASP  21  13.008  17.655   0.573
  159    HB3  ASP  21           1HB      ASP  21  12.416  19.011  -0.378
  160    H    GLU  22           HN       GLU  22   9.137  19.256   2.412
  161    HA   GLU  22           HA       GLU  22   7.697  20.504   0.301
  162    HB2  GLU  22           2HB      GLU  22   6.313  21.457   2.171
  163    HB3  GLU  22           1HB      GLU  22   6.437  19.705   2.158
  164    HG2  GLU  22           2HG      GLU  22   8.059  19.753   3.927
  165    HG3  GLU  22           1HG      GLU  22   8.103  21.513   3.887
  166    H    GLU  23           HN       GLU  23  10.456  21.455   1.907
  167    HA   GLU  23           HA       GLU  23   9.936  24.301   1.769
  168    HB2  GLU  23           2HB      GLU  23  12.446  22.751   2.417
  169    HB3  GLU  23           1HB      GLU  23  12.262  24.490   2.563
  170    HG2  GLU  23           2HG      GLU  23  10.487  22.586   4.038
  171    HG3  GLU  23           1HG      GLU  23  12.050  23.090   4.674
  172    H    ARG  24           HN       ARG  24  10.833  21.864  -0.346
  173    HA   ARG  24           HA       ARG  24  12.386  23.721  -2.021
  174    HB2  ARG  24           2HB      ARG  24  13.533  21.620  -1.103
  175    HB3  ARG  24           1HB      ARG  24  12.514  20.719  -2.215
  176    HG2  ARG  24           2HG      ARG  24  14.447  20.968  -3.430
  177    HG3  ARG  24           1HG      ARG  24  13.479  22.324  -4.008
  178    HD2  ARG  24           2HD      ARG  24  15.688  22.411  -1.957
  179    HD3  ARG  24           1HD      ARG  24  15.735  23.069  -3.591
  180    HE   ARG  24           HE       ARG  24  13.822  24.550  -2.736
  181   HH11  ARG  24          1HH1      ARG  24  16.542  23.434  -0.820
  182   HH12  ARG  24          2HH1      ARG  24  16.406  24.715   0.350
  183   HH21  ARG  24          1HH2      ARG  24  13.673  26.256  -1.251
  184   HH22  ARG  24          2HH2      ARG  24  14.782  26.351   0.078
  185    H    TYR  25           HN       TYR  25  10.332  20.808  -2.349
  186    HA   TYR  25           HA       TYR  25   9.087  22.050  -4.716
  187    HB2  TYR  25           2HB      TYR  25   9.917  19.143  -4.524
  188    HB3  TYR  25           1HB      TYR  25   9.132  19.918  -5.891
  189    HD1  TYR  25           2HD      TYR  25  10.504  22.063  -6.790
  190    HD2  TYR  25           1HD      TYR  25  12.168  18.763  -4.685
  191    HE1  TYR  25           2HE      TYR  25  12.707  22.568  -7.757
  192    HE2  TYR  25           1HE      TYR  25  14.375  19.260  -5.646
  193    HH   TYR  25           HH       TYR  25  15.101  22.165  -7.173
  194    H    ASP  26           HN       ASP  26   7.163  20.578  -5.388
  195    HA   ASP  26           HA       ASP  26   5.895  19.281  -3.101
  196    HB2  ASP  26           2HB      ASP  26   4.979  21.556  -3.120
  197    HB3  ASP  26           1HB      ASP  26   4.535  21.376  -4.813
  198    H    ILE  27           HN       ILE  27   4.057  17.922  -3.785
  199    HA   ILE  27           HA       ILE  27   4.948  16.285  -5.951
  200    HB   ILE  27           HB       ILE  27   2.431  16.031  -4.293
  201   HG12  ILE  27          2HG1      ILE  27   5.130  14.706  -3.937
  202   HG13  ILE  27          1HG1      ILE  27   4.500  16.007  -2.931
  203   HG21  ILE  27          1HG2      ILE  27   3.867  14.022  -6.027
  204   HG22  ILE  27          2HG2      ILE  27   2.310  14.774  -6.371
  205   HG23  ILE  27          3HG2      ILE  27   2.475  13.680  -4.997
  206   HD11  ILE  27          3HD1      ILE  27   3.305  13.259  -3.217
  207   HD12  ILE  27          1HD1      ILE  27   2.684  14.557  -2.198
  208   HD13  ILE  27          2HD1      ILE  27   4.259  13.841  -1.851
  209    H    VAL  28           HN       VAL  28   4.470  16.558  -7.996
  210    HA   VAL  28           HA       VAL  28   1.985  17.911  -8.749
  211    HB   VAL  28           HB       VAL  28   4.366  17.122 -10.445
  212   HG11  VAL  28          1HG1      VAL  28   3.332  18.490 -12.193
  213   HG12  VAL  28          2HG1      VAL  28   1.923  18.741 -11.161
  214   HG13  VAL  28          3HG1      VAL  28   2.309  17.125 -11.748
  215   HG21  VAL  28          3HG2      VAL  28   3.469  19.786  -9.357
  216   HG22  VAL  28          1HG2      VAL  28   4.761  19.565 -10.538
  217   HG23  VAL  28          2HG2      VAL  28   4.926  18.894  -8.915
  218    H    GLU  29           HN       GLU  29   3.822  14.967  -9.436
  219    HA   GLU  29           HA       GLU  29   1.298  13.566  -9.947
  220    HB2  GLU  29           2HB      GLU  29   3.827  13.323 -11.589
  221    HB3  GLU  29           1HB      GLU  29   2.450  12.241 -11.720
  222    HG2  GLU  29           2HG      GLU  29   1.059  14.007 -12.530
  223    HG3  GLU  29           1HG      GLU  29   2.320  15.200 -12.223
  224    H    GLN  30           HN       GLN  30   1.385  11.315  -9.462
  225    HA   GLN  30           HA       GLN  30   3.697  10.015  -8.480
  226    HB2  GLN  30           2HB      GLN  30   3.201   9.867  -6.132
  227    HB3  GLN  30           1HB      GLN  30   3.216  11.574  -6.551
  228    HG2  GLN  30           2HG      GLN  30   0.880  11.738  -6.439
  229    HG3  GLN  30           1HG      GLN  30   0.672   9.988  -6.473
  230   HE21  GLN  30          1HE2      GLN  30   1.071   8.789  -4.594
  231   HE22  GLN  30          2HE2      GLN  30   1.132   9.539  -3.037
  232    H    THR  31           HN       THR  31   3.168   7.839  -7.703
  233    HA   THR  31           HA       THR  31   0.729   6.744  -8.748
  234    HB   THR  31           HB       THR  31   2.626   5.379  -6.828
  235    HG1  THR  31           1HG      THR  31   3.244   4.764  -9.351
  236   HG21  THR  31          3HG2      THR  31   1.953   3.366  -8.082
  237   HG22  THR  31          1HG2      THR  31   0.873   4.352  -9.067
  238   HG23  THR  31          2HG2      THR  31   0.573   4.172  -7.339
  239    H    GLU  32           HN       GLU  32  -1.177   6.766  -7.684
  240    HA   GLU  32           HA       GLU  32  -1.267   7.901  -5.043
  241    HB2  GLU  32           2HB      GLU  32  -3.436   6.981  -6.923
  242    HB3  GLU  32           1HB      GLU  32  -3.752   7.686  -5.342
  243    HG2  GLU  32           2HG      GLU  32  -2.578   9.721  -6.034
  244    HG3  GLU  32           1HG      GLU  32  -2.321   9.020  -7.629
  245    H    THR  33           HN       THR  33  -2.244   4.818  -6.483
  246    HA   THR  33           HA       THR  33  -1.970   3.586  -3.844
  247    HB   THR  33           HB       THR  33  -4.054   2.177  -4.488
  248    HG1  THR  33           1HG      THR  33  -4.834   2.806  -6.372
  249   HG21  THR  33          3HG2      THR  33  -5.553   3.796  -3.396
  250   HG22  THR  33          1HG2      THR  33  -4.334   5.053  -3.613
  251   HG23  THR  33          2HG2      THR  33  -3.999   3.672  -2.566
  252    H    VAL  34           HN       VAL  34  -1.369   1.407  -3.874
  253    HA   VAL  34           HA       VAL  34  -0.864   0.250  -6.537
  254    HB   VAL  34           HB       VAL  34   1.086  -0.747  -4.682
  255   HG11  VAL  34          1HG1      VAL  34   2.640  -0.005  -6.428
  256   HG12  VAL  34          2HG1      VAL  34   1.329   0.881  -7.207
  257   HG13  VAL  34          3HG1      VAL  34   1.259  -0.877  -7.091
  258   HG21  VAL  34          3HG2      VAL  34   0.839   1.428  -3.546
  259   HG22  VAL  34          1HG2      VAL  34   1.175   2.250  -5.069
  260   HG23  VAL  34          2HG2      VAL  34   2.419   1.256  -4.309
  261    H    GLN  35           HN       GLN  35  -0.883  -2.037  -6.625
  262    HA   GLN  35           HA       GLN  35  -2.770  -3.150  -4.694
  263    HB2  GLN  35           2HB      GLN  35  -2.902  -3.131  -7.344
  264    HB3  GLN  35           1HB      GLN  35  -1.921  -4.577  -7.182
  265    HG2  GLN  35           2HG      GLN  35  -4.622  -4.165  -5.914
  266    HG3  GLN  35           1HG      GLN  35  -4.324  -5.042  -7.412
  267   HE21  GLN  35          1HE2      GLN  35  -3.172  -7.007  -7.324
  268   HE22  GLN  35          2HE2      GLN  35  -3.123  -7.939  -5.860
  269    H    VAL  36           HN       VAL  36  -2.109  -4.525  -3.160
  270    HA   VAL  36           HA       VAL  36   0.441  -5.981  -3.555
  271    HB   VAL  36           HB       VAL  36  -0.599  -4.918  -0.916
  272   HG11  VAL  36          1HG1      VAL  36   1.602  -5.545  -0.068
  273   HG12  VAL  36          2HG1      VAL  36   2.040  -6.176  -1.653
  274   HG13  VAL  36          3HG1      VAL  36   0.751  -6.943  -0.726
  275   HG21  VAL  36          3HG2      VAL  36   1.226  -3.292  -1.030
  276   HG22  VAL  36          1HG2      VAL  36   0.090  -3.077  -2.362
  277   HG23  VAL  36          2HG2      VAL  36   1.641  -3.867  -2.644
  278    H    ASP  37           HN       ASP  37   0.331  -8.082  -3.386
  279    HA   ASP  37           HA       ASP  37  -1.957  -9.310  -1.984
  280    HB2  ASP  37           2HB      ASP  37  -2.100  -9.782  -4.353
  281    HB3  ASP  37           1HB      ASP  37  -0.412 -10.280  -4.401
  282    H    LEU  38           HN       LEU  38  -1.508 -10.866  -0.473
  283    HA   LEU  38           HA       LEU  38   1.354 -11.351   0.041
  284    HB2  LEU  38           2HB      LEU  38  -0.874 -11.014   2.052
  285    HB3  LEU  38           1HB      LEU  38   0.774 -11.463   2.447
  286    HG   LEU  38           HG       LEU  38  -0.097  -8.837   1.237
  287   HD11  LEU  38          1HD1      LEU  38   0.542  -7.895   3.391
  288   HD12  LEU  38          2HD1      LEU  38   0.924  -9.508   3.994
  289   HD13  LEU  38          3HD1      LEU  38  -0.740  -9.091   3.582
  290   HD21  LEU  38          3HD2      LEU  38   2.628  -9.757   2.144
  291   HD22  LEU  38          1HD2      LEU  38   2.217  -8.144   1.567
  292   HD23  LEU  38          2HD2      LEU  38   2.128  -9.522   0.469
  293    H    GLU  39           HN       GLU  39   1.981 -13.409   0.156
  294    HA   GLU  39           HA       GLU  39  -0.060 -15.435   0.792
  295    HB2  GLU  39           2HB      GLU  39   2.193 -15.550  -1.193
  296    HB3  GLU  39           1HB      GLU  39   1.506 -17.016  -0.506
  297    HG2  GLU  39           2HG      GLU  39  -0.711 -16.299  -1.338
  298    HG3  GLU  39           1HG      GLU  39   0.081 -14.939  -2.125
  299    H    GLY  40           HN       GLY  40   0.863 -17.429   1.730
  300    HA2  GLY  40           2HA      GLY  40   3.275 -18.112   2.553
  301    HA3  GLY  40           1HA      GLY  40   2.988 -16.752   3.629
  302    HA   PRO  41           HA       PRO  41   1.584 -20.575   5.863
  303    HB2  PRO  41           2HB      PRO  41   2.152 -19.394   8.309
  304    HB3  PRO  41           1HB      PRO  41   3.240 -20.465   7.416
  305    HG2  PRO  41           2HG      PRO  41   3.197 -17.479   7.549
  306    HG3  PRO  41           1HG      PRO  41   4.583 -18.584   7.509
  307    HD2  PRO  41           2HD      PRO  41   3.814 -17.215   5.333
  308    HD3  PRO  41           1HD      PRO  41   4.446 -18.870   5.213
  309    H    ARG  42           HN       ARG  42  -0.484 -20.798   6.325
  310    HA   ARG  42           HA       ARG  42  -2.361 -18.793   6.145
  311    HB2  ARG  42           2HB      ARG  42  -3.946 -20.414   7.192
  312    HB3  ARG  42           1HB      ARG  42  -3.019 -21.068   5.851
  313    HG2  ARG  42           2HG      ARG  42  -1.559 -22.237   7.373
  314    HG3  ARG  42           1HG      ARG  42  -2.366 -21.501   8.758
  315    HD2  ARG  42           2HD      ARG  42  -4.423 -22.651   8.216
  316    HD3  ARG  42           1HD      ARG  42  -3.704 -23.308   6.746
  317    HE   ARG  42           HE       ARG  42  -2.164 -24.549   8.228
  318   HH11  ARG  42          1HH1      ARG  42  -5.225 -23.416   9.504
  319   HH12  ARG  42          2HH1      ARG  42  -5.312 -24.639  10.739
  320   HH21  ARG  42          1HH2      ARG  42  -2.262 -26.132   9.882
  321   HH22  ARG  42          2HH2      ARG  42  -3.608 -26.151  10.978
  322    H    GLY  43           HN       GLY  43  -0.731 -19.967   9.042
  323    HA2  GLY  43           2HA      GLY  43  -2.478 -18.884  10.959
  324    HA3  GLY  43           1HA      GLY  43  -0.791 -19.286  11.230
  325    H    VAL  44           HN       VAL  44   0.363 -17.450   9.387
  326    HA   VAL  44           HA       VAL  44   0.514 -15.181  11.061
  327    HB   VAL  44           HB       VAL  44   1.440 -15.451   8.192
  328   HG11  VAL  44          1HG1      VAL  44   2.999 -13.642   8.739
  329   HG12  VAL  44          2HG1      VAL  44   2.272 -13.502  10.340
  330   HG13  VAL  44          3HG1      VAL  44   1.321 -13.122   8.904
  331   HG21  VAL  44          3HG2      VAL  44   3.630 -15.969   9.183
  332   HG22  VAL  44          1HG2      VAL  44   2.408 -17.173   9.591
  333   HG23  VAL  44          2HG2      VAL  44   2.890 -15.967  10.784
  334    H    LEU  45           HN       LEU  45  -1.210 -15.830   8.060
  335    HA   LEU  45           HA       LEU  45  -2.110 -13.187   7.619
  336    HB2  LEU  45           2HB      LEU  45  -3.304 -15.808   6.722
  337    HB3  LEU  45           1HB      LEU  45  -3.770 -14.231   6.113
  338    HG   LEU  45           HG       LEU  45  -1.055 -15.515   5.805
  339   HD11  LEU  45          1HD1      LEU  45  -1.644 -15.578   3.424
  340   HD12  LEU  45          2HD1      LEU  45  -3.260 -14.989   3.823
  341   HD13  LEU  45          3HD1      LEU  45  -2.725 -16.565   4.409
  342   HD21  LEU  45          3HD2      LEU  45  -0.538 -13.608   4.362
  343   HD22  LEU  45          1HD2      LEU  45  -0.885 -13.089   6.013
  344   HD23  LEU  45          2HD2      LEU  45  -2.102 -12.890   4.753
  345    H    THR  46           HN       THR  46  -3.353 -15.846   9.539
  346    HA   THR  46           HA       THR  46  -5.917 -14.763  10.066
  347    HB   THR  46           HB       THR  46  -4.337 -16.526  11.947
  348    HG1  THR  46           1HG      THR  46  -5.550 -17.088   9.471
  349   HG21  THR  46          3HG2      THR  46  -6.440 -15.673  12.845
  350   HG22  THR  46          1HG2      THR  46  -6.563 -17.404  12.527
  351   HG23  THR  46          2HG2      THR  46  -7.299 -16.248  11.415
  352    H    VAL  47           HN       VAL  47  -2.823 -14.580  11.808
  353    HA   VAL  47           HA       VAL  47  -3.737 -12.936  13.921
  354    HB   VAL  47           HB       VAL  47  -0.942 -13.103  12.775
  355   HG11  VAL  47          1HG1      VAL  47  -1.248 -11.179  14.237
  356   HG12  VAL  47          2HG1      VAL  47  -0.210 -12.386  14.994
  357   HG13  VAL  47          3HG1      VAL  47  -1.892 -12.227  15.500
  358   HG21  VAL  47          3HG2      VAL  47  -2.240 -14.722  14.960
  359   HG22  VAL  47          1HG2      VAL  47  -0.533 -14.779  14.523
  360   HG23  VAL  47          2HG2      VAL  47  -1.756 -15.308  13.370
  361    H    PHE  48           HN       PHE  48  -2.432 -12.274  10.735
  362    HA   PHE  48           HA       PHE  48  -2.214  -9.460  11.000
  363    HB2  PHE  48           2HB      PHE  48  -1.127 -10.956   9.251
  364    HB3  PHE  48           1HB      PHE  48  -2.685 -10.992   8.438
  365    HD1  PHE  48           1HD      PHE  48  -0.001  -8.721   9.592
  366    HD2  PHE  48           2HD      PHE  48  -3.303  -9.286   6.973
  367    HE1  PHE  48           1HE      PHE  48   0.597  -6.654   8.398
  368    HE2  PHE  48           2HE      PHE  48  -2.713  -7.221   5.777
  369    HZ   PHE  48           HZ       PHE  48  -0.762  -5.901   6.489
  370    H    ARG  49           HN       ARG  49  -4.827 -11.617  10.228
  371    HA   ARG  49           HA       ARG  49  -6.620  -9.647   9.221
  372    HB2  ARG  49           2HB      ARG  49  -6.611 -12.497   9.738
  373    HB3  ARG  49           1HB      ARG  49  -8.132 -11.770  10.207
  374    HG2  ARG  49           2HG      ARG  49  -6.873 -11.382   7.503
  375    HG3  ARG  49           1HG      ARG  49  -8.033 -12.659   7.869
  376    HD2  ARG  49           2HD      ARG  49  -9.251 -10.877   6.879
  377    HD3  ARG  49           1HD      ARG  49  -9.633 -10.868   8.598
  378    HE   ARG  49           HE       ARG  49  -7.544  -9.095   8.281
  379   HH11  ARG  49          1HH1      ARG  49 -10.809  -9.433   7.067
  380   HH12  ARG  49          2HH1      ARG  49 -11.039  -7.720   6.857
  381   HH21  ARG  49          1HH2      ARG  49  -7.858  -6.833   8.043
  382   HH22  ARG  49          2HH2      ARG  49  -9.383  -6.256   7.436
  383    H    PHE  50           HN       PHE  50  -5.966 -11.025  12.400
  384    HA   PHE  50           HA       PHE  50  -8.092  -9.769  13.772
  385    HB2  PHE  50           2HB      PHE  50  -5.384 -10.713  14.717
  386    HB3  PHE  50           1HB      PHE  50  -6.647 -10.136  15.784
  387    HD1  PHE  50           2HD      PHE  50  -9.053 -11.379  14.744
  388    HD2  PHE  50           1HD      PHE  50  -5.112 -12.956  15.103
  389    HE1  PHE  50           2HE      PHE  50  -9.977 -13.660  14.858
  390    HE2  PHE  50           1HE      PHE  50  -6.028 -15.233  15.218
  391    HZ   PHE  50           HZ       PHE  50  -8.462 -15.588  15.097
  392    H    ALA  51           HN       ALA  51  -4.951  -8.743  12.745
  393    HA   ALA  51           HA       ALA  51  -4.681  -6.494  14.433
  394    HB1  ALA  51           1HB      ALA  51  -3.364  -7.043  11.777
  395    HB2  ALA  51           2HB      ALA  51  -2.776  -7.591  13.346
  396    HB3  ALA  51           3HB      ALA  51  -2.840  -5.867  12.982
  397    H    ARG  52           HN       ARG  52  -5.432  -4.495  14.248
  398    HA   ARG  52           HA       ARG  52  -7.150  -3.645  12.171
  399    HB2  ARG  52           2HB      ARG  52  -7.077  -2.893  14.615
  400    HB3  ARG  52           1HB      ARG  52  -5.639  -1.976  14.195
  401    HG2  ARG  52           2HG      ARG  52  -6.924  -0.755  12.545
  402    HG3  ARG  52           1HG      ARG  52  -8.362  -1.641  13.025
  403    HD2  ARG  52           2HD      ARG  52  -8.205  -0.722  15.271
  404    HD3  ARG  52           1HD      ARG  52  -6.729   0.133  14.828
  405    HE   ARG  52           HE       ARG  52  -9.052   0.741  13.204
  406   HH11  ARG  52          1HH1      ARG  52  -7.189   1.623  16.046
  407   HH12  ARG  52          2HH1      ARG  52  -7.715   3.278  16.018
  408   HH21  ARG  52          1HH2      ARG  52  -9.725   2.902  13.164
  409   HH22  ARG  52          2HH2      ARG  52  -9.138   4.023  14.361
  410    HA   PRO  53           HA       PRO  53  -4.208  -2.408   9.100
  411    HB2  PRO  53           2HB      PRO  53  -5.049   0.254   8.690
  412    HB3  PRO  53           1HB      PRO  53  -5.519  -1.174   7.766
  413    HG2  PRO  53           2HG      PRO  53  -6.962   0.241   9.932
  414    HG3  PRO  53           1HG      PRO  53  -7.610  -0.701   8.579
  415    HD2  PRO  53           2HD      PRO  53  -7.596  -1.625  11.119
  416    HD3  PRO  53           1HD      PRO  53  -7.413  -2.702   9.720
  417    H    SER  54           HN       SER  54  -2.221  -2.093   9.655
  418    HA   SER  54           HA       SER  54  -1.378   0.409  10.898
  419    HB2  SER  54           2HB      SER  54   0.380  -1.260  11.931
  420    HB3  SER  54           1HB      SER  54  -1.188  -1.034  12.683
  421    HG   SER  54           HG       SER  54  -1.811  -2.973  12.048
  422    H    TYR  55           HN       TYR  55  -1.392  -1.348   8.297
  423    HA   TYR  55           HA       TYR  55   1.445  -1.294   7.627
  424    HB2  TYR  55           2HB      TYR  55   0.401  -2.501   5.503
  425    HB3  TYR  55           1HB      TYR  55   0.697  -3.377   7.000
  426    HD1  TYR  55           1HD      TYR  55  -1.160  -4.019   8.454
  427    HD2  TYR  55           2HD      TYR  55  -1.863  -2.039   4.754
  428    HE1  TYR  55           1HE      TYR  55  -3.529  -4.661   8.571
  429    HE2  TYR  55           2HE      TYR  55  -4.237  -2.676   4.859
  430    HH   TYR  55           HH       TYR  55  -5.675  -4.312   5.910
  431    H    GLU  56           HN       GLU  56   2.280   0.033   6.115
  432    HA   GLU  56           HA       GLU  56   0.451   1.673   4.525
  433    HB2  GLU  56           2HB      GLU  56   2.715   2.768   6.204
  434    HB3  GLU  56           1HB      GLU  56   1.753   3.698   5.064
  435    HG2  GLU  56           2HG      GLU  56  -0.253   3.187   6.432
  436    HG3  GLU  56           1HG      GLU  56   0.804   2.406   7.610
  437    H    VAL  57           HN       VAL  57   1.376   2.529   2.638
  438    HA   VAL  57           HA       VAL  57   4.026   1.437   1.954
  439    HB   VAL  57           HB       VAL  57   1.980   2.291  -0.087
  440   HG11  VAL  57          1HG1      VAL  57   4.258   2.024  -0.865
  441   HG12  VAL  57          2HG1      VAL  57   3.238   0.745  -1.523
  442   HG13  VAL  57          3HG1      VAL  57   4.326   0.401  -0.178
  443   HG21  VAL  57          3HG2      VAL  57   0.880   0.593   1.272
  444   HG22  VAL  57          1HG2      VAL  57   2.273  -0.473   1.091
  445   HG23  VAL  57          2HG2      VAL  57   1.294  -0.055  -0.315
  446    H    PHE  58           HN       PHE  58   5.571   2.940   1.659
  447    HA   PHE  58           HA       PHE  58   4.895   5.589   0.738
  448    HB2  PHE  58           2HB      PHE  58   5.796   6.764   2.690
  449    HB3  PHE  58           1HB      PHE  58   4.413   5.776   3.139
  450    HD1  PHE  58           2HD      PHE  58   4.757   3.688   4.426
  451    HD2  PHE  58           1HD      PHE  58   7.952   6.380   3.603
  452    HE1  PHE  58           2HE      PHE  58   6.095   2.639   6.204
  453    HE2  PHE  58           1HE      PHE  58   9.293   5.335   5.381
  454    HZ   PHE  58           HZ       PHE  58   8.367   3.463   6.687
  455    H    VAL  59           HN       VAL  59   6.674   6.812   0.100
  456    HA   VAL  59           HA       VAL  59   9.275   5.447   0.200
  457    HB   VAL  59           HB       VAL  59   9.692   6.341  -2.145
  458   HG11  VAL  59          1HG1      VAL  59   7.613   4.188  -1.772
  459   HG12  VAL  59          2HG1      VAL  59   9.365   3.979  -1.729
  460   HG13  VAL  59          3HG1      VAL  59   8.570   4.445  -3.233
  461   HG21  VAL  59          3HG2      VAL  59   6.687   6.580  -2.120
  462   HG22  VAL  59          1HG2      VAL  59   7.708   6.683  -3.555
  463   HG23  VAL  59          2HG2      VAL  59   7.844   7.899  -2.288
  464    H    ASP  60           HN       ASP  60  10.927   6.723   0.753
  465    HA   ASP  60           HA       ASP  60  10.453   9.534   1.245
  466    HB2  ASP  60           2HB      ASP  60  11.840   8.114   2.785
  467    HB3  ASP  60           1HB      ASP  60  13.045   7.991   1.505
  468    H    LEU  61           HN       LEU  61  10.741  11.029  -0.215
  469    HA   LEU  61           HA       LEU  61  12.731  10.611  -2.333
  470    HB2  LEU  61           2HB      LEU  61   9.903  11.628  -2.687
  471    HB3  LEU  61           1HB      LEU  61  11.127  11.605  -3.944
  472    HG   LEU  61           HG       LEU  61  10.215   9.095  -2.551
  473   HD11  LEU  61          1HD1      LEU  61   8.765   8.676  -4.452
  474   HD12  LEU  61          2HD1      LEU  61   9.160  10.262  -5.115
  475   HD13  LEU  61          3HD1      LEU  61   8.277  10.137  -3.594
  476   HD21  LEU  61          3HD2      LEU  61  11.132   8.020  -4.549
  477   HD22  LEU  61          1HD2      LEU  61  12.355   8.967  -3.702
  478   HD23  LEU  61          2HD2      LEU  61  11.615   9.596  -5.174
  479    H    THR  62           HN       THR  62  12.750  12.069   0.174
  480    HA   THR  62           HA       THR  62  12.378  14.843  -0.246
  481    HB   THR  62           HB       THR  62  13.842  15.116   1.752
  482    HG1  THR  62           1HG      THR  62  13.949  12.263   1.833
  483   HG21  THR  62          3HG2      THR  62  11.445  14.716   2.030
  484   HG22  THR  62          1HG2      THR  62  12.367  13.969   3.334
  485   HG23  THR  62          2HG2      THR  62  11.731  12.976   2.024
  486    H    GLU  63           HN       GLU  63  14.871  12.615  -1.093
  487    HA   GLU  63           HA       GLU  63  16.811  14.726  -1.626
  488    HB2  GLU  63           2HB      GLU  63  17.007  11.724  -1.823
  489    HB3  GLU  63           1HB      GLU  63  18.335  12.827  -2.107
  490    HG2  GLU  63           2HG      GLU  63  18.326  13.514   0.142
  491    HG3  GLU  63           1HG      GLU  63  16.816  12.680   0.449
  492    H    ALA  64           HN       ALA  64  14.222  13.689  -3.203
  493    HA   ALA  64           HA       ALA  64  15.473  13.524  -5.848
  494    HB1  ALA  64           1HB      ALA  64  13.796  11.828  -5.332
  495    HB2  ALA  64           2HB      ALA  64  13.265  12.862  -6.657
  496    HB3  ALA  64           3HB      ALA  64  12.597  13.090  -5.043
  497    H    GLY  65           HN       GLY  65  13.993  14.688  -7.598
  498    HA2  GLY  65           2HA      GLY  65  12.735  17.113  -6.848
  499    HA3  GLY  65           1HA      GLY  65  14.400  17.417  -7.315
  500    H    GLU  66           HN       GLU  66  14.778  17.822  -9.371
  501    HA   GLU  66           HA       GLU  66  12.688  18.138 -11.205
  502    HB2  GLU  66           2HB      GLU  66  15.648  17.988 -11.755
  503    HB3  GLU  66           1HB      GLU  66  14.440  18.610 -12.859
  504    HG2  GLU  66           2HG      GLU  66  13.930  20.420 -11.351
  505    HG3  GLU  66           1HG      GLU  66  15.053  19.771 -10.157
  506    H    GLY  67           HN       GLY  67  12.090  17.090 -13.025
  507    HA2  GLY  67           2HA      GLY  67  11.766  15.358 -14.498
  508    HA3  GLY  67           1HA      GLY  67  13.316  14.705 -14.000
  509    H    SER  68           HN       SER  68  10.445  13.634 -14.412
  510    HA   SER  68           HA       SER  68   9.723  12.648 -11.837
  511    HB2  SER  68           2HB      SER  68   8.102  12.869 -13.716
  512    HB3  SER  68           1HB      SER  68   8.900  11.524 -14.520
  513    HG   SER  68           HG       SER  68   7.899  11.317 -11.885
  514    H    HIS  69           HN       HIS  69  10.244  10.810 -10.885
  515    HA   HIS  69           HA       HIS  69  12.233   9.114 -12.226
  516    HB2  HIS  69           2HB      HIS  69  12.459  10.520  -9.593
  517    HB3  HIS  69           1HB      HIS  69  13.279   8.979  -9.828
  518    HD1  HIS  69           1HD      HIS  69  13.432  12.581 -10.806
  519    HD2  HIS  69           2HD      HIS  69  15.373   9.015 -11.717
  520    HE1  HIS  69           1HE      HIS  69  15.554  13.241 -11.981
  521    HE2  HIS  69           2HE      HIS  69  16.760  11.075 -12.448
  522    H    THR  70           HN       THR  70  12.129   6.998 -11.831
  523    HA   THR  70           HA       THR  70   9.805   6.105 -10.264
  524    HB   THR  70           HB       THR  70  11.092   4.473 -12.434
  525    HG1  THR  70           1HG      THR  70   9.174   5.552 -13.666
  526   HG21  THR  70          3HG2      THR  70   8.222   4.710 -11.524
  527   HG22  THR  70          1HG2      THR  70   9.358   3.508 -10.916
  528   HG23  THR  70          2HG2      THR  70   8.896   3.501 -12.617
  529    H    VAL  71           HN       VAL  71  10.278   4.992  -8.471
  530    HA   VAL  71           HA       VAL  71  12.848   3.539  -8.373
  531    HB   VAL  71           HB       VAL  71  12.983   4.036  -5.957
  532   HG11  VAL  71          1HG1      VAL  71  14.205   5.440  -7.518
  533   HG12  VAL  71          2HG1      VAL  71  13.630   6.393  -6.149
  534   HG13  VAL  71          3HG1      VAL  71  12.799   6.489  -7.702
  535   HG21  VAL  71          3HG2      VAL  71  10.645   5.873  -6.461
  536   HG22  VAL  71          1HG2      VAL  71  11.563   5.756  -4.962
  537   HG23  VAL  71          2HG2      VAL  71  10.605   4.384  -5.517
  538    H    ASP  72           HN       ASP  72  12.877   1.673  -6.955
  539    HA   ASP  72           HA       ASP  72  10.427   0.179  -7.057
  540    HB2  ASP  72           2HB      ASP  72  12.673  -0.875  -7.307
  541    HB3  ASP  72           1HB      ASP  72  13.002  -0.508  -5.617
  542    H    VAL  73           HN       VAL  73   8.974  -0.176  -5.472
  543    HA   VAL  73           HA       VAL  73   9.047   1.763  -3.333
  544    HB   VAL  73           HB       VAL  73   6.871  -0.206  -4.045
  545   HG11  VAL  73          1HG1      VAL  73   5.409   1.273  -2.758
  546   HG12  VAL  73          2HG1      VAL  73   6.798   2.268  -2.322
  547   HG13  VAL  73          3HG1      VAL  73   6.695   0.602  -1.754
  548   HG21  VAL  73          3HG2      VAL  73   7.344   1.305  -5.892
  549   HG22  VAL  73          1HG2      VAL  73   7.202   2.692  -4.812
  550   HG23  VAL  73          2HG2      VAL  73   5.789   1.691  -5.154
  551    H    GLU  74           HN       GLU  74   9.515   1.420  -1.296
  552    HA   GLU  74           HA       GLU  74   9.983  -1.272  -0.323
  553    HB2  GLU  74           2HB      GLU  74  10.997   1.320   0.313
  554    HB3  GLU  74           1HB      GLU  74  10.243   0.660   1.758
  555    HG2  GLU  74           2HG      GLU  74  12.426  -0.603   0.117
  556    HG3  GLU  74           1HG      GLU  74  12.570   0.079   1.737
  557    H    HIS  75           HN       HIS  75   8.987  -2.061   1.621
  558    HA   HIS  75           HA       HIS  75   6.284  -0.954   2.019
  559    HB2  HIS  75           2HB      HIS  75   5.680  -3.456   2.455
  560    HB3  HIS  75           1HB      HIS  75   5.790  -2.862   0.804
  561    HD1  HIS  75           1HD      HIS  75   8.373  -4.337   3.225
  562    HD2  HIS  75           2HD      HIS  75   7.037  -4.671  -0.698
  563    HE1  HIS  75           1HE      HIS  75   9.795  -6.120   2.174
  564    HE2  HIS  75           2HE      HIS  75   9.142  -6.107  -0.264
  565    H    ARG  76           HN       ARG  76   5.366  -1.173   4.083
  566    HA   ARG  76           HA       ARG  76   6.996  -2.298   6.206
  567    HB2  ARG  76           2HB      ARG  76   7.708   0.124   5.802
  568    HB3  ARG  76           1HB      ARG  76   6.118   0.584   6.394
  569    HG2  ARG  76           2HG      ARG  76   6.573  -0.141   8.551
  570    HG3  ARG  76           1HG      ARG  76   7.908  -1.169   8.026
  571    HD2  ARG  76           2HD      ARG  76   9.118   0.930   7.351
  572    HD3  ARG  76           1HD      ARG  76   7.845   1.840   8.161
  573    HE   ARG  76           HE       ARG  76   8.765   1.273  10.179
  574   HH11  ARG  76          1HH1      ARG  76  10.163  -0.730   7.659
  575   HH12  ARG  76          2HH1      ARG  76  11.367  -1.430   8.704
  576   HH21  ARG  76          1HH2      ARG  76  10.375   0.374  11.550
  577   HH22  ARG  76          2HH2      ARG  76  11.467  -0.826  10.924
  578    H    GLY  77           HN       GLY  77   5.820  -2.822   8.032
  579    HA2  GLY  77           2HA      GLY  77   3.683  -2.421   9.291
  580    HA3  GLY  77           1HA      GLY  77   2.895  -2.553   7.722
  581    H    PHE  78           HN       PHE  78   3.246  -4.615   6.546
  582    HA   PHE  78           HA       PHE  78   2.904  -6.865   8.282
  583    HB2  PHE  78           2HB      PHE  78   2.900  -8.155   6.071
  584    HB3  PHE  78           1HB      PHE  78   1.612  -6.983   6.310
  585    HD1  PHE  78           2HD      PHE  78   4.668  -7.764   4.443
  586    HD2  PHE  78           1HD      PHE  78   1.484  -4.989   4.973
  587    HE1  PHE  78           2HE      PHE  78   5.246  -6.696   2.304
  588    HE2  PHE  78           1HE      PHE  78   2.056  -3.921   2.831
  589    HZ   PHE  78           HZ       PHE  78   3.941  -4.770   1.498
  590    HA   PRO  79           HA       PRO  79   7.091  -8.041   8.781
  591    HB2  PRO  79           2HB      PRO  79   6.825 -10.754   8.994
  592    HB3  PRO  79           1HB      PRO  79   6.422  -9.620  10.288
  593    HG2  PRO  79           2HG      PRO  79   4.617 -10.971   8.319
  594    HG3  PRO  79           1HG      PRO  79   4.376 -10.695  10.054
  595    HD2  PRO  79           2HD      PRO  79   3.200  -9.156   8.182
  596    HD3  PRO  79           1HD      PRO  79   3.726  -8.500   9.745
  597    H    GLY  80           HN       GLY  80   8.837  -8.650   7.614
  598    HA2  GLY  80           2HA      GLY  80   8.431  -9.253   4.818
  599    HA3  GLY  80           1HA      GLY  80   9.970  -8.955   5.614
  600    H    ASP  81           HN       ASP  81   7.447 -11.341   6.247
  601    HA   ASP  81           HA       ASP  81   9.449 -13.469   5.851
  602    HB2  ASP  81           2HB      ASP  81   8.673 -13.093   8.216
  603    HB3  ASP  81           1HB      ASP  81   7.060 -13.541   7.689
  604    H    LEU  82           HN       LEU  82   6.431 -12.163   5.015
  605    HA   LEU  82           HA       LEU  82   5.328 -14.613   3.943
  606    HB2  LEU  82           2HB      LEU  82   4.317 -11.769   3.854
  607    HB3  LEU  82           1HB      LEU  82   3.433 -13.169   3.281
  608    HG   LEU  82           HG       LEU  82   4.253 -12.690   6.147
  609   HD11  LEU  82          1HD1      LEU  82   2.531 -11.129   5.386
  610   HD12  LEU  82          2HD1      LEU  82   1.879 -12.293   6.539
  611   HD13  LEU  82          3HD1      LEU  82   1.555 -12.482   4.816
  612   HD21  LEU  82          3HD2      LEU  82   2.807 -14.602   6.636
  613   HD22  LEU  82          1HD2      LEU  82   4.138 -15.060   5.573
  614   HD23  LEU  82          2HD2      LEU  82   2.523 -14.831   4.911
  615    H    ALA  83           HN       ALA  83   4.507 -14.618   1.689
  616    HA   ALA  83           HA       ALA  83   6.540 -13.677  -0.147
  617    HB1  ALA  83           1HB      ALA  83   5.622 -15.922  -0.430
  618    HB2  ALA  83           2HB      ALA  83   5.272 -14.921  -1.839
  619    HB3  ALA  83           3HB      ALA  83   4.009 -15.247  -0.650
  620    H    VAL  84           HN       VAL  84   6.435 -11.580  -0.612
  621    HA   VAL  84           HA       VAL  84   3.842 -10.252  -0.756
  622    HB   VAL  84           HB       VAL  84   6.605  -9.027  -0.867
  623   HG11  VAL  84          1HG1      VAL  84   3.894  -7.780  -0.409
  624   HG12  VAL  84          2HG1      VAL  84   4.897  -7.604  -1.849
  625   HG13  VAL  84          3HG1      VAL  84   5.441  -6.937  -0.309
  626   HG21  VAL  84          3HG2      VAL  84   6.258 -10.180   1.255
  627   HG22  VAL  84          1HG2      VAL  84   4.738  -9.314   1.486
  628   HG23  VAL  84          2HG2      VAL  84   6.264  -8.430   1.476
  629    H    THR  85           HN       THR  85   2.884  -9.886  -2.636
  630    HA   THR  85           HA       THR  85   4.572  -9.659  -5.039
  631    HB   THR  85           HB       THR  85   1.763 -10.757  -4.985
  632    HG1  THR  85           1HG      THR  85   2.639 -12.637  -4.515
  633   HG21  THR  85          3HG2      THR  85   2.303 -11.491  -7.279
  634   HG22  THR  85          1HG2      THR  85   3.875 -10.703  -7.144
  635   HG23  THR  85          2HG2      THR  85   2.399  -9.738  -7.108
  636    H    VAL  86           HN       VAL  86   4.142  -7.950  -6.326
  637    HA   VAL  86           HA       VAL  86   2.054  -6.108  -5.396
  638    HB   VAL  86           HB       VAL  86   4.793  -5.207  -6.263
  639   HG11  VAL  86          1HG1      VAL  86   2.995  -3.555  -6.470
  640   HG12  VAL  86          2HG1      VAL  86   4.185  -3.090  -5.254
  641   HG13  VAL  86          3HG1      VAL  86   2.631  -3.752  -4.755
  642   HG21  VAL  86          3HG2      VAL  86   3.805  -5.626  -3.444
  643   HG22  VAL  86          1HG2      VAL  86   5.303  -4.804  -3.881
  644   HG23  VAL  86          2HG2      VAL  86   5.100  -6.515  -4.249
  645    H    GLU  87           HN       GLU  87   1.118  -4.822  -6.955
  646    HA   GLU  87           HA       GLU  87   1.930  -5.290  -9.750
  647    HB2  GLU  87           2HB      GLU  87  -0.648  -4.276  -8.514
  648    HB3  GLU  87           1HB      GLU  87  -0.303  -4.127 -10.236
  649    HG2  GLU  87           2HG      GLU  87  -0.175  -6.497 -10.484
  650    HG3  GLU  87           1HG      GLU  87  -0.285  -6.734  -8.744
  651    HA   PRO  88           HA       PRO  88   4.311  -2.854 -11.127
  652    HB2  PRO  88           2HB      PRO  88   3.273  -0.128 -10.651
  653    HB3  PRO  88           1HB      PRO  88   3.998  -0.820 -12.103
  654    HG2  PRO  88           2HG      PRO  88   1.180  -0.660 -11.380
  655    HG3  PRO  88           1HG      PRO  88   1.899  -1.166 -12.922
  656    HD2  PRO  88           2HD      PRO  88   0.586  -2.908 -11.309
  657    HD3  PRO  88           1HD      PRO  88   2.000  -3.413 -12.270
  658    H    ARG  89           HN       ARG  89   6.110  -2.645 -10.076
  659    HA   ARG  89           HA       ARG  89   5.897  -2.370  -7.171
  660    HB2  ARG  89           2HB      ARG  89   8.365  -3.264  -8.594
  661    HB3  ARG  89           1HB      ARG  89   7.768  -3.734  -7.008
  662    HG2  ARG  89           2HG      ARG  89   5.927  -4.962  -8.149
  663    HG3  ARG  89           1HG      ARG  89   6.720  -4.605  -9.685
  664    HD2  ARG  89           2HD      ARG  89   8.806  -5.605  -8.514
  665    HD3  ARG  89           1HD      ARG  89   7.622  -6.357  -7.451
  666    HE   ARG  89           HE       ARG  89   7.031  -6.756 -10.232
  667   HH11  ARG  89          1HH1      ARG  89   8.923  -7.925  -7.523
  668   HH12  ARG  89          2HH1      ARG  89   9.097  -9.525  -8.179
  669   HH21  ARG  89          1HH2      ARG  89   7.298  -8.844 -11.109
  670   HH22  ARG  89          2HH2      ARG  89   8.210 -10.039 -10.235
  671    H    MET  90           HN       MET  90   6.974  -0.754  -9.898
  672    HA   MET  90           HA       MET  90   8.727   0.994  -8.329
  673    HB2  MET  90           2HB      MET  90   8.486   0.690 -11.330
  674    HB3  MET  90           1HB      MET  90   9.584   1.784 -10.502
  675    HG2  MET  90           2HG      MET  90  10.703  -0.139  -9.468
  676    HG3  MET  90           1HG      MET  90   9.628  -1.218 -10.356
  677    HE1  MET  90           3HE      MET  90  12.733   1.555 -12.337
  678    HE2  MET  90           1HE      MET  90  12.414   1.490 -10.604
  679    HE3  MET  90           2HE      MET  90  11.205   2.160 -11.701
  680    H    ALA  91           HN       ALA  91   8.172   3.048  -7.997
  681    HA   ALA  91           HA       ALA  91   5.672   3.990  -9.249
  682    HB1  ALA  91           1HB      ALA  91   5.329   3.459  -6.887
  683    HB2  ALA  91           2HB      ALA  91   5.192   5.195  -7.171
  684    HB3  ALA  91           3HB      ALA  91   6.657   4.532  -6.446
  685    H    ARG  92           HN       ARG  92   5.639   6.095  -9.966
  686    HA   ARG  92           HA       ARG  92   8.279   7.375 -10.028
  687    HB2  ARG  92           2HB      ARG  92   7.579   8.475 -12.076
  688    HB3  ARG  92           1HB      ARG  92   7.369   6.738 -12.231
  689    HG2  ARG  92           2HG      ARG  92   5.020   6.911 -12.031
  690    HG3  ARG  92           1HG      ARG  92   5.124   8.588 -11.487
  691    HD2  ARG  92           2HD      ARG  92   6.075   9.184 -13.704
  692    HD3  ARG  92           1HD      ARG  92   5.786   7.527 -14.231
  693    HE   ARG  92           HE       ARG  92   3.408   7.931 -13.933
  694   HH11  ARG  92          1HH1      ARG  92   5.501  10.742 -13.984
  695   HH12  ARG  92          2HH1      ARG  92   4.233  11.837 -14.441
  696   HH21  ARG  92          1HH2      ARG  92   1.742   9.371 -14.542
  697   HH22  ARG  92          2HH2      ARG  92   2.090  11.067 -14.736
  698    H    VAL  93           HN       VAL  93   8.546   9.403  -9.357
  699    HA   VAL  93           HA       VAL  93   6.174  10.811  -8.321
  700    HB   VAL  93           HB       VAL  93   7.750  10.081  -6.549
  701   HG11  VAL  93          1HG1      VAL  93   9.707  11.948  -7.886
  702   HG12  VAL  93          2HG1      VAL  93   9.826  10.188  -7.847
  703   HG13  VAL  93          3HG1      VAL  93   9.947  11.113  -6.351
  704   HG21  VAL  93          3HG2      VAL  93   7.950  12.251  -5.430
  705   HG22  VAL  93          1HG2      VAL  93   6.375  12.050  -6.196
  706   HG23  VAL  93          2HG2      VAL  93   7.603  13.065  -6.957
  707    H    GLN  94           HN       GLN  94   5.860  12.882  -8.963
  708    HA   GLN  94           HA       GLN  94   7.997  14.111 -10.578
  709    HB2  GLN  94           2HB      GLN  94   6.023  13.632 -11.937
  710    HB3  GLN  94           1HB      GLN  94   5.002  14.479 -10.786
  711    HG2  GLN  94           2HG      GLN  94   5.361  15.859 -12.712
  712    HG3  GLN  94           1HG      GLN  94   6.173  16.576 -11.329
  713   HE21  GLN  94          1HE2      GLN  94   6.602  16.919 -14.180
  714   HE22  GLN  94          2HE2      GLN  94   8.263  16.527 -14.453
  715    H    LEU  95           HN       LEU  95   8.927  15.754  -9.610
  716    HA   LEU  95           HA       LEU  95   7.394  17.276  -7.609
  717    HB2  LEU  95           2HB      LEU  95  10.329  16.555  -7.597
  718    HB3  LEU  95           1HB      LEU  95   9.577  17.665  -6.467
  719    HG   LEU  95           HG       LEU  95   8.906  14.733  -6.734
  720   HD11  LEU  95          1HD1      LEU  95  11.129  15.093  -5.802
  721   HD12  LEU  95          2HD1      LEU  95  10.015  14.504  -4.569
  722   HD13  LEU  95          3HD1      LEU  95  10.458  16.211  -4.613
  723   HD21  LEU  95          3HD2      LEU  95   6.992  16.044  -6.006
  724   HD22  LEU  95          1HD2      LEU  95   7.974  16.814  -4.756
  725   HD23  LEU  95          2HD2      LEU  95   7.625  15.088  -4.668
  726    H    GLU  96           HN       GLU  96   7.178  19.359  -8.075
  727    HA   GLU  96           HA       GLU  96   9.214  20.610  -9.787
  728    HB2  GLU  96           2HB      GLU  96   6.221  20.903 -10.077
  729    HB3  GLU  96           1HB      GLU  96   7.402  21.908 -10.907
  730    HG2  GLU  96           2HG      GLU  96   8.323  19.796 -11.916
  731    HG3  GLU  96           1HG      GLU  96   6.920  18.961 -11.250
  732    H    GLU  97           HN       GLU  97   9.704  22.710  -9.331
  733    HA   GLU  97           HA       GLU  97   9.021  23.632  -6.702
  734    HB2  GLU  97           2HB      GLU  97  11.258  23.985  -7.770
  735    HB3  GLU  97           1HB      GLU  97  10.498  25.087  -8.907
  736    HG2  GLU  97           2HG      GLU  97   9.759  26.435  -6.897
  737    HG3  GLU  97           1HG      GLU  97  10.860  25.434  -5.948
  738    H    ARG  98           HN       ARG  98   6.702  23.726  -7.031
  739    HA   ARG  98           HA       ARG  98   5.617  25.624  -8.874
  740    HB2  ARG  98           2HB      ARG  98   3.504  24.986  -7.988
  741    HB3  ARG  98           1HB      ARG  98   4.459  23.529  -8.126
  742    HG2  ARG  98           2HG      ARG  98   4.992  23.815  -5.675
  743    HG3  ARG  98           1HG      ARG  98   3.745  25.062  -5.643
  744    HD2  ARG  98           2HD      ARG  98   3.331  22.190  -6.480
  745    HD3  ARG  98           1HD      ARG  98   2.901  22.864  -4.911
  746    HE   ARG  98           HE       ARG  98   1.629  24.410  -6.848
  747   HH11  ARG  98          1HH1      ARG  98   1.549  21.126  -5.610
  748   HH12  ARG  98          2HH1      ARG  98  -0.110  20.859  -6.071
  749   HH21  ARG  98          1HH2      ARG  98  -0.550  24.061  -7.449
  750   HH22  ARG  98          2HH2      ARG  98  -1.310  22.538  -7.101
  751    H    GLN  99           HN       GLN  99   4.415  27.505  -8.241
  752    HA   GLN  99           HA       GLN  99   5.799  28.868  -6.059
  753    HB2  GLN  99           2HB      GLN  99   5.297  29.718  -8.578
  754    HB3  GLN  99           1HB      GLN  99   3.894  30.379  -7.751
  755    HG2  GLN  99           2HG      GLN  99   6.794  30.930  -7.179
  756    HG3  GLN  99           1HG      GLN  99   5.580  32.056  -7.778
  757   HE21  GLN  99          1HE2      GLN  99   6.881  30.429  -5.023
  758   HE22  GLN  99          2HE2      GLN  99   5.985  31.305  -3.823
  759    H    THR 100           HN       THR 100   4.716  27.936  -4.344
  760    HA   THR 100           HA       THR 100   1.930  28.805  -3.986
  761    HB   THR 100           HB       THR 100   3.494  26.821  -2.309
  762    HG1  THR 100           1HG      THR 100   1.934  26.520  -4.635
  763   HG21  THR 100          3HG2      THR 100   1.606  27.857  -1.144
  764   HG22  THR 100          1HG2      THR 100   1.275  26.160  -1.485
  765   HG23  THR 100          2HG2      THR 100   0.534  27.419  -2.474
  766    H    VAL 101           HN       VAL 101   1.411  30.136  -2.251
  767    HA   VAL 101           HA       VAL 101   3.259  32.013  -1.424
  768    HB   VAL 101           HB       VAL 101   1.662  32.575   0.439
  769   HG11  VAL 101          1HG1      VAL 101  -0.083  33.378  -1.065
  770   HG12  VAL 101          2HG1      VAL 101   0.482  32.273  -2.319
  771   HG13  VAL 101          3HG1      VAL 101   1.517  33.593  -1.778
  772   HG21  VAL 101          3HG2      VAL 101   0.040  30.328  -0.760
  773   HG22  VAL 101          1HG2      VAL 101  -0.510  31.460   0.476
  774   HG23  VAL 101          2HG2      VAL 101   0.787  30.318   0.836
  775    H    SER 102           HN       SER 102   4.988  31.866  -0.238
  776    HA   SER 102           HA       SER 102   5.349  29.617   1.555
  777    HB2  SER 102           2HB      SER 102   7.274  31.854   0.862
  778    HB3  SER 102           1HB      SER 102   7.673  30.338   1.675
  779    HG   SER 102           HG       SER 102   6.373  29.923  -0.681
  780    H    VAL 103           HN       VAL 103   3.771  30.236   3.124
  781    HA   VAL 103           HA       VAL 103   4.518  32.533   4.791
  782    HB   VAL 103           HB       VAL 103   2.293  32.225   5.865
  783   HG11  VAL 103          1HG1      VAL 103   2.259  32.584   2.871
  784   HG12  VAL 103          2HG1      VAL 103   2.550  33.841   4.073
  785   HG13  VAL 103          3HG1      VAL 103   0.968  33.069   3.969
  786   HG21  VAL 103          3HG2      VAL 103   1.879  30.167   3.696
  787   HG22  VAL 103          1HG2      VAL 103   0.624  30.785   4.771
  788   HG23  VAL 103          2HG2      VAL 103   1.969  29.849   5.428
  789    HA   PRO 104           HA       PRO 104   6.189  29.866   7.878
  790    HB2  PRO 104           2HB      PRO 104   5.288  31.806   9.893
  791    HB3  PRO 104           1HB      PRO 104   6.929  31.329   9.452
  792    HG2  PRO 104           2HG      PRO 104   5.936  33.749   8.828
  793    HG3  PRO 104           1HG      PRO 104   7.072  32.896   7.763
  794    HD2  PRO 104           2HD      PRO 104   4.096  33.157   7.548
  795    HD3  PRO 104           1HD      PRO 104   5.327  33.247   6.270
  796    H    VAL 105           HN       VAL 105   4.762  28.132   7.850
  797    HA   VAL 105           HA       VAL 105   2.454  28.286   9.643
  798    HB   VAL 105           HB       VAL 105   1.953  25.951   8.740
  799   HG11  VAL 105          1HG1      VAL 105   1.957  28.290   6.831
  800   HG12  VAL 105          2HG1      VAL 105   0.726  27.937   8.045
  801   HG13  VAL 105          3HG1      VAL 105   0.957  26.844   6.679
  802   HG21  VAL 105          3HG2      VAL 105   4.011  26.785   6.693
  803   HG22  VAL 105          1HG2      VAL 105   2.943  25.383   6.572
  804   HG23  VAL 105          2HG2      VAL 105   4.171  25.454   7.837
  805    H    THR 106           HN       THR 106   3.464  28.277  11.618
  806    HA   THR 106           HA       THR 106   5.362  26.154  12.226
  807    HB   THR 106           HB       THR 106   4.465  28.299  14.134
  808    HG1  THR 106           1HG      THR 106   6.329  28.460  11.983
  809   HG21  THR 106          3HG2      THR 106   6.749  28.022  15.011
  810   HG22  THR 106          1HG2      THR 106   7.051  26.774  13.802
  811   HG23  THR 106          2HG2      THR 106   5.844  26.509  15.057
  812    H    VAL 107           HN       VAL 107   2.077  26.877  12.601
  813    HA   VAL 107           HA       VAL 107   1.690  25.203  14.931
  814    HB   VAL 107           HB       VAL 107  -0.456  26.260  13.083
  815   HG11  VAL 107          1HG1      VAL 107  -1.184  24.485  14.565
  816   HG12  VAL 107          2HG1      VAL 107  -1.888  26.025  15.062
  817   HG13  VAL 107          3HG1      VAL 107  -0.524  25.349  15.955
  818   HG21  VAL 107          3HG2      VAL 107  -0.697  28.136  14.651
  819   HG22  VAL 107          1HG2      VAL 107   0.885  28.136  13.871
  820   HG23  VAL 107          2HG2      VAL 107   0.723  27.572  15.533
  821    H    GLU 108           HN       GLU 108   1.904  23.100  14.713
  822    HA   GLU 108           HA       GLU 108   1.488  21.822  12.129
  823    HB2  GLU 108           2HB      GLU 108   3.579  21.407  13.270
  824    HB3  GLU 108           1HB      GLU 108   2.732  20.897  14.721
  825    HG2  GLU 108           2HG      GLU 108   1.825  18.973  13.469
  826    HG3  GLU 108           1HG      GLU 108   2.792  19.469  12.078
  827    H    MET 109           HN       MET 109  -0.349  20.788  11.675
  828    HA   MET 109           HA       MET 109  -1.832  19.520  13.889
  829    HB2  MET 109           2HB      MET 109  -3.137  20.453  11.335
  830    HB3  MET 109           1HB      MET 109  -3.914  19.930  12.816
  831    HG2  MET 109           2HG      MET 109  -4.230  22.176  12.942
  832    HG3  MET 109           1HG      MET 109  -2.713  22.015  13.826
  833    HE1  MET 109           3HE      MET 109  -4.100  24.622  12.258
  834    HE2  MET 109           1HE      MET 109  -2.631  25.425  11.707
  835    HE3  MET 109           2HE      MET 109  -2.717  24.763  13.341
  836    H    ILE 110           HN       ILE 110  -2.678  17.466  13.482
  837    HA   ILE 110           HA       ILE 110  -2.146  16.334  10.829
  838    HB   ILE 110           HB       ILE 110  -0.431  15.396  12.187
  839   HG12  ILE 110          2HG1      ILE 110  -2.664  13.368  11.944
  840   HG13  ILE 110          1HG1      ILE 110  -1.577  13.854  10.648
  841   HG21  ILE 110          1HG2      ILE 110  -2.552  14.635  14.184
  842   HG22  ILE 110          2HG2      ILE 110  -1.329  15.888  14.380
  843   HG23  ILE 110          3HG2      ILE 110  -0.846  14.196  14.275
  844   HD11  ILE 110          3HD1      ILE 110   0.315  12.956  11.895
  845   HD12  ILE 110          1HD1      ILE 110  -0.915  11.728  11.593
  846   HD13  ILE 110          2HD1      ILE 110  -0.776  12.463  13.190
  847    H    ASN 111           HN       ASN 111  -4.213  16.569  10.149
  848    HA   ASN 111           HA       ASN 111  -6.260  15.049  11.638
  849    HB2  ASN 111           2HB      ASN 111  -6.616  17.550  11.466
  850    HB3  ASN 111           1HB      ASN 111  -6.753  17.342   9.724
  851   HD21  ASN 111          1HD2      ASN 111  -8.274  16.896  12.791
  852   HD22  ASN 111          2HD2      ASN 111  -9.830  16.416  12.191
  853    H    LEU 112           HN       LEU 112  -7.546  13.610  10.487
  854    HA   LEU 112           HA       LEU 112  -7.025  13.387   7.603
  855    HB2  LEU 112           2HB      LEU 112  -6.896  10.966   7.733
  856    HB3  LEU 112           1HB      LEU 112  -5.636  11.702   8.697
  857    HG   LEU 112           HG       LEU 112  -8.184  10.748   9.976
  858   HD11  LEU 112          1HD1      LEU 112  -5.717   9.124   9.376
  859   HD12  LEU 112          2HD1      LEU 112  -7.337   8.853   8.731
  860   HD13  LEU 112          3HD1      LEU 112  -7.023   8.628  10.453
  861   HD21  LEU 112          3HD2      LEU 112  -6.746  10.531  11.938
  862   HD22  LEU 112          1HD2      LEU 112  -6.702  12.175  11.303
  863   HD23  LEU 112          2HD2      LEU 112  -5.360  11.073  10.993
  864    H    GLU 113           HN       GLU 113  -9.247  14.013   9.820
  865    HA   GLU 113           HA       GLU 113 -11.363  12.309   8.760
  866    HB2  GLU 113           2HB      GLU 113 -11.178  12.702  11.209
  867    HB3  GLU 113           1HB      GLU 113 -11.481  14.410  10.937
  868    HG2  GLU 113           2HG      GLU 113 -13.458  13.156  11.724
  869    HG3  GLU 113           1HG      GLU 113 -13.701  13.966  10.178
  870    H    HIS 114           HN       HIS 114  -9.885  14.976   7.718
  871    HA   HIS 114           HA       HIS 114 -12.020  16.702   7.031
  872    HB2  HIS 114           2HB      HIS 114  -9.664  17.428   6.937
  873    HB3  HIS 114           1HB      HIS 114  -9.368  16.302   5.616
  874    HD1  HIS 114           1HD      HIS 114  -9.816  17.132   3.285
  875    HD2  HIS 114           2HD      HIS 114 -11.448  19.603   6.212
  876    HE1  HIS 114           1HE      HIS 114 -10.636  19.178   2.072
  877    HE2  HIS 114           2HE      HIS 114 -11.435  20.740   3.884
  878    H    HIS 115           HN       HIS 115 -13.705  15.473   6.272
  879    HA   HIS 115           HA       HIS 115 -13.299  14.287   3.609
  880    HB2  HIS 115           2HB      HIS 115 -15.098  13.382   5.857
  881    HB3  HIS 115           1HB      HIS 115 -15.321  12.849   4.193
  882    HD1  HIS 115           1HD      HIS 115 -13.628  11.918   7.244
  883    HD2  HIS 115           2HD      HIS 115 -12.849  11.546   3.166
  884    HE1  HIS 115           1HE      HIS 115 -11.887  10.111   7.040
  885    HE2  HIS 115           2HE      HIS 115 -11.546   9.798   4.557
  886    H    HIS 116           HN       HIS 116 -14.702  14.845   2.022
  887    HA   HIS 116           HA       HIS 116 -16.260  17.250   2.587
  888    HB2  HIS 116           2HB      HIS 116 -14.534  16.966   0.667
  889    HB3  HIS 116           1HB      HIS 116 -15.813  16.073  -0.148
  890    HD1  HIS 116           1HD      HIS 116 -17.428  17.426  -1.461
  891    HD2  HIS 116           2HD      HIS 116 -15.340  19.714   1.317
  892    HE1  HIS 116           1HE      HIS 116 -18.069  19.818  -1.927
  893    HE2  HIS 116           2HE      HIS 116 -16.623  21.189  -0.384
  894    H    HIS 117           HN       HIS 117 -18.343  17.087   2.973
  895    HA   HIS 117           HA       HIS 117 -20.007  15.248   1.463
  896    HB2  HIS 117           2HB      HIS 117 -21.039  14.270   3.495
  897    HB3  HIS 117           1HB      HIS 117 -19.339  13.842   3.348
  898    HD1  HIS 117           1HD      HIS 117 -21.770  15.380   5.623
  899    HD2  HIS 117           2HD      HIS 117 -17.633  15.311   5.196
  900    HE1  HIS 117           1HE      HIS 117 -20.848  16.238   7.799
  901    HE2  HIS 117           2HE      HIS 117 -18.361  16.423   7.413
  902    H    HIS 118           HN       HIS 118 -21.923  16.173   1.026
  903    HA   HIS 118           HA       HIS 118 -23.140  18.029   2.858
  904    HB2  HIS 118           2HB      HIS 118 -23.199  19.941   1.309
  905    HB3  HIS 118           1HB      HIS 118 -21.555  19.539   1.777
  906    HD1  HIS 118           1HD      HIS 118 -23.656  20.144  -1.124
  907    HD2  HIS 118           2HD      HIS 118 -20.120  18.094  -0.346
  908    HE1  HIS 118           1HE      HIS 118 -22.558  19.808  -3.363
  909    HE2  HIS 118           2HE      HIS 118 -20.337  18.728  -2.851
  910    H    HIS 119           HN       HIS 119 -25.291  18.413   2.425
  911    HA   HIS 119           HA       HIS 119 -26.465  17.723  -0.091
  912    HB2  HIS 119           2HB      HIS 119 -28.010  16.024   0.700
  913    HB3  HIS 119           1HB      HIS 119 -26.360  15.483   0.968
  914    HD1  HIS 119           1HD      HIS 119 -29.517  16.341   2.724
  915    HD2  HIS 119           2HD      HIS 119 -25.607  15.307   3.702
  916    HE1  HIS 119           1HE      HIS 119 -29.564  15.734   5.162
  917    HE2  HIS 119           2HE      HIS 119 -27.157  15.324   5.777
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1   2.532 -23.830  16.403
    2    H2   MET   1           H2       MET   1   4.190 -24.197  16.431
    3    H3   MET   1           H3       MET   1   3.082 -25.219  17.201
    4    HA   MET   1           HA       MET   1   3.922 -26.052  15.045
    5    HB2  MET   1           2HB      MET   1   0.967 -25.551  15.403
    6    HB3  MET   1           1HB      MET   1   1.619 -26.609  14.161
    7    HG2  MET   1           2HG      MET   1   1.990 -26.960  17.126
    8    HG3  MET   1           1HG      MET   1   0.844 -27.842  16.120
    9    HE1  MET   1           2HE      MET   1   2.916 -29.306  18.014
   10    HE2  MET   1           3HE      MET   1   3.485 -30.591  16.949
   11    HE3  MET   1           1HE      MET   1   1.777 -30.152  16.966
   12    HA   PRO   2           HA       PRO   2   4.164 -22.671  12.055
   13    HB2  PRO   2           2HB      PRO   2   5.459 -24.801  10.466
   14    HB3  PRO   2           1HB      PRO   2   6.060 -23.196  10.890
   15    HG2  PRO   2           2HG      PRO   2   7.061 -25.401  12.031
   16    HG3  PRO   2           1HG      PRO   2   6.864 -23.892  12.943
   17    HD2  PRO   2           2HD      PRO   2   5.165 -26.359  12.972
   18    HD3  PRO   2           1HD      PRO   2   5.658 -25.311  14.318
   19    H    THR   3           HN       THR   3   2.295 -22.299  11.028
   20    HA   THR   3           HA       THR   3   0.580 -24.377  10.160
   21    HB   THR   3           HB       THR   3  -0.758 -22.502   9.120
   22    HG1  THR   3           1HG      THR   3   1.234 -20.888  10.395
   23   HG21  THR   3          3HG2      THR   3  -1.215 -23.303  11.369
   24   HG22  THR   3          1HG2      THR   3  -1.418 -21.553  11.289
   25   HG23  THR   3          2HG2      THR   3   0.032 -22.240  12.020
   26    H    PHE   4           HN       PHE   4   0.241 -25.268   8.248
   27    HA   PHE   4           HA       PHE   4   2.081 -24.670   6.097
   28    HB2  PHE   4           2HB      PHE   4   0.150 -26.922   6.534
   29    HB3  PHE   4           1HB      PHE   4   1.215 -26.785   5.154
   30    HD1  PHE   4           1HD      PHE   4   3.701 -26.848   5.517
   31    HD2  PHE   4           2HD      PHE   4   0.901 -27.818   8.579
   32    HE1  PHE   4           1HE      PHE   4   5.478 -27.990   6.779
   33    HE2  PHE   4           2HE      PHE   4   2.676 -28.959   9.843
   34    HZ   PHE   4           HZ       PHE   4   4.969 -29.044   8.947
   35    H    ASP   5           HN       ASP   5   0.595 -25.585   3.948
   36    HA   ASP   5           HA       ASP   5  -0.823 -24.920   2.329
   37    HB2  ASP   5           2HB      ASP   5  -2.627 -25.517   3.836
   38    HB3  ASP   5           1HB      ASP   5  -2.513 -23.957   4.640
   39    H    HIS   6           HN       HIS   6   0.249 -23.465   1.197
   40    HA   HIS   6           HA       HIS   6   0.686 -20.789   2.152
   41    HB2  HIS   6           2HB      HIS   6   1.293 -22.233  -0.411
   42    HB3  HIS   6           1HB      HIS   6   1.457 -20.485  -0.311
   43    HD1  HIS   6           1HD      HIS   6   3.662 -19.685   0.363
   44    HD2  HIS   6           2HD      HIS   6   2.965 -23.569   1.684
   45    HE1  HIS   6           1HE      HIS   6   5.821 -20.440   1.430
   46    HE2  HIS   6           2HE      HIS   6   5.436 -22.862   2.014
   47    H    GLY   7           HN       GLY   7  -1.163 -19.701   2.418
   48    HA2  GLY   7           2HA      GLY   7  -3.034 -19.572   0.147
   49    HA3  GLY   7           1HA      GLY   7  -3.402 -19.101   1.805
   50    H    ASN   8           HN       ASN   8  -4.143 -17.266   0.150
   51    HA   ASN   8           HA       ASN   8  -2.000 -15.258   0.288
   52    HB2  ASN   8           2HB      ASN   8  -4.103 -15.558  -1.853
   53    HB3  ASN   8           1HB      ASN   8  -3.088 -14.141  -1.675
   54   HD21  ASN   8          1HD2      ASN   8  -0.986 -14.196  -2.295
   55   HD22  ASN   8          2HD2      ASN   8  -0.287 -15.535  -3.154
   56    H    LEU   9           HN       LEU   9  -2.698 -13.112   0.650
   57    HA   LEU   9           HA       LEU   9  -5.399 -12.801   1.739
   58    HB2  LEU   9           2HB      LEU   9  -3.966 -13.476   3.621
   59    HB3  LEU   9           1HB      LEU   9  -2.876 -12.149   3.266
   60    HG   LEU   9           HG       LEU   9  -4.737 -10.556   3.753
   61   HD11  LEU   9          1HD1      LEU   9  -6.684 -11.412   4.985
   62   HD12  LEU   9          2HD1      LEU   9  -6.149 -13.061   4.659
   63   HD13  LEU   9          3HD1      LEU   9  -6.624 -12.007   3.327
   64   HD21  LEU   9          3HD2      LEU   9  -4.626 -10.820   6.179
   65   HD22  LEU   9          1HD2      LEU   9  -3.050 -11.081   5.432
   66   HD23  LEU   9          2HD2      LEU   9  -4.007 -12.459   5.979
   67    H    SER  10           HN       SER  10  -6.254 -10.984   0.992
   68    HA   SER  10           HA       SER  10  -4.630  -8.976  -0.270
   69    HB2  SER  10           2HB      SER  10  -7.604  -8.967   0.313
   70    HB3  SER  10           1HB      SER  10  -6.759  -7.905  -0.813
   71    HG   SER  10           HG       SER  10  -6.137  -9.883  -1.946
   72    H    LEU  11           HN       LEU  11  -3.799  -7.221   0.697
   73    HA   LEU  11           HA       LEU  11  -4.792  -6.421   3.321
   74    HB2  LEU  11           2HB      LEU  11  -2.524  -5.356   1.633
   75    HB3  LEU  11           1HB      LEU  11  -2.953  -4.737   3.216
   76    HG   LEU  11           HG       LEU  11  -1.964  -7.527   2.615
   77   HD11  LEU  11          1HD1      LEU  11  -0.239  -5.805   2.429
   78   HD12  LEU  11          2HD1      LEU  11   0.026  -6.843   3.830
   79   HD13  LEU  11          3HD1      LEU  11  -0.644  -5.225   4.047
   80   HD21  LEU  11          3HD2      LEU  11  -1.921  -7.837   5.032
   81   HD22  LEU  11          1HD2      LEU  11  -3.561  -7.491   4.479
   82   HD23  LEU  11          2HD2      LEU  11  -2.609  -6.230   5.264
   83    H    GLY  12           HN       GLY  12  -5.509  -5.903   0.158
   84    HA2  GLY  12           2HA      GLY  12  -7.296  -4.549  -0.582
   85    HA3  GLY  12           1HA      GLY  12  -7.015  -3.479   0.787
   86    H    GLU  13           HN       GLU  13  -7.328  -2.074  -1.299
   87    HA   GLU  13           HA       GLU  13  -4.815  -1.659  -2.695
   88    HB2  GLU  13           2HB      GLU  13  -6.118   0.270  -3.755
   89    HB3  GLU  13           1HB      GLU  13  -6.673  -1.358  -4.117
   90    HG2  GLU  13           2HG      GLU  13  -8.423  -1.118  -2.409
   91    HG3  GLU  13           1HG      GLU  13  -7.884   0.536  -2.115
   92    H    LEU  14           HN       LEU  14  -3.263  -0.531  -1.789
   93    HA   LEU  14           HA       LEU  14  -3.951   1.159   0.491
   94    HB2  LEU  14           2HB      LEU  14  -1.291   0.048  -0.389
   95    HB3  LEU  14           1HB      LEU  14  -1.562   1.004   1.056
   96    HG   LEU  14           HG       LEU  14  -2.743  -1.713   0.502
   97   HD11  LEU  14          1HD1      LEU  14  -1.285  -2.461   2.322
   98   HD12  LEU  14          2HD1      LEU  14  -0.591  -0.843   2.426
   99   HD13  LEU  14          3HD1      LEU  14  -0.353  -1.812   0.972
  100   HD21  LEU  14          3HD2      LEU  14  -2.903  -0.020   2.991
  101   HD22  LEU  14          1HD2      LEU  14  -3.626  -1.610   2.748
  102   HD23  LEU  14          2HD2      LEU  14  -4.211  -0.225   1.825
  103    H    GLU  15           HN       GLU  15  -3.639   3.242   0.551
  104    HA   GLU  15           HA       GLU  15  -2.978   4.658  -1.859
  105    HB2  GLU  15           2HB      GLU  15  -3.523   5.732   0.922
  106    HB3  GLU  15           1HB      GLU  15  -3.533   6.659  -0.574
  107    HG2  GLU  15           2HG      GLU  15  -5.461   5.459  -1.367
  108    HG3  GLU  15           1HG      GLU  15  -5.408   4.380   0.024
  109    H    LEU  16           HN       LEU  16  -1.136   5.827  -2.271
  110    HA   LEU  16           HA       LEU  16   1.195   4.887  -0.850
  111    HB2  LEU  16           2HB      LEU  16   1.108   5.014  -3.317
  112    HB3  LEU  16           1HB      LEU  16   0.967   6.758  -3.211
  113    HG   LEU  16           HG       LEU  16   3.225   6.743  -2.047
  114   HD11  LEU  16          1HD1      LEU  16   4.634   4.784  -2.472
  115   HD12  LEU  16          2HD1      LEU  16   3.228   3.923  -3.099
  116   HD13  LEU  16          3HD1      LEU  16   3.280   4.411  -1.404
  117   HD21  LEU  16          3HD2      LEU  16   2.927   7.420  -4.375
  118   HD22  LEU  16          1HD2      LEU  16   3.092   5.742  -4.890
  119   HD23  LEU  16          2HD2      LEU  16   4.457   6.574  -4.142
  120    H    THR  17           HN       THR  17   2.499   5.998   0.472
  121    HA   THR  17           HA       THR  17   1.862   8.824   0.988
  122    HB   THR  17           HB       THR  17   3.339   6.891   2.789
  123    HG1  THR  17           1HG      THR  17   0.855   6.761   2.269
  124   HG21  THR  17          3HG2      THR  17   2.211   9.653   3.292
  125   HG22  THR  17          1HG2      THR  17   3.918   9.221   3.216
  126   HG23  THR  17          2HG2      THR  17   2.911   8.602   4.524
  127    H    VAL  18           HN       VAL  18   3.258  10.219   0.119
  128    HA   VAL  18           HA       VAL  18   5.964   9.262  -0.521
  129    HB   VAL  18           HB       VAL  18   4.495  11.636  -1.681
  130   HG11  VAL  18          1HG1      VAL  18   6.927  11.880  -1.735
  131   HG12  VAL  18          2HG1      VAL  18   6.272  11.654  -3.357
  132   HG13  VAL  18          3HG1      VAL  18   7.069  10.313  -2.535
  133   HG21  VAL  18          3HG2      VAL  18   4.262  10.264  -3.703
  134   HG22  VAL  18          1HG2      VAL  18   3.411   9.559  -2.328
  135   HG23  VAL  18          2HG2      VAL  18   4.960   8.892  -2.843
  136    H    LEU  19           HN       LEU  19   7.688  10.118   0.404
  137    HA   LEU  19           HA       LEU  19   7.385  12.511   2.075
  138    HB2  LEU  19           2HB      LEU  19   9.643  10.500   1.940
  139    HB3  LEU  19           1HB      LEU  19   9.518  11.829   3.079
  140    HG   LEU  19           HG       LEU  19   7.600   9.496   2.943
  141   HD11  LEU  19          1HD1      LEU  19   8.663   8.759   5.011
  142   HD12  LEU  19          2HD1      LEU  19   9.826  10.080   4.889
  143   HD13  LEU  19          3HD1      LEU  19   9.819   8.798   3.679
  144   HD21  LEU  19          3HD2      LEU  19   6.774  10.365   5.072
  145   HD22  LEU  19          1HD2      LEU  19   6.587  11.561   3.788
  146   HD23  LEU  19          2HD2      LEU  19   7.894  11.722   4.961
  147    H    TYR  20           HN       TYR  20   8.057  14.380   1.240
  148    HA   TYR  20           HA       TYR  20  10.239  14.446  -0.701
  149    HB2  TYR  20           2HB      TYR  20   8.827  15.882  -2.224
  150    HB3  TYR  20           1HB      TYR  20   8.333  14.194  -2.148
  151    HD1  TYR  20           2HD      TYR  20   6.274  13.552  -0.964
  152    HD2  TYR  20           1HD      TYR  20   7.381  17.640  -1.401
  153    HE1  TYR  20           2HE      TYR  20   3.991  14.229  -0.356
  154    HE2  TYR  20           1HE      TYR  20   5.099  18.327  -0.790
  155    HH   TYR  20           HH       TYR  20   2.899  16.280   0.668
  156    H    ASP  21           HN       ASP  21  10.043  17.078  -1.476
  157    HA   ASP  21           HA       ASP  21  10.040  18.533   1.079
  158    HB2  ASP  21           2HB      ASP  21  12.323  18.275   0.152
  159    HB3  ASP  21           1HB      ASP  21  11.798  19.105  -1.313
  160    H    GLU  22           HN       GLU  22   8.205  19.618   1.123
  161    HA   GLU  22           HA       GLU  22   6.945  20.591  -1.275
  162    HB2  GLU  22           2HB      GLU  22   5.220  21.451   0.312
  163    HB3  GLU  22           1HB      GLU  22   5.538  19.727   0.465
  164    HG2  GLU  22           2HG      GLU  22   6.901  20.116   2.420
  165    HG3  GLU  22           1HG      GLU  22   6.702  21.858   2.245
  166    H    GLU  23           HN       GLU  23   9.370  21.814   0.665
  167    HA   GLU  23           HA       GLU  23   8.585  24.573   0.618
  168    HB2  GLU  23           2HB      GLU  23  11.191  23.212   1.287
  169    HB3  GLU  23           1HB      GLU  23  10.896  24.935   1.475
  170    HG2  GLU  23           2HG      GLU  23   9.276  22.804   2.831
  171    HG3  GLU  23           1HG      GLU  23  10.672  23.593   3.556
  172    H    ARG  24           HN       ARG  24   9.584  22.574  -1.791
  173    HA   ARG  24           HA       ARG  24  10.649  24.846  -3.307
  174    HB2  ARG  24           2HB      ARG  24  12.480  23.264  -2.454
  175    HB3  ARG  24           1HB      ARG  24  11.832  22.093  -3.592
  176    HG2  ARG  24           2HG      ARG  24  13.684  23.169  -4.622
  177    HG3  ARG  24           1HG      ARG  24  12.220  23.755  -5.413
  178    HD2  ARG  24           2HD      ARG  24  12.964  25.387  -3.131
  179    HD3  ARG  24           1HD      ARG  24  14.252  25.299  -4.329
  180    HE   ARG  24           HE       ARG  24  11.724  25.859  -5.536
  181   HH11  ARG  24          1HH1      ARG  24  14.302  27.338  -3.677
  182   HH12  ARG  24          2HH1      ARG  24  14.075  28.908  -4.387
  183   HH21  ARG  24          1HH2      ARG  24  11.403  27.911  -6.442
  184   HH22  ARG  24          2HH2      ARG  24  12.430  29.240  -5.957
  185    H    TYR  25           HN       TYR  25   9.838  21.396  -3.734
  186    HA   TYR  25           HA       TYR  25   8.489  22.133  -6.247
  187    HB2  TYR  25           2HB      TYR  25   9.535  19.429  -5.361
  188    HB3  TYR  25           1HB      TYR  25   8.768  19.774  -6.904
  189    HD1  TYR  25           2HD      TYR  25   9.949  21.561  -8.395
  190    HD2  TYR  25           1HD      TYR  25  11.838  19.522  -5.173
  191    HE1  TYR  25           2HE      TYR  25  12.150  22.056  -9.378
  192    HE2  TYR  25           1HE      TYR  25  14.043  20.007  -6.145
  193    HH   TYR  25           HH       TYR  25  14.555  22.279  -8.525
  194    H    ASP  26           HN       ASP  26   6.538  21.035  -6.799
  195    HA   ASP  26           HA       ASP  26   5.022  20.035  -4.484
  196    HB2  ASP  26           2HB      ASP  26   4.009  21.697  -6.808
  197    HB3  ASP  26           1HB      ASP  26   2.985  20.978  -5.570
  198    H    ILE  27           HN       ILE  27   3.206  18.582  -5.137
  199    HA   ILE  27           HA       ILE  27   4.259  16.527  -6.825
  200    HB   ILE  27           HB       ILE  27   1.540  16.704  -5.514
  201   HG12  ILE  27          2HG1      ILE  27   4.069  15.325  -4.582
  202   HG13  ILE  27          1HG1      ILE  27   3.418  16.816  -3.905
  203   HG21  ILE  27          1HG2      ILE  27   1.485  14.272  -5.800
  204   HG22  ILE  27          2HG2      ILE  27   3.020  14.342  -6.665
  205   HG23  ILE  27          3HG2      ILE  27   1.587  15.109  -7.349
  206   HD11  ILE  27          3HD1      ILE  27   2.887  14.901  -2.509
  207   HD12  ILE  27          1HD1      ILE  27   2.068  14.123  -3.865
  208   HD13  ILE  27          2HD1      ILE  27   1.422  15.615  -3.183
  209    H    VAL  28           HN       VAL  28   4.052  16.396  -8.934
  210    HA   VAL  28           HA       VAL  28   1.835  17.773 -10.283
  211    HB   VAL  28           HB       VAL  28   4.362  16.573 -11.442
  212   HG11  VAL  28          1HG1      VAL  28   2.208  18.241 -12.739
  213   HG12  VAL  28          2HG1      VAL  28   2.549  16.543 -13.065
  214   HG13  VAL  28          3HG1      VAL  28   3.730  17.779 -13.497
  215   HG21  VAL  28          3HG2      VAL  28   3.596  19.456 -10.984
  216   HG22  VAL  28          1HG2      VAL  28   5.073  18.888 -11.762
  217   HG23  VAL  28          2HG2      VAL  28   4.788  18.547 -10.054
  218    H    GLU  29           HN       GLU  29   3.523  14.658 -10.233
  219    HA   GLU  29           HA       GLU  29   0.973  13.334 -10.811
  220    HB2  GLU  29           2HB      GLU  29   3.633  12.650 -12.080
  221    HB3  GLU  29           1HB      GLU  29   2.209  11.625 -12.155
  222    HG2  GLU  29           2HG      GLU  29   1.013  13.506 -13.276
  223    HG3  GLU  29           1HG      GLU  29   2.556  14.356 -13.354
  224    H    GLN  30           HN       GLN  30   0.849  11.166  -9.962
  225    HA   GLN  30           HA       GLN  30   2.916  10.256  -8.163
  226    HB2  GLN  30           2HB      GLN  30   1.651  12.071  -6.919
  227    HB3  GLN  30           1HB      GLN  30   0.229  11.048  -7.020
  228    HG2  GLN  30           2HG      GLN  30   1.494   9.286  -5.799
  229    HG3  GLN  30           1HG      GLN  30   2.795  10.453  -5.572
  230   HE21  GLN  30          1HE2      GLN  30   0.804  12.656  -5.324
  231   HE22  GLN  30          2HE2      GLN  30   0.168  12.506  -3.724
  232    H    THR  31           HN       THR  31   2.502   8.105  -7.393
  233    HA   THR  31           HA       THR  31   0.415   6.689  -8.866
  234    HB   THR  31           HB       THR  31   2.552   5.568  -7.037
  235    HG1  THR  31           1HG      THR  31   3.219   6.715  -9.071
  236   HG21  THR  31          3HG2      THR  31   0.671   4.052  -7.325
  237   HG22  THR  31          1HG2      THR  31   2.071   3.444  -8.209
  238   HG23  THR  31          2HG2      THR  31   0.756   4.242  -9.075
  239    H    GLU  32           HN       GLU  32  -1.540   6.690  -7.923
  240    HA   GLU  32           HA       GLU  32  -1.855   7.674  -5.291
  241    HB2  GLU  32           2HB      GLU  32  -3.893   6.428  -7.134
  242    HB3  GLU  32           1HB      GLU  32  -4.262   7.332  -5.669
  243    HG2  GLU  32           2HG      GLU  32  -3.216   9.317  -6.634
  244    HG3  GLU  32           1HG      GLU  32  -2.865   8.411  -8.105
  245    H    THR  33           HN       THR  33  -2.752   4.478  -6.649
  246    HA   THR  33           HA       THR  33  -2.501   3.427  -3.910
  247    HB   THR  33           HB       THR  33  -4.425   1.862  -4.521
  248    HG1  THR  33           1HG      THR  33  -4.727   2.205  -6.679
  249   HG21  THR  33          3HG2      THR  33  -6.120   3.490  -3.841
  250   HG22  THR  33          1HG2      THR  33  -5.008   4.809  -4.205
  251   HG23  THR  33          2HG2      THR  33  -4.642   3.682  -2.898
  252    H    VAL  34           HN       VAL  34  -1.696   1.395  -3.671
  253    HA   VAL  34           HA       VAL  34  -1.186  -0.194  -6.100
  254    HB   VAL  34           HB       VAL  34   0.872  -1.101  -4.955
  255   HG11  VAL  34          1HG1      VAL  34   1.033   0.487  -6.798
  256   HG12  VAL  34          2HG1      VAL  34   2.307   0.764  -5.612
  257   HG13  VAL  34          3HG1      VAL  34   0.904   1.831  -5.662
  258   HG21  VAL  34          3HG2      VAL  34   1.931   0.289  -3.235
  259   HG22  VAL  34          1HG2      VAL  34   0.388  -0.363  -2.683
  260   HG23  VAL  34          2HG2      VAL  34   0.503   1.322  -3.193
  261    H    GLN  35           HN       GLN  35  -1.126  -2.521  -5.709
  262    HA   GLN  35           HA       GLN  35  -2.821  -3.218  -3.419
  263    HB2  GLN  35           2HB      GLN  35  -2.361  -4.690  -6.014
  264    HB3  GLN  35           1HB      GLN  35  -3.322  -5.311  -4.681
  265    HG2  GLN  35           2HG      GLN  35  -4.978  -4.436  -5.942
  266    HG3  GLN  35           1HG      GLN  35  -4.581  -3.009  -4.989
  267   HE21  GLN  35          1HE2      GLN  35  -4.368  -4.531  -8.102
  268   HE22  GLN  35          2HE2      GLN  35  -3.895  -3.124  -8.989
  269    H    VAL  36           HN       VAL  36  -2.176  -4.588  -1.904
  270    HA   VAL  36           HA       VAL  36   0.402  -5.974  -2.283
  271    HB   VAL  36           HB       VAL  36  -0.585  -4.771   0.314
  272   HG11  VAL  36          1HG1      VAL  36   0.771  -6.769   0.626
  273   HG12  VAL  36          2HG1      VAL  36   1.648  -5.331   1.149
  274   HG13  VAL  36          3HG1      VAL  36   2.036  -6.087  -0.397
  275   HG21  VAL  36          3HG2      VAL  36   0.071  -3.030  -1.274
  276   HG22  VAL  36          1HG2      VAL  36   1.628  -3.821  -1.502
  277   HG23  VAL  36          2HG2      VAL  36   1.208  -3.138   0.070
  278    H    ASP  37           HN       ASP  37   0.258  -8.048  -2.111
  279    HA   ASP  37           HA       ASP  37  -1.960  -9.249  -0.585
  280    HB2  ASP  37           2HB      ASP  37  -2.245  -9.625  -2.977
  281    HB3  ASP  37           1HB      ASP  37  -0.595 -10.215  -3.109
  282    H    LEU  38           HN       LEU  38  -1.437 -11.016   0.718
  283    HA   LEU  38           HA       LEU  38   1.453 -11.423   1.099
  284    HB2  LEU  38           2HB      LEU  38  -0.797 -11.713   3.093
  285    HB3  LEU  38           1HB      LEU  38   0.886 -12.078   3.417
  286    HG   LEU  38           HG       LEU  38  -0.238  -9.351   2.770
  287   HD11  LEU  38          1HD1      LEU  38   0.837 -10.520   5.333
  288   HD12  LEU  38          2HD1      LEU  38  -0.844 -10.105   4.992
  289   HD13  LEU  38          3HD1      LEU  38   0.377  -8.835   5.089
  290   HD21  LEU  38          3HD2      LEU  38   2.017  -9.601   1.895
  291   HD22  LEU  38          1HD2      LEU  38   2.573 -10.202   3.456
  292   HD23  LEU  38          2HD2      LEU  38   2.014  -8.537   3.301
  293    H    GLU  39           HN       GLU  39   2.218 -13.355   0.667
  294    HA   GLU  39           HA       GLU  39   0.319 -15.595   0.425
  295    HB2  GLU  39           2HB      GLU  39   1.308 -14.736  -1.725
  296    HB3  GLU  39           1HB      GLU  39   2.898 -15.150  -1.111
  297    HG2  GLU  39           2HG      GLU  39   0.825 -17.277  -1.243
  298    HG3  GLU  39           1HG      GLU  39   1.588 -16.738  -2.736
  299    H    GLY  40           HN       GLY  40   0.830 -17.442   1.535
  300    HA2  GLY  40           2HA      GLY  40   3.106 -18.613   2.232
  301    HA3  GLY  40           1HA      GLY  40   3.107 -17.255   3.347
  302    HA   PRO  41           HA       PRO  41   1.275 -20.822   5.613
  303    HB2  PRO  41           2HB      PRO  41   1.905 -18.912   7.806
  304    HB3  PRO  41           1HB      PRO  41   2.230 -20.644   7.692
  305    HG2  PRO  41           2HG      PRO  41   4.185 -18.861   7.381
  306    HG3  PRO  41           1HG      PRO  41   4.127 -20.338   6.399
  307    HD2  PRO  41           2HD      PRO  41   3.423 -17.533   5.660
  308    HD3  PRO  41           1HD      PRO  41   4.189 -18.800   4.680
  309    H    ARG  42           HN       ARG  42  -0.842 -20.957   5.691
  310    HA   ARG  42           HA       ARG  42  -2.678 -18.895   5.544
  311    HB2  ARG  42           2HB      ARG  42  -3.048 -21.376   5.147
  312    HB3  ARG  42           1HB      ARG  42  -3.213 -21.545   6.889
  313    HG2  ARG  42           2HG      ARG  42  -5.063 -19.833   6.753
  314    HG3  ARG  42           1HG      ARG  42  -4.984 -20.029   5.000
  315    HD2  ARG  42           2HD      ARG  42  -5.257 -22.519   5.426
  316    HD3  ARG  42           1HD      ARG  42  -5.693 -22.081   7.077
  317    HE   ARG  42           HE       ARG  42  -7.210 -21.453   4.642
  318   HH11  ARG  42          1HH1      ARG  42  -6.975 -21.465   8.134
  319   HH12  ARG  42          2HH1      ARG  42  -8.683 -21.251   8.381
  320   HH21  ARG  42          1HH2      ARG  42  -9.454 -21.138   4.960
  321   HH22  ARG  42          2HH2      ARG  42 -10.092 -21.015   6.570
  322    H    GLY  43           HN       GLY  43  -1.224 -20.377   8.368
  323    HA2  GLY  43           2HA      GLY  43  -3.012 -19.383  10.314
  324    HA3  GLY  43           1HA      GLY  43  -1.371 -19.934  10.605
  325    H    VAL  44           HN       VAL  44   0.098 -18.118   9.119
  326    HA   VAL  44           HA       VAL  44   0.296 -15.930  10.843
  327    HB   VAL  44           HB       VAL  44   1.256 -16.146   7.979
  328   HG11  VAL  44          1HG1      VAL  44   2.783 -14.326   8.508
  329   HG12  VAL  44          2HG1      VAL  44   2.073 -14.183  10.116
  330   HG13  VAL  44          3HG1      VAL  44   1.106 -13.815   8.689
  331   HG21  VAL  44          3HG2      VAL  44   2.260 -17.839   9.355
  332   HG22  VAL  44          1HG2      VAL  44   2.643 -16.658  10.606
  333   HG23  VAL  44          2HG2      VAL  44   3.459 -16.580   9.043
  334    H    LEU  45           HN       LEU  45  -1.284 -16.264   7.710
  335    HA   LEU  45           HA       LEU  45  -2.105 -13.615   7.365
  336    HB2  LEU  45           2HB      LEU  45  -3.562 -16.092   6.449
  337    HB3  LEU  45           1HB      LEU  45  -3.682 -14.486   5.757
  338    HG   LEU  45           HG       LEU  45  -1.220 -16.232   5.704
  339   HD11  LEU  45          1HD1      LEU  45  -2.965 -17.093   4.263
  340   HD12  LEU  45          2HD1      LEU  45  -1.679 -16.371   3.294
  341   HD13  LEU  45          3HD1      LEU  45  -3.188 -15.494   3.548
  342   HD21  LEU  45          3HD2      LEU  45  -0.677 -13.849   5.776
  343   HD22  LEU  45          1HD2      LEU  45  -1.755 -13.561   4.410
  344   HD23  LEU  45          2HD2      LEU  45  -0.308 -14.545   4.199
  345    H    THR  46           HN       THR  46  -3.665 -16.338   8.987
  346    HA   THR  46           HA       THR  46  -6.108 -14.975   9.537
  347    HB   THR  46           HB       THR  46  -4.962 -17.355  11.020
  348    HG1  THR  46           1HG      THR  46  -5.326 -17.319   8.510
  349   HG21  THR  46          3HG2      THR  46  -7.323 -17.916  11.401
  350   HG22  THR  46          1HG2      THR  46  -7.804 -16.434  10.573
  351   HG23  THR  46          2HG2      THR  46  -6.911 -16.346  12.090
  352    H    VAL  47           HN       VAL  47  -3.175 -15.614  11.460
  353    HA   VAL  47           HA       VAL  47  -4.091 -14.466  13.860
  354    HB   VAL  47           HB       VAL  47  -1.257 -14.745  12.840
  355   HG11  VAL  47          1HG1      VAL  47  -0.581 -14.519  15.203
  356   HG12  VAL  47          2HG1      VAL  47  -2.249 -14.134  15.628
  357   HG13  VAL  47          3HG1      VAL  47  -1.333 -13.052  14.578
  358   HG21  VAL  47          3HG2      VAL  47  -2.444 -16.869  13.066
  359   HG22  VAL  47          1HG2      VAL  47  -2.854 -16.470  14.735
  360   HG23  VAL  47          2HG2      VAL  47  -1.168 -16.717  14.274
  361    H    PHE  48           HN       PHE  48  -2.264 -13.068  11.160
  362    HA   PHE  48           HA       PHE  48  -1.934 -10.499  12.281
  363    HB2  PHE  48           2HB      PHE  48  -0.643 -11.361  10.340
  364    HB3  PHE  48           1HB      PHE  48  -2.098 -11.269   9.355
  365    HD1  PHE  48           2HD      PHE  48   0.279  -9.225  11.324
  366    HD2  PHE  48           1HD      PHE  48  -2.683  -9.282   8.272
  367    HE1  PHE  48           2HE      PHE  48   0.830  -6.895  10.751
  368    HE2  PHE  48           1HE      PHE  48  -2.138  -6.955   7.691
  369    HZ   PHE  48           HZ       PHE  48  -0.380  -5.760   8.931
  370    H    ARG  49           HN       ARG  49  -4.576 -12.040  10.638
  371    HA   ARG  49           HA       ARG  49  -6.022  -9.670  10.021
  372    HB2  ARG  49           2HB      ARG  49  -6.387 -12.583   9.768
  373    HB3  ARG  49           1HB      ARG  49  -7.864 -11.660   9.923
  374    HG2  ARG  49           2HG      ARG  49  -5.712 -11.225   7.865
  375    HG3  ARG  49           1HG      ARG  49  -7.276 -11.994   7.588
  376    HD2  ARG  49           2HD      ARG  49  -8.420  -9.927   8.133
  377    HD3  ARG  49           1HD      ARG  49  -6.883  -9.153   8.518
  378    HE   ARG  49           HE       ARG  49  -6.321  -9.512   6.105
  379   HH11  ARG  49          1HH1      ARG  49  -9.658  -9.353   7.143
  380   HH12  ARG  49          2HH1      ARG  49 -10.229  -8.698   5.631
  381   HH21  ARG  49          1HH2      ARG  49  -7.081  -8.688   4.093
  382   HH22  ARG  49          2HH2      ARG  49  -8.776  -8.352   3.898
  383    H    PHE  50           HN       PHE  50  -5.579 -11.457  12.889
  384    HA   PHE  50           HA       PHE  50  -8.060 -10.695  14.126
  385    HB2  PHE  50           2HB      PHE  50  -5.519 -11.980  15.075
  386    HB3  PHE  50           1HB      PHE  50  -6.706 -11.398  16.226
  387    HD1  PHE  50           2HD      PHE  50  -9.220 -12.169  15.533
  388    HD2  PHE  50           1HD      PHE  50  -5.606 -14.207  14.589
  389    HE1  PHE  50           2HE      PHE  50 -10.476 -14.267  15.285
  390    HE2  PHE  50           1HE      PHE  50  -6.855 -16.313  14.337
  391    HZ   PHE  50           HZ       PHE  50  -9.293 -16.341  14.685
  392    H    ALA  51           HN       ALA  51  -4.989  -9.295  13.595
  393    HA   ALA  51           HA       ALA  51  -5.347  -7.275  15.666
  394    HB1  ALA  51           1HB      ALA  51  -3.090  -6.553  15.075
  395    HB2  ALA  51           2HB      ALA  51  -3.054  -7.724  13.757
  396    HB3  ALA  51           3HB      ALA  51  -3.132  -8.280  15.429
  397    H    ARG  52           HN       ARG  52  -4.935  -4.985  15.008
  398    HA   ARG  52           HA       ARG  52  -6.531  -4.337  12.705
  399    HB2  ARG  52           2HB      ARG  52  -5.236  -2.698  14.866
  400    HB3  ARG  52           1HB      ARG  52  -6.087  -1.984  13.520
  401    HG2  ARG  52           2HG      ARG  52  -8.051  -3.496  14.269
  402    HG3  ARG  52           1HG      ARG  52  -7.160  -3.582  15.792
  403    HD2  ARG  52           2HD      ARG  52  -8.777  -1.786  15.898
  404    HD3  ARG  52           1HD      ARG  52  -7.144  -1.118  15.886
  405    HE   ARG  52           HE       ARG  52  -7.999  -1.196  13.251
  406   HH11  ARG  52          1HH1      ARG  52  -8.927   0.430  16.211
  407   HH12  ARG  52          2HH1      ARG  52  -9.602   1.803  15.384
  408   HH21  ARG  52          1HH2      ARG  52  -8.842   0.620  12.168
  409   HH22  ARG  52          2HH2      ARG  52  -9.530   1.925  13.097
  410    HA   PRO  53           HA       PRO  53  -3.248  -3.550   9.891
  411    HB2  PRO  53           2HB      PRO  53  -4.568  -1.108   8.969
  412    HB3  PRO  53           1HB      PRO  53  -4.259  -2.609   8.096
  413    HG2  PRO  53           2HG      PRO  53  -6.742  -1.872   8.869
  414    HG3  PRO  53           1HG      PRO  53  -6.240  -3.570   8.779
  415    HD2  PRO  53           2HD      PRO  53  -6.522  -1.796  11.164
  416    HD3  PRO  53           1HD      PRO  53  -6.908  -3.521  10.987
  417    H    SER  54           HN       SER  54  -1.345  -2.770  10.424
  418    HA   SER  54           HA       SER  54  -1.053   0.041  11.095
  419    HB2  SER  54           2HB      SER  54  -0.016  -2.366  12.542
  420    HB3  SER  54           1HB      SER  54   0.743  -0.799  12.684
  421    HG   SER  54           HG       SER  54  -1.873  -0.474  13.004
  422    H    TYR  55           HN       TYR  55  -0.711  -1.300   8.620
  423    HA   TYR  55           HA       TYR  55   2.202  -1.363   8.313
  424    HB2  TYR  55           2HB      TYR  55   1.637  -2.508   6.088
  425    HB3  TYR  55           1HB      TYR  55   1.409  -3.433   7.564
  426    HD1  TYR  55           1HD      TYR  55  -0.367  -1.566   4.903
  427    HD2  TYR  55           2HD      TYR  55  -0.725  -4.266   8.168
  428    HE1  TYR  55           1HE      TYR  55  -2.680  -2.056   4.239
  429    HE2  TYR  55           2HE      TYR  55  -3.044  -4.756   7.516
  430    HH   TYR  55           HH       TYR  55  -4.356  -3.790   4.510
  431    H    GLU  56           HN       GLU  56   3.216   0.057   7.054
  432    HA   GLU  56           HA       GLU  56   1.555   1.983   5.569
  433    HB2  GLU  56           2HB      GLU  56   4.127   2.421   7.087
  434    HB3  GLU  56           1HB      GLU  56   3.495   3.585   5.937
  435    HG2  GLU  56           2HG      GLU  56   2.807   4.387   7.999
  436    HG3  GLU  56           1HG      GLU  56   1.378   3.579   7.361
  437    H    VAL  57           HN       VAL  57   2.161   2.549   3.532
  438    HA   VAL  57           HA       VAL  57   4.652   1.398   2.475
  439    HB   VAL  57           HB       VAL  57   3.555   1.479   0.207
  440   HG11  VAL  57          1HG1      VAL  57   3.795  -0.620   1.404
  441   HG12  VAL  57          2HG1      VAL  57   2.271  -0.587   0.516
  442   HG13  VAL  57          3HG1      VAL  57   2.283  -0.325   2.261
  443   HG21  VAL  57          3HG2      VAL  57   1.745   3.033   0.689
  444   HG22  VAL  57          1HG2      VAL  57   1.044   1.892   1.838
  445   HG23  VAL  57          2HG2      VAL  57   1.092   1.497   0.119
  446    H    PHE  58           HN       PHE  58   6.102   2.860   1.757
  447    HA   PHE  58           HA       PHE  58   5.182   5.581   1.235
  448    HB2  PHE  58           2HB      PHE  58   6.831   6.519   2.837
  449    HB3  PHE  58           1HB      PHE  58   5.540   5.612   3.613
  450    HD1  PHE  58           1HD      PHE  58   6.004   3.379   4.573
  451    HD2  PHE  58           2HD      PHE  58   9.101   5.850   3.011
  452    HE1  PHE  58           1HE      PHE  58   7.675   2.042   5.784
  453    HE2  PHE  58           2HE      PHE  58  10.779   4.508   4.215
  454    HZ   PHE  58           HZ       PHE  58  10.066   2.604   5.604
  455    H    VAL  59           HN       VAL  59   6.652   6.922   0.211
  456    HA   VAL  59           HA       VAL  59   9.105   5.643  -0.811
  457    HB   VAL  59           HB       VAL  59   7.430   7.661  -2.301
  458   HG11  VAL  59          1HG1      VAL  59   9.774   6.001  -3.191
  459   HG12  VAL  59          2HG1      VAL  59   9.792   7.732  -2.856
  460   HG13  VAL  59          3HG1      VAL  59   8.845   7.105  -4.204
  461   HG21  VAL  59          3HG2      VAL  59   6.206   5.564  -2.160
  462   HG22  VAL  59          1HG2      VAL  59   7.621   4.686  -2.745
  463   HG23  VAL  59          2HG2      VAL  59   6.793   5.828  -3.802
  464    H    ASP  60           HN       ASP  60  10.924   6.866  -0.658
  465    HA   ASP  60           HA       ASP  60  10.603   9.492   0.632
  466    HB2  ASP  60           2HB      ASP  60  11.628   7.763   2.095
  467    HB3  ASP  60           1HB      ASP  60  12.924   7.566   0.919
  468    H    LEU  61           HN       LEU  61  10.912  11.011  -0.868
  469    HA   LEU  61           HA       LEU  61  13.361  10.872  -2.460
  470    HB2  LEU  61           2HB      LEU  61  10.601  11.407  -3.546
  471    HB3  LEU  61           1HB      LEU  61  12.071  11.808  -4.413
  472    HG   LEU  61           HG       LEU  61  11.298   9.012  -3.563
  473   HD11  LEU  61          1HD1      LEU  61   9.769   9.877  -5.252
  474   HD12  LEU  61          2HD1      LEU  61  10.823   8.634  -5.926
  475   HD13  LEU  61          3HD1      LEU  61  11.137  10.335  -6.268
  476   HD21  LEU  61          3HD2      LEU  61  13.510  10.042  -5.338
  477   HD22  LEU  61          1HD2      LEU  61  13.096   8.343  -5.100
  478   HD23  LEU  61          2HD2      LEU  61  13.699   9.302  -3.747
  479    H    THR  62           HN       THR  62  14.169  12.396  -0.982
  480    HA   THR  62           HA       THR  62  12.967  15.069  -1.081
  481    HB   THR  62           HB       THR  62  14.753  15.631   0.612
  482    HG1  THR  62           1HG      THR  62  15.221  13.096   1.420
  483   HG21  THR  62          3HG2      THR  62  13.650  14.469   2.471
  484   HG22  THR  62          1HG2      THR  62  12.892  13.360   1.327
  485   HG23  THR  62          2HG2      THR  62  12.469  15.072   1.306
  486    H    GLU  63           HN       GLU  63  15.365  13.157  -2.496
  487    HA   GLU  63           HA       GLU  63  16.953  15.438  -3.404
  488    HB2  GLU  63           2HB      GLU  63  17.353  12.475  -3.783
  489    HB3  GLU  63           1HB      GLU  63  18.449  13.712  -4.345
  490    HG2  GLU  63           2HG      GLU  63  18.816  14.399  -2.057
  491    HG3  GLU  63           1HG      GLU  63  17.745  13.125  -1.509
  492    H    ALA  64           HN       ALA  64  14.202  13.940  -4.330
  493    HA   ALA  64           HA       ALA  64  14.671  13.536  -7.121
  494    HB1  ALA  64           1HB      ALA  64  12.255  13.232  -7.282
  495    HB2  ALA  64           2HB      ALA  64  12.063  13.832  -5.635
  496    HB3  ALA  64           3HB      ALA  64  12.915  12.316  -5.927
  497    H    GLY  65           HN       GLY  65  14.919  15.080  -8.578
  498    HA2  GLY  65           2HA      GLY  65  13.858  17.753  -8.029
  499    HA3  GLY  65           1HA      GLY  65  15.071  17.349  -9.237
  500    H    GLU  66           HN       GLU  66  14.300  17.824 -11.165
  501    HA   GLU  66           HA       GLU  66  11.483  18.004 -11.644
  502    HB2  GLU  66           2HB      GLU  66  12.140  18.771 -13.885
  503    HB3  GLU  66           1HB      GLU  66  12.970  19.653 -12.617
  504    HG2  GLU  66           2HG      GLU  66  14.219  17.335 -14.064
  505    HG3  GLU  66           1HG      GLU  66  14.332  18.995 -14.643
  506    H    GLY  67           HN       GLY  67  10.382  16.998 -13.424
  507    HA2  GLY  67           2HA      GLY  67   9.885  15.253 -14.863
  508    HA3  GLY  67           1HA      GLY  67  11.508  14.621 -14.614
  509    H    SER  68           HN       SER  68   9.171  13.037 -14.696
  510    HA   SER  68           HA       SER  68   8.370  12.426 -12.017
  511    HB2  SER  68           2HB      SER  68   6.933  12.010 -14.006
  512    HB3  SER  68           1HB      SER  68   8.031  10.722 -14.492
  513    HG   SER  68           HG       SER  68   6.262  10.859 -12.317
  514    H    HIS  69           HN       HIS  69   9.105  10.924 -10.698
  515    HA   HIS  69           HA       HIS  69  11.591   9.552 -11.495
  516    HB2  HIS  69           2HB      HIS  69  10.812  10.948  -8.959
  517    HB3  HIS  69           1HB      HIS  69  11.979   9.630  -8.899
  518    HD1  HIS  69           1HD      HIS  69  11.516  13.034 -10.528
  519    HD2  HIS  69           2HD      HIS  69  14.518  10.308  -9.598
  520    HE1  HIS  69           1HE      HIS  69  13.681  14.210 -11.022
  521    HE2  HIS  69           2HE      HIS  69  15.471  12.481 -10.618
  522    H    THR  70           HN       THR  70  11.479   7.439 -11.543
  523    HA   THR  70           HA       THR  70   9.351   6.095 -10.023
  524    HB   THR  70           HB       THR  70  11.013   4.762 -12.150
  525    HG1  THR  70           1HG      THR  70  10.148   6.794 -12.984
  526   HG21  THR  70          3HG2      THR  70   8.128   4.458 -11.302
  527   HG22  THR  70          1HG2      THR  70   9.458   3.416 -10.796
  528   HG23  THR  70          2HG2      THR  70   8.974   3.465 -12.489
  529    H    VAL  71           HN       VAL  71  10.003   5.228  -8.141
  530    HA   VAL  71           HA       VAL  71  12.620   3.895  -8.062
  531    HB   VAL  71           HB       VAL  71  12.963   4.728  -5.734
  532   HG11  VAL  71          1HG1      VAL  71  14.161   5.747  -7.587
  533   HG12  VAL  71          2HG1      VAL  71  13.749   6.957  -6.372
  534   HG13  VAL  71          3HG1      VAL  71  12.817   6.856  -7.865
  535   HG21  VAL  71          3HG2      VAL  71  10.716   6.615  -6.428
  536   HG22  VAL  71          1HG2      VAL  71  11.729   6.698  -4.986
  537   HG23  VAL  71          2HG2      VAL  71  10.652   5.323  -5.231
  538    H    ASP  72           HN       ASP  72  12.805   2.518  -6.054
  539    HA   ASP  72           HA       ASP  72  10.607   0.704  -6.011
  540    HB2  ASP  72           2HB      ASP  72  13.176   0.278  -5.680
  541    HB3  ASP  72           1HB      ASP  72  12.836   0.635  -3.992
  542    H    VAL  73           HN       VAL  73   9.194   0.229  -4.329
  543    HA   VAL  73           HA       VAL  73   8.750   2.467  -2.490
  544    HB   VAL  73           HB       VAL  73   6.891   0.196  -3.236
  545   HG11  VAL  73          1HG1      VAL  73   6.429   1.016  -1.002
  546   HG12  VAL  73          2HG1      VAL  73   5.153   1.507  -2.116
  547   HG13  VAL  73          3HG1      VAL  73   6.370   2.675  -1.599
  548   HG21  VAL  73          3HG2      VAL  73   6.928   3.080  -4.111
  549   HG22  VAL  73          1HG2      VAL  73   5.644   1.924  -4.471
  550   HG23  VAL  73          2HG2      VAL  73   7.266   1.669  -5.112
  551    H    GLU  74           HN       GLU  74   9.131   2.313  -0.402
  552    HA   GLU  74           HA       GLU  74   9.905  -0.259   0.736
  553    HB2  GLU  74           2HB      GLU  74  10.818   2.372   1.082
  554    HB3  GLU  74           1HB      GLU  74   9.988   1.975   2.580
  555    HG2  GLU  74           2HG      GLU  74  12.186   0.347   1.325
  556    HG3  GLU  74           1HG      GLU  74  12.386   1.475   2.666
  557    H    HIS  75           HN       HIS  75   8.976  -1.030   2.721
  558    HA   HIS  75           HA       HIS  75   6.416   0.114   3.487
  559    HB2  HIS  75           2HB      HIS  75   5.468  -2.357   3.244
  560    HB3  HIS  75           1HB      HIS  75   5.373  -1.189   1.934
  561    HD1  HIS  75           1HD      HIS  75   7.178  -4.326   2.974
  562    HD2  HIS  75           2HD      HIS  75   6.882  -1.783  -0.309
  563    HE1  HIS  75           1HE      HIS  75   8.281  -5.541   1.063
  564    HE2  HIS  75           2HE      HIS  75   8.296  -3.879  -0.840
  565    H    ARG  76           HN       ARG  76   5.577  -0.643   5.428
  566    HA   ARG  76           HA       ARG  76   7.204  -2.505   6.992
  567    HB2  ARG  76           2HB      ARG  76   7.820   0.028   7.340
  568    HB3  ARG  76           1HB      ARG  76   6.330   0.061   8.275
  569    HG2  ARG  76           2HG      ARG  76   7.243  -1.851   9.615
  570    HG3  ARG  76           1HG      ARG  76   8.777  -1.614   8.776
  571    HD2  ARG  76           2HD      ARG  76   9.007  -0.426  10.775
  572    HD3  ARG  76           1HD      ARG  76   8.637   0.804   9.570
  573    HE   ARG  76           HE       ARG  76   6.197   0.219  10.540
  574   HH11  ARG  76          1HH1      ARG  76   9.237   1.027  12.081
  575   HH12  ARG  76          2HH1      ARG  76   8.493   1.676  13.514
  576   HH21  ARG  76          1HH2      ARG  76   5.205   1.069  12.411
  577   HH22  ARG  76          2HH2      ARG  76   6.187   1.717  13.696
  578    H    GLY  77           HN       GLY  77   6.027  -3.086   9.061
  579    HA2  GLY  77           2HA      GLY  77   3.901  -3.091  10.251
  580    HA3  GLY  77           1HA      GLY  77   3.102  -2.859   8.698
  581    H    PHE  78           HN       PHE  78   3.934  -4.628   7.055
  582    HA   PHE  78           HA       PHE  78   3.698  -7.234   8.372
  583    HB2  PHE  78           2HB      PHE  78   3.315  -8.073   6.013
  584    HB3  PHE  78           1HB      PHE  78   2.067  -7.006   6.642
  585    HD1  PHE  78           1HD      PHE  78   1.915  -4.682   5.836
  586    HD2  PHE  78           2HD      PHE  78   4.612  -7.476   4.107
  587    HE1  PHE  78           1HE      PHE  78   2.140  -3.234   3.859
  588    HE2  PHE  78           2HE      PHE  78   4.845  -6.033   2.130
  589    HZ   PHE  78           HZ       PHE  78   3.611  -3.911   2.001
  590    HA   PRO  79           HA       PRO  79   7.978  -7.775   7.442
  591    HB2  PRO  79           2HB      PRO  79   8.300 -10.230   8.434
  592    HB3  PRO  79           1HB      PRO  79   7.885  -8.866   9.480
  593    HG2  PRO  79           2HG      PRO  79   6.181 -11.100   8.519
  594    HG3  PRO  79           1HG      PRO  79   6.086 -10.185  10.031
  595    HD2  PRO  79           2HD      PRO  79   4.533  -9.801   7.682
  596    HD3  PRO  79           1HD      PRO  79   4.558  -8.777   9.131
  597    H    GLY  80           HN       GLY  80   9.402  -8.772   6.029
  598    HA2  GLY  80           2HA      GLY  80   8.251 -10.225   3.804
  599    HA3  GLY  80           1HA      GLY  80   9.932  -9.742   3.985
  600    H    ASP  81           HN       ASP  81   8.190 -11.511   6.433
  601    HA   ASP  81           HA       ASP  81  10.131 -13.601   6.502
  602    HB2  ASP  81           2HB      ASP  81   8.748 -12.730   8.469
  603    HB3  ASP  81           1HB      ASP  81   7.416 -13.659   7.800
  604    H    LEU  82           HN       LEU  82   7.037 -13.104   5.074
  605    HA   LEU  82           HA       LEU  82   7.160 -15.768   3.848
  606    HB2  LEU  82           2HB      LEU  82   4.661 -15.268   3.388
  607    HB3  LEU  82           1HB      LEU  82   5.145 -15.796   4.984
  608    HG   LEU  82           HG       LEU  82   5.120 -13.367   5.688
  609   HD11  LEU  82          1HD1      LEU  82   3.782 -11.824   4.338
  610   HD12  LEU  82          2HD1      LEU  82   3.712 -13.023   3.047
  611   HD13  LEU  82          3HD1      LEU  82   5.259 -12.313   3.508
  612   HD21  LEU  82          3HD2      LEU  82   3.338 -14.886   6.289
  613   HD22  LEU  82          1HD2      LEU  82   2.547 -14.608   4.739
  614   HD23  LEU  82          2HD2      LEU  82   2.678 -13.295   5.908
  615    H    ALA  83           HN       ALA  83   5.319 -15.233   1.779
  616    HA   ALA  83           HA       ALA  83   7.060 -13.673   0.046
  617    HB1  ALA  83           1HB      ALA  83   6.325 -15.876  -0.721
  618    HB2  ALA  83           2HB      ALA  83   5.743 -14.596  -1.787
  619    HB3  ALA  83           3HB      ALA  83   4.644 -15.346  -0.630
  620    H    VAL  84           HN       VAL  84   6.686 -11.559  -0.069
  621    HA   VAL  84           HA       VAL  84   3.962 -10.551   0.279
  622    HB   VAL  84           HB       VAL  84   6.562  -9.031  -0.059
  623   HG11  VAL  84          1HG1      VAL  84   4.630  -7.739  -0.791
  624   HG12  VAL  84          2HG1      VAL  84   5.299  -7.089   0.705
  625   HG13  VAL  84          3HG1      VAL  84   3.824  -8.055   0.747
  626   HG21  VAL  84          3HG2      VAL  84   4.960  -9.599   2.433
  627   HG22  VAL  84          1HG2      VAL  84   6.404  -8.588   2.338
  628   HG23  VAL  84          2HG2      VAL  84   6.515 -10.318   2.013
  629    H    THR  85           HN       THR  85   2.724  -9.986  -1.407
  630    HA   THR  85           HA       THR  85   4.021  -9.895  -4.048
  631    HB   THR  85           HB       THR  85   1.117 -10.453  -3.465
  632    HG1  THR  85           1HG      THR  85   1.990 -12.312  -2.812
  633   HG21  THR  85          3HG2      THR  85   1.043 -11.225  -5.785
  634   HG22  THR  85          1HG2      THR  85   2.745 -10.804  -5.980
  635   HG23  THR  85          2HG2      THR  85   1.551  -9.540  -5.690
  636    H    VAL  86           HN       VAL  86   3.773  -8.110  -5.230
  637    HA   VAL  86           HA       VAL  86   2.063  -5.978  -4.181
  638    HB   VAL  86           HB       VAL  86   4.924  -5.560  -5.034
  639   HG11  VAL  86          1HG1      VAL  86   3.520  -3.625  -5.458
  640   HG12  VAL  86          2HG1      VAL  86   4.634  -3.294  -4.133
  641   HG13  VAL  86          3HG1      VAL  86   2.943  -3.655  -3.789
  642   HG21  VAL  86          3HG2      VAL  86   5.409  -5.077  -2.678
  643   HG22  VAL  86          1HG2      VAL  86   4.896  -6.747  -2.925
  644   HG23  VAL  86          2HG2      VAL  86   3.770  -5.569  -2.250
  645    H    GLU  87           HN       GLU  87   1.086  -4.774  -5.691
  646    HA   GLU  87           HA       GLU  87   1.886  -5.177  -8.487
  647    HB2  GLU  87           2HB      GLU  87  -0.706  -4.143  -7.298
  648    HB3  GLU  87           1HB      GLU  87  -0.339  -4.138  -9.021
  649    HG2  GLU  87           2HG      GLU  87   0.025  -6.627  -8.828
  650    HG3  GLU  87           1HG      GLU  87  -0.675  -6.513  -7.216
  651    HA   PRO  88           HA       PRO  88   4.181  -2.681  -9.895
  652    HB2  PRO  88           2HB      PRO  88   3.022  -0.010  -9.330
  653    HB3  PRO  88           1HB      PRO  88   3.846  -0.595 -10.777
  654    HG2  PRO  88           2HG      PRO  88   1.012  -0.582 -10.238
  655    HG3  PRO  88           1HG      PRO  88   1.842  -1.140 -11.701
  656    HD2  PRO  88           2HD      PRO  88   0.477  -2.825 -10.024
  657    HD3  PRO  88           1HD      PRO  88   1.888  -3.349 -10.976
  658    H    ARG  89           HN       ARG  89   5.991  -2.463  -8.923
  659    HA   ARG  89           HA       ARG  89   5.951  -2.053  -6.013
  660    HB2  ARG  89           2HB      ARG  89   8.133  -3.355  -7.616
  661    HB3  ARG  89           1HB      ARG  89   7.812  -3.504  -5.891
  662    HG2  ARG  89           2HG      ARG  89   5.739  -4.698  -6.396
  663    HG3  ARG  89           1HG      ARG  89   6.101  -4.577  -8.119
  664    HD2  ARG  89           2HD      ARG  89   8.306  -5.688  -7.548
  665    HD3  ARG  89           1HD      ARG  89   7.574  -6.099  -5.999
  666    HE   ARG  89           HE       ARG  89   5.779  -6.936  -7.917
  667   HH11  ARG  89          1HH1      ARG  89   9.134  -7.596  -7.172
  668   HH12  ARG  89          2HH1      ARG  89   9.063  -9.247  -7.717
  669   HH21  ARG  89          1HH2      ARG  89   5.680  -9.084  -8.671
  670   HH22  ARG  89          2HH2      ARG  89   7.092 -10.097  -8.585
  671    H    MET  90           HN       MET  90   7.347  -1.078  -8.986
  672    HA   MET  90           HA       MET  90   8.944   0.977  -7.624
  673    HB2  MET  90           2HB      MET  90   9.838  -0.643  -9.498
  674    HB3  MET  90           1HB      MET  90   8.995   0.453 -10.579
  675    HG2  MET  90           2HG      MET  90  10.345   2.307  -9.754
  676    HG3  MET  90           1HG      MET  90  11.181   1.214  -8.655
  677    HE1  MET  90           3HE      MET  90  12.806   3.055 -10.601
  678    HE2  MET  90           1HE      MET  90  13.977   1.923 -11.277
  679    HE3  MET  90           2HE      MET  90  13.571   1.853  -9.562
  680    H    ALA  91           HN       ALA  91   8.098   2.984  -7.561
  681    HA   ALA  91           HA       ALA  91   5.737   3.468  -9.261
  682    HB1  ALA  91           1HB      ALA  91   6.130   4.375  -6.413
  683    HB2  ALA  91           2HB      ALA  91   5.152   2.996  -6.916
  684    HB3  ALA  91           3HB      ALA  91   4.696   4.627  -7.408
  685    H    ARG  92           HN       ARG  92   5.356   5.544  -9.986
  686    HA   ARG  92           HA       ARG  92   7.744   7.237  -9.920
  687    HB2  ARG  92           2HB      ARG  92   7.104   8.092 -12.070
  688    HB3  ARG  92           1HB      ARG  92   7.076   6.338 -12.133
  689    HG2  ARG  92           2HG      ARG  92   4.673   6.321 -11.991
  690    HG3  ARG  92           1HG      ARG  92   4.643   8.071 -11.765
  691    HD2  ARG  92           2HD      ARG  92   5.861   8.186 -14.020
  692    HD3  ARG  92           1HD      ARG  92   5.368   6.505 -14.219
  693    HE   ARG  92           HE       ARG  92   3.095   7.211 -14.258
  694   HH11  ARG  92          1HH1      ARG  92   5.435   9.817 -14.253
  695   HH12  ARG  92          2HH1      ARG  92   4.299  11.018 -14.811
  696   HH21  ARG  92          1HH2      ARG  92   1.602   8.809 -15.006
  697   HH22  ARG  92          2HH2      ARG  92   2.135  10.451 -15.217
  698    H    VAL  93           HN       VAL  93   7.673   9.229  -9.197
  699    HA   VAL  93           HA       VAL  93   5.101  10.619  -9.007
  700    HB   VAL  93           HB       VAL  93   5.556   9.791  -6.745
  701   HG11  VAL  93          1HG1      VAL  93   7.948   9.512  -6.843
  702   HG12  VAL  93          2HG1      VAL  93   7.530  10.562  -5.488
  703   HG13  VAL  93          3HG1      VAL  93   8.177  11.255  -6.975
  704   HG21  VAL  93          3HG2      VAL  93   6.027  12.758  -7.007
  705   HG22  VAL  93          1HG2      VAL  93   5.538  11.931  -5.528
  706   HG23  VAL  93          2HG2      VAL  93   4.465  11.945  -6.927
  707    H    GLN  94           HN       GLN  94   5.238  12.794  -9.537
  708    HA   GLN  94           HA       GLN  94   7.906  13.644 -10.453
  709    HB2  GLN  94           2HB      GLN  94   6.321  13.334 -12.290
  710    HB3  GLN  94           1HB      GLN  94   5.189  14.439 -11.518
  711    HG2  GLN  94           2HG      GLN  94   6.641  16.289 -11.853
  712    HG3  GLN  94           1HG      GLN  94   7.957  15.244 -12.375
  713   HE21  GLN  94          1HE2      GLN  94   6.792  17.471 -13.756
  714   HE22  GLN  94          2HE2      GLN  94   6.196  16.856 -15.252
  715    H    LEU  95           HN       LEU  95   8.793  15.220  -9.355
  716    HA   LEU  95           HA       LEU  95   7.062  17.062  -7.865
  717    HB2  LEU  95           2HB      LEU  95   9.996  16.414  -7.554
  718    HB3  LEU  95           1HB      LEU  95   9.159  17.656  -6.643
  719    HG   LEU  95           HG       LEU  95   8.542  14.700  -6.535
  720   HD11  LEU  95          1HD1      LEU  95  10.695  15.268  -5.508
  721   HD12  LEU  95          2HD1      LEU  95   9.503  14.786  -4.301
  722   HD13  LEU  95          3HD1      LEU  95   9.895  16.491  -4.519
  723   HD21  LEU  95          3HD2      LEU  95   6.560  16.067  -6.145
  724   HD22  LEU  95          1HD2      LEU  95   7.436  17.015  -4.944
  725   HD23  LEU  95          2HD2      LEU  95   7.097  15.310  -4.645
  726    H    GLU  96           HN       GLU  96   6.811  19.012  -8.622
  727    HA   GLU  96           HA       GLU  96   8.998  20.389  -9.926
  728    HB2  GLU  96           2HB      GLU  96   7.831  19.275 -11.808
  729    HB3  GLU  96           1HB      GLU  96   6.331  20.050 -11.320
  730    HG2  GLU  96           2HG      GLU  96   7.413  21.165 -13.219
  731    HG3  GLU  96           1HG      GLU  96   7.230  22.223 -11.820
  732    H    GLU  97           HN       GLU  97   8.787  22.629  -9.778
  733    HA   GLU  97           HA       GLU  97   7.491  23.500  -7.455
  734    HB2  GLU  97           2HB      GLU  97   9.505  24.539  -8.447
  735    HB3  GLU  97           1HB      GLU  97   8.513  25.165  -9.757
  736    HG2  GLU  97           2HG      GLU  97   7.415  26.673  -8.365
  737    HG3  GLU  97           1HG      GLU  97   7.895  25.812  -6.904
  738    H    ARG  98           HN       ARG  98   5.566  24.264  -7.055
  739    HA   ARG  98           HA       ARG  98   3.529  25.209  -7.235
  740    HB2  ARG  98           2HB      ARG  98   4.146  26.698  -8.936
  741    HB3  ARG  98           1HB      ARG  98   4.218  25.426 -10.136
  742    HG2  ARG  98           2HG      ARG  98   1.735  25.136  -9.793
  743    HG3  ARG  98           1HG      ARG  98   1.785  26.619  -8.839
  744    HD2  ARG  98           2HD      ARG  98   1.113  27.117 -11.107
  745    HD3  ARG  98           1HD      ARG  98   2.701  27.812 -10.786
  746    HE   ARG  98           HE       ARG  98   3.676  26.048 -12.105
  747   HH11  ARG  98          1HH1      ARG  98   0.183  26.254 -12.256
  748   HH12  ARG  98          2HH1      ARG  98   0.084  25.483 -13.810
  749   HH21  ARG  98          1HH2      ARG  98   3.543  25.034 -14.139
  750   HH22  ARG  98          2HH2      ARG  98   1.989  24.764 -14.874
  751    H    GLN  99           HN       GLN  99   1.543  24.413  -7.340
  752    HA   GLN  99           HA       GLN  99   1.390  21.589  -7.655
  753    HB2  GLN  99           2HB      GLN  99   0.188  23.340  -6.022
  754    HB3  GLN  99           1HB      GLN  99  -1.068  23.202  -7.243
  755    HG2  GLN  99           2HG      GLN  99   0.119  20.723  -6.126
  756    HG3  GLN  99           1HG      GLN  99  -1.013  21.641  -5.138
  757   HE21  GLN  99          1HE2      GLN  99  -2.576  20.058  -5.170
  758   HE22  GLN  99          2HE2      GLN  99  -3.488  19.658  -6.585
  759    H    THR 100           HN       THR 100   0.990  20.554  -9.468
  760    HA   THR 100           HA       THR 100  -1.033  21.611 -11.300
  761    HB   THR 100           HB       THR 100   1.609  20.447 -12.217
  762    HG1  THR 100           1HG      THR 100   1.811  22.595 -11.413
  763   HG21  THR 100          3HG2      THR 100  -0.667  21.662 -13.792
  764   HG22  THR 100          1HG2      THR 100  -0.257  19.948 -13.733
  765   HG23  THR 100          2HG2      THR 100   0.866  21.100 -14.457
  766    H    VAL 101           HN       VAL 101  -2.537  20.103 -10.670
  767    HA   VAL 101           HA       VAL 101  -1.943  17.336 -10.383
  768    HB   VAL 101           HB       VAL 101  -3.823  18.233  -9.176
  769   HG11  VAL 101          1HG1      VAL 101  -5.845  19.041 -10.250
  770   HG12  VAL 101          2HG1      VAL 101  -5.110  18.822 -11.837
  771   HG13  VAL 101          3HG1      VAL 101  -4.457  20.023 -10.723
  772   HG21  VAL 101          3HG2      VAL 101  -3.963  15.893  -9.816
  773   HG22  VAL 101          1HG2      VAL 101  -4.746  16.338 -11.333
  774   HG23  VAL 101          2HG2      VAL 101  -5.568  16.625  -9.799
  775    H    SER 102           HN       SER 102  -1.528  15.957 -11.938
  776    HA   SER 102           HA       SER 102  -2.356  16.576 -14.670
  777    HB2  SER 102           2HB      SER 102  -0.488  14.404 -13.674
  778    HB3  SER 102           1HB      SER 102  -0.716  14.912 -15.351
  779    HG   SER 102           HG       SER 102   0.377  16.437 -13.216
  780    H    VAL 103           HN       VAL 103  -3.747  15.332 -15.820
  781    HA   VAL 103           HA       VAL 103  -4.981  13.084 -14.388
  782    HB   VAL 103           HB       VAL 103  -6.595  14.839 -14.636
  783   HG11  VAL 103          1HG1      VAL 103  -7.246  15.772 -16.800
  784   HG12  VAL 103          2HG1      VAL 103  -5.982  14.830 -17.589
  785   HG13  VAL 103          3HG1      VAL 103  -5.550  16.099 -16.442
  786   HG21  VAL 103          3HG2      VAL 103  -7.099  12.687 -16.691
  787   HG22  VAL 103          1HG2      VAL 103  -8.330  13.718 -15.958
  788   HG23  VAL 103          2HG2      VAL 103  -7.430  12.574 -14.962
  789    HA   PRO 104           HA       PRO 104  -3.363  10.798 -17.911
  790    HB2  PRO 104           2HB      PRO 104  -3.771   8.427 -16.323
  791    HB3  PRO 104           1HB      PRO 104  -2.247   9.185 -16.785
  792    HG2  PRO 104           2HG      PRO 104  -3.193   9.084 -14.214
  793    HG3  PRO 104           1HG      PRO 104  -2.064  10.312 -14.811
  794    HD2  PRO 104           2HD      PRO 104  -5.025  10.493 -14.407
  795    HD3  PRO 104           1HD      PRO 104  -3.766  11.705 -14.075
  796    H    VAL 105           HN       VAL 105  -5.091  11.007 -19.301
  797    HA   VAL 105           HA       VAL 105  -7.704  10.113 -18.741
  798    HB   VAL 105           HB       VAL 105  -7.270  11.822 -20.437
  799   HG11  VAL 105          1HG1      VAL 105  -5.200  10.952 -21.372
  800   HG12  VAL 105          2HG1      VAL 105  -6.393  11.242 -22.639
  801   HG13  VAL 105          3HG1      VAL 105  -6.077   9.598 -22.083
  802   HG21  VAL 105          3HG2      VAL 105  -8.593   9.361 -21.568
  803   HG22  VAL 105          1HG2      VAL 105  -8.795  11.003 -22.176
  804   HG23  VAL 105          2HG2      VAL 105  -9.360  10.586 -20.558
  805    H    THR 106           HN       THR 106  -4.948   8.593 -20.278
  806    HA   THR 106           HA       THR 106  -4.459   6.449 -20.804
  807    HB   THR 106           HB       THR 106  -6.981   5.628 -19.369
  808    HG1  THR 106           1HG      THR 106  -5.832   6.797 -17.876
  809   HG21  THR 106          3HG2      THR 106  -5.900   3.870 -20.693
  810   HG22  THR 106          1HG2      THR 106  -5.748   3.545 -18.966
  811   HG23  THR 106          2HG2      THR 106  -4.374   4.184 -19.869
  812    H    VAL 107           HN       VAL 107  -4.591   6.097 -22.904
  813    HA   VAL 107           HA       VAL 107  -6.903   6.435 -24.475
  814    HB   VAL 107           HB       VAL 107  -5.646   5.245 -26.265
  815   HG11  VAL 107          1HG1      VAL 107  -3.873   6.916 -26.479
  816   HG12  VAL 107          2HG1      VAL 107  -4.088   7.365 -24.786
  817   HG13  VAL 107          3HG1      VAL 107  -5.387   7.645 -25.947
  818   HG21  VAL 107          3HG2      VAL 107  -3.331   4.573 -25.876
  819   HG22  VAL 107          1HG2      VAL 107  -4.431   3.643 -24.862
  820   HG23  VAL 107          2HG2      VAL 107  -3.492   4.963 -24.164
  821    H    GLU 108           HN       GLU 108  -8.491   5.102 -25.076
  822    HA   GLU 108           HA       GLU 108  -8.849   2.667 -23.608
  823    HB2  GLU 108           2HB      GLU 108 -10.692   4.278 -24.192
  824    HB3  GLU 108           1HB      GLU 108 -10.546   3.755 -25.862
  825    HG2  GLU 108           2HG      GLU 108 -11.187   1.513 -25.261
  826    HG3  GLU 108           1HG      GLU 108 -11.212   1.946 -23.552
  827    H    MET 109           HN       MET 109  -8.316   0.674 -24.229
  828    HA   MET 109           HA       MET 109  -7.195   0.375 -26.930
  829    HB2  MET 109           2HB      MET 109  -6.720  -1.287 -24.451
  830    HB3  MET 109           1HB      MET 109  -5.926  -1.515 -26.003
  831    HG2  MET 109           2HG      MET 109  -4.902   0.693 -25.802
  832    HG3  MET 109           1HG      MET 109  -5.701   0.919 -24.247
  833    HE1  MET 109           3HE      MET 109  -2.025   0.464 -23.091
  834    HE2  MET 109           1HE      MET 109  -3.493   1.434 -22.961
  835    HE3  MET 109           2HE      MET 109  -2.624   1.352 -24.492
  836    H    ILE 110           HN       ILE 110  -7.795  -1.284 -28.265
  837    HA   ILE 110           HA       ILE 110 -10.090  -2.911 -27.368
  838    HB   ILE 110           HB       ILE 110 -10.714  -3.094 -29.770
  839   HG12  ILE 110          2HG1      ILE 110  -8.650  -0.911 -30.159
  840   HG13  ILE 110          1HG1      ILE 110  -8.487  -2.567 -30.723
  841   HG21  ILE 110          1HG2      ILE 110 -11.707  -0.876 -29.947
  842   HG22  ILE 110          2HG2      ILE 110 -10.626  -0.284 -28.685
  843   HG23  ILE 110          3HG2      ILE 110 -11.837  -1.511 -28.307
  844   HD11  ILE 110          3HD1      ILE 110 -10.446  -2.247 -32.173
  845   HD12  ILE 110          1HD1      ILE 110  -9.136  -1.123 -32.542
  846   HD13  ILE 110          2HD1      ILE 110 -10.541  -0.570 -31.633
  847    H    ASN 111           HN       ASN 111 -10.245  -4.784 -29.256
  848    HA   ASN 111           HA       ASN 111  -7.600  -6.024 -29.520
  849    HB2  ASN 111           2HB      ASN 111  -8.375  -8.158 -28.703
  850    HB3  ASN 111           1HB      ASN 111  -8.753  -6.952 -27.477
  851   HD21  ASN 111          1HD2      ASN 111  -9.995  -9.271 -29.676
  852   HD22  ASN 111          2HD2      ASN 111 -11.677  -9.077 -29.277
  853    H    LEU 112           HN       LEU 112  -7.471  -7.526 -31.264
  854    HA   LEU 112           HA       LEU 112  -9.833  -7.667 -32.987
  855    HB2  LEU 112           2HB      LEU 112  -8.509  -7.227 -34.995
  856    HB3  LEU 112           1HB      LEU 112  -8.516  -5.848 -33.917
  857    HG   LEU 112           HG       LEU 112  -6.215  -7.783 -33.912
  858   HD11  LEU 112          1HD1      LEU 112  -5.087  -6.301 -35.515
  859   HD12  LEU 112          2HD1      LEU 112  -6.590  -5.404 -35.728
  860   HD13  LEU 112          3HD1      LEU 112  -6.494  -7.093 -36.224
  861   HD21  LEU 112          3HD2      LEU 112  -6.470  -4.851 -33.232
  862   HD22  LEU 112          1HD2      LEU 112  -4.987  -5.800 -33.149
  863   HD23  LEU 112          2HD2      LEU 112  -6.335  -6.179 -32.078
  864    H    GLU 113           HN       GLU 113  -9.720  -9.404 -34.567
  865    HA   GLU 113           HA       GLU 113  -7.973 -11.579 -33.633
  866    HB2  GLU 113           2HB      GLU 113  -9.840 -13.128 -34.173
  867    HB3  GLU 113           1HB      GLU 113 -10.222 -12.004 -32.877
  868    HG2  GLU 113           2HG      GLU 113 -11.498 -10.628 -34.415
  869    HG3  GLU 113           1HG      GLU 113 -11.086 -11.709 -35.746
  870    H    HIS 114           HN       HIS 114  -6.935 -12.770 -35.133
  871    HA   HIS 114           HA       HIS 114  -7.384 -12.073 -37.959
  872    HB2  HIS 114           2HB      HIS 114  -5.027 -13.396 -36.592
  873    HB3  HIS 114           1HB      HIS 114  -5.173 -13.210 -38.335
  874    HD1  HIS 114           1HD      HIS 114  -3.349 -11.776 -35.816
  875    HD2  HIS 114           2HD      HIS 114  -5.879 -10.129 -38.679
  876    HE1  HIS 114           1HE      HIS 114  -2.634  -9.373 -36.057
  877    HE2  HIS 114           2HE      HIS 114  -4.257  -8.364 -37.707
  878    H    HIS 115           HN       HIS 115  -8.203 -13.551 -39.346
  879    HA   HIS 115           HA       HIS 115  -8.897 -16.160 -38.211
  880    HB2  HIS 115           2HB      HIS 115  -9.908 -14.718 -40.664
  881    HB3  HIS 115           1HB      HIS 115 -10.397 -16.347 -40.216
  882    HD1  HIS 115           1HD      HIS 115 -11.880 -13.306 -40.231
  883    HD2  HIS 115           2HD      HIS 115 -11.152 -15.973 -37.128
  884    HE1  HIS 115           1HE      HIS 115 -13.544 -12.728 -38.433
  885    HE2  HIS 115           2HE      HIS 115 -12.909 -14.193 -36.481
  886    H    HIS 116           HN       HIS 116  -8.239 -18.051 -39.014
  887    HA   HIS 116           HA       HIS 116  -6.290 -18.001 -41.228
  888    HB2  HIS 116           2HB      HIS 116  -6.748 -20.029 -39.030
  889    HB3  HIS 116           1HB      HIS 116  -5.689 -20.312 -40.404
  890    HD1  HIS 116           1HD      HIS 116  -3.430 -19.055 -40.450
  891    HD2  HIS 116           2HD      HIS 116  -5.721 -18.367 -37.047
  892    HE1  HIS 116           1HE      HIS 116  -1.865 -18.012 -38.775
  893    HE2  HIS 116           2HE      HIS 116  -3.210 -17.887 -36.649
  894    H    HIS 117           HN       HIS 117  -7.012 -18.711 -43.135
  895    HA   HIS 117           HA       HIS 117  -9.429 -20.372 -43.129
  896    HB2  HIS 117           2HB      HIS 117  -9.786 -19.745 -45.420
  897    HB3  HIS 117           1HB      HIS 117  -9.448 -18.283 -44.509
  898    HD1  HIS 117           1HD      HIS 117  -7.656 -16.799 -45.422
  899    HD2  HIS 117           2HD      HIS 117  -7.512 -20.625 -47.044
  900    HE1  HIS 117           1HE      HIS 117  -5.933 -16.699 -47.250
  901    HE2  HIS 117           2HE      HIS 117  -5.952 -18.988 -48.300
  902    H    HIS 118           HN       HIS 118  -9.492 -22.389 -43.996
  903    HA   HIS 118           HA       HIS 118  -6.899 -23.586 -44.614
  904    HB2  HIS 118           2HB      HIS 118  -7.959 -25.733 -44.409
  905    HB3  HIS 118           1HB      HIS 118  -8.467 -24.754 -43.043
  906    HD1  HIS 118           1HD      HIS 118  -9.798 -26.126 -46.327
  907    HD2  HIS 118           2HD      HIS 118 -11.178 -24.444 -42.777
  908    HE1  HIS 118           1HE      HIS 118 -12.292 -26.423 -46.357
  909    HE2  HIS 118           2HE      HIS 118 -13.080 -25.580 -44.117
  910    H    HIS 119           HN       HIS 119  -7.012 -25.285 -46.451
  911    HA   HIS 119           HA       HIS 119  -8.715 -24.323 -48.635
  912    HB2  HIS 119           2HB      HIS 119  -6.373 -23.459 -48.891
  913    HB3  HIS 119           1HB      HIS 119  -5.812 -25.128 -48.950
  914    HD1  HIS 119           1HD      HIS 119  -7.337 -22.461 -51.010
  915    HD2  HIS 119           2HD      HIS 119  -6.543 -26.533 -51.332
  916    HE1  HIS 119           1HE      HIS 119  -7.602 -23.015 -53.447
  917    HE2  HIS 119           2HE      HIS 119  -6.913 -25.428 -53.639
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1  -6.368 -34.935  10.135
    2    H2   MET   1           H2       MET   1  -5.269 -33.830  10.815
    3    H3   MET   1           H3       MET   1  -4.755 -35.390  10.388
    4    HA   MET   1           HA       MET   1  -4.992 -34.984   8.109
    5    HB2  MET   1           2HB      MET   1  -5.804 -32.813   7.247
    6    HB3  MET   1           1HB      MET   1  -7.039 -33.681   8.143
    7    HG2  MET   1           2HG      MET   1  -6.674 -32.246  10.070
    8    HG3  MET   1           1HG      MET   1  -5.389 -31.400   9.215
    9    HE1  MET   1           2HE      MET   1  -6.565 -29.067   9.731
   10    HE2  MET   1           3HE      MET   1  -7.835 -29.924  10.613
   11    HE3  MET   1           1HE      MET   1  -8.259 -28.737   9.380
   12    HA   PRO   2           HA       PRO   2  -1.044 -32.892   8.672
   13    HB2  PRO   2           2HB      PRO   2   0.370 -34.496   7.079
   14    HB3  PRO   2           1HB      PRO   2  -0.174 -35.062   8.665
   15    HG2  PRO   2           2HG      PRO   2  -1.237 -35.697   5.955
   16    HG3  PRO   2           1HG      PRO   2  -1.134 -36.724   7.395
   17    HD2  PRO   2           2HD      PRO   2  -3.405 -35.312   6.486
   18    HD3  PRO   2           1HD      PRO   2  -3.216 -36.112   8.058
   19    H    THR   3           HN       THR   3  -3.249 -32.205   6.821
   20    HA   THR   3           HA       THR   3  -2.304 -32.008   4.158
   21    HB   THR   3           HB       THR   3  -4.326 -30.528   3.879
   22    HG1  THR   3           1HG      THR   3  -4.179 -29.911   6.231
   23   HG21  THR   3          3HG2      THR   3  -4.470 -32.960   3.552
   24   HG22  THR   3          1HG2      THR   3  -5.950 -32.322   4.269
   25   HG23  THR   3          2HG2      THR   3  -4.778 -33.172   5.276
   26    H    PHE   4           HN       PHE   4  -0.752 -30.656   3.515
   27    HA   PHE   4           HA       PHE   4  -0.101 -28.201   4.744
   28    HB2  PHE   4           2HB      PHE   4   0.938 -27.807   2.364
   29    HB3  PHE   4           1HB      PHE   4   1.635 -29.005   3.443
   30    HD1  PHE   4           2HD      PHE   4  -0.299 -28.467   0.388
   31    HD2  PHE   4           1HD      PHE   4   1.438 -31.358   2.983
   32    HE1  PHE   4           2HE      PHE   4  -0.585 -30.187  -1.344
   33    HE2  PHE   4           1HE      PHE   4   1.157 -33.084   1.254
   34    HZ   PHE   4           HZ       PHE   4   0.146 -32.500  -0.912
   35    H    ASP   5           HN       ASP   5  -0.991 -26.233   4.525
   36    HA   ASP   5           HA       ASP   5  -3.038 -25.788   2.508
   37    HB2  ASP   5           2HB      ASP   5  -4.293 -26.831   4.303
   38    HB3  ASP   5           1HB      ASP   5  -3.563 -25.760   5.492
   39    H    HIS   6           HN       HIS   6  -1.926 -24.110   1.672
   40    HA   HIS   6           HA       HIS   6  -1.054 -21.938   3.393
   41    HB2  HIS   6           2HB      HIS   6  -0.107 -20.910   1.460
   42    HB3  HIS   6           1HB      HIS   6   0.252 -22.625   1.341
   43    HD1  HIS   6           1HD      HIS   6  -0.340 -23.724  -0.812
   44    HD2  HIS   6           2HD      HIS   6  -2.313 -20.093  -0.321
   45    HE1  HIS   6           1HE      HIS   6  -1.504 -23.274  -3.002
   46    HE2  HIS   6           2HE      HIS   6  -2.643 -21.043  -2.706
   47    H    GLY   7           HN       GLY   7  -1.793 -19.746   3.067
   48    HA2  GLY   7           2HA      GLY   7  -4.604 -19.674   2.173
   49    HA3  GLY   7           1HA      GLY   7  -3.989 -18.736   3.529
   50    H    ASN   8           HN       ASN   8  -5.337 -17.655   1.324
   51    HA   ASN   8           HA       ASN   8  -3.192 -15.997   0.164
   52    HB2  ASN   8           2HB      ASN   8  -5.956 -16.440  -0.975
   53    HB3  ASN   8           1HB      ASN   8  -4.669 -15.501  -1.704
   54   HD21  ASN   8          1HD2      ASN   8  -3.087 -16.504  -2.847
   55   HD22  ASN   8          2HD2      ASN   8  -3.100 -18.200  -3.209
   56    H    LEU   9           HN       LEU   9  -3.535 -13.781   0.193
   57    HA   LEU   9           HA       LEU   9  -5.918 -12.754   1.502
   58    HB2  LEU   9           2HB      LEU   9  -4.397 -13.316   3.360
   59    HB3  LEU   9           1HB      LEU   9  -3.159 -12.297   2.647
   60    HG   LEU   9           HG       LEU   9  -4.634 -10.329   2.967
   61   HD11  LEU   9          1HD1      LEU   9  -6.605 -10.559   4.424
   62   HD12  LEU   9          2HD1      LEU   9  -6.411 -12.312   4.385
   63   HD13  LEU   9          3HD1      LEU   9  -6.790 -11.434   2.903
   64   HD21  LEU   9          3HD2      LEU   9  -4.375 -10.196   5.396
   65   HD22  LEU   9          1HD2      LEU   9  -2.944 -10.898   4.639
   66   HD23  LEU   9          2HD2      LEU   9  -4.105 -11.936   5.464
   67    H    SER  10           HN       SER  10  -6.301 -10.605   1.072
   68    HA   SER  10           HA       SER  10  -4.308  -9.217  -0.577
   69    HB2  SER  10           2HB      SER  10  -7.320  -9.038  -0.871
   70    HB3  SER  10           1HB      SER  10  -6.121  -8.214  -1.869
   71    HG   SER  10           HG       SER  10  -5.492 -10.154  -2.734
   72    H    LEU  11           HN       LEU  11  -3.630  -7.383   0.328
   73    HA   LEU  11           HA       LEU  11  -4.940  -6.302   2.658
   74    HB2  LEU  11           2HB      LEU  11  -2.614  -5.251   1.034
   75    HB3  LEU  11           1HB      LEU  11  -3.150  -4.594   2.569
   76    HG   LEU  11           HG       LEU  11  -2.047  -7.382   2.165
   77   HD11  LEU  11          1HD1      LEU  11  -0.325  -5.699   1.866
   78   HD12  LEU  11          2HD1      LEU  11  -0.102  -6.539   3.402
   79   HD13  LEU  11          3HD1      LEU  11  -0.800  -4.919   3.377
   80   HD21  LEU  11          3HD2      LEU  11  -2.781  -5.884   4.681
   81   HD22  LEU  11          1HD2      LEU  11  -2.000  -7.464   4.612
   82   HD23  LEU  11          2HD2      LEU  11  -3.645  -7.268   4.006
   83    H    GLY  12           HN       GLY  12  -5.218  -5.966  -0.671
   84    HA2  GLY  12           2HA      GLY  12  -6.763  -4.718  -1.871
   85    HA3  GLY  12           1HA      GLY  12  -7.141  -3.827  -0.399
   86    H    GLU  13           HN       GLU  13  -7.096  -1.976  -1.878
   87    HA   GLU  13           HA       GLU  13  -4.510  -1.113  -2.805
   88    HB2  GLU  13           2HB      GLU  13  -7.202   0.255  -2.732
   89    HB3  GLU  13           1HB      GLU  13  -5.747   0.997  -3.390
   90    HG2  GLU  13           2HG      GLU  13  -5.572  -0.899  -4.982
   91    HG3  GLU  13           1HG      GLU  13  -7.120  -1.489  -4.381
   92    H    LEU  14           HN       LEU  14  -3.060  -0.329  -1.491
   93    HA   LEU  14           HA       LEU  14  -3.863   0.978   1.001
   94    HB2  LEU  14           2HB      LEU  14  -1.156   0.051   0.038
   95    HB3  LEU  14           1HB      LEU  14  -1.470   0.779   1.602
   96    HG   LEU  14           HG       LEU  14  -2.551  -1.863   0.623
   97   HD11  LEU  14          1HD1      LEU  14  -1.124  -2.827   2.350
   98   HD12  LEU  14          2HD1      LEU  14  -0.519  -1.220   2.754
   99   HD13  LEU  14          3HD1      LEU  14  -0.173  -1.920   1.173
  100   HD21  LEU  14          3HD2      LEU  14  -4.157  -0.731   2.051
  101   HD22  LEU  14          1HD2      LEU  14  -2.910  -0.462   3.267
  102   HD23  LEU  14          2HD2      LEU  14  -3.439  -2.103   2.896
  103    H    GLU  15           HN       GLU  15  -3.111   3.015   1.569
  104    HA   GLU  15           HA       GLU  15  -2.823   4.812  -0.678
  105    HB2  GLU  15           2HB      GLU  15  -2.903   5.397   2.287
  106    HB3  GLU  15           1HB      GLU  15  -3.064   6.578   0.993
  107    HG2  GLU  15           2HG      GLU  15  -5.157   5.672   0.321
  108    HG3  GLU  15           1HG      GLU  15  -4.963   4.279   1.384
  109    H    LEU  16           HN       LEU  16  -0.963   5.617  -1.413
  110    HA   LEU  16           HA       LEU  16   1.487   5.065   0.061
  111    HB2  LEU  16           2HB      LEU  16   1.263   4.547  -2.378
  112    HB3  LEU  16           1HB      LEU  16   1.152   6.267  -2.685
  113    HG   LEU  16           HG       LEU  16   3.554   5.228  -1.239
  114   HD11  LEU  16          1HD1      LEU  16   3.280   3.724  -3.153
  115   HD12  LEU  16          2HD1      LEU  16   4.671   4.792  -3.355
  116   HD13  LEU  16          3HD1      LEU  16   3.173   5.118  -4.230
  117   HD21  LEU  16          3HD2      LEU  16   3.245   7.638  -1.510
  118   HD22  LEU  16          1HD2      LEU  16   3.125   7.432  -3.256
  119   HD23  LEU  16          2HD2      LEU  16   4.640   7.069  -2.427
  120    H    THR  17           HN       THR  17   2.629   6.523   1.120
  121    HA   THR  17           HA       THR  17   1.793   9.343   0.991
  122    HB   THR  17           HB       THR  17   3.329   7.932   3.184
  123    HG1  THR  17           1HG      THR  17   0.612   8.782   3.286
  124   HG21  THR  17          3HG2      THR  17   1.966  10.633   3.169
  125   HG22  THR  17          1HG2      THR  17   3.706  10.376   3.057
  126   HG23  THR  17          2HG2      THR  17   2.840   9.911   4.522
  127    H    VAL  18           HN       VAL  18   3.298  10.920   0.517
  128    HA   VAL  18           HA       VAL  18   5.919   9.897  -0.349
  129    HB   VAL  18           HB       VAL  18   4.540  12.448  -1.215
  130   HG11  VAL  18          1HG1      VAL  18   6.973  12.574  -1.329
  131   HG12  VAL  18          2HG1      VAL  18   6.259  12.541  -2.941
  132   HG13  VAL  18          3HG1      VAL  18   7.012  11.090  -2.278
  133   HG21  VAL  18          3HG2      VAL  18   4.209  11.286  -3.369
  134   HG22  VAL  18          1HG2      VAL  18   3.315  10.538  -2.043
  135   HG23  VAL  18          2HG2      VAL  18   4.805   9.800  -2.631
  136    H    LEU  19           HN       LEU  19   7.585  10.379   0.911
  137    HA   LEU  19           HA       LEU  19   7.523  12.779   2.580
  138    HB2  LEU  19           2HB      LEU  19   9.643  10.638   2.293
  139    HB3  LEU  19           1HB      LEU  19   9.669  11.950   3.455
  140    HG   LEU  19           HG       LEU  19   7.662   9.696   3.388
  141   HD11  LEU  19          1HD1      LEU  19   9.864   8.970   4.127
  142   HD12  LEU  19          2HD1      LEU  19   8.728   9.001   5.478
  143   HD13  LEU  19          3HD1      LEU  19   9.920  10.290   5.297
  144   HD21  LEU  19          3HD2      LEU  19   6.872  10.611   5.513
  145   HD22  LEU  19          1HD2      LEU  19   6.663  11.769   4.197
  146   HD23  LEU  19          2HD2      LEU  19   7.991  11.967   5.345
  147    H    TYR  20           HN       TYR  20   8.261  14.623   1.760
  148    HA   TYR  20           HA       TYR  20  10.352  14.620  -0.245
  149    HB2  TYR  20           2HB      TYR  20   9.027  15.766  -1.938
  150    HB3  TYR  20           1HB      TYR  20   8.286  14.219  -1.547
  151    HD1  TYR  20           2HD      TYR  20   6.398  14.351   0.317
  152    HD2  TYR  20           1HD      TYR  20   7.677  17.640  -2.059
  153    HE1  TYR  20           2HE      TYR  20   4.270  15.494   0.764
  154    HE2  TYR  20           1HE      TYR  20   5.550  18.792  -1.616
  155    HH   TYR  20           HH       TYR  20   3.430  17.856   0.807
  156    H    ASP  21           HN       ASP  21   8.352  16.225   2.050
  157    HA   ASP  21           HA       ASP  21   8.391  18.240   3.061
  158    HB2  ASP  21           2HB      ASP  21  10.787  18.010   3.357
  159    HB3  ASP  21           1HB      ASP  21  11.079  18.557   1.708
  160    H    GLU  22           HN       GLU  22   7.107  19.832   2.536
  161    HA   GLU  22           HA       GLU  22   6.490  20.199  -0.236
  162    HB2  GLU  22           2HB      GLU  22   4.725  21.772   0.700
  163    HB3  GLU  22           1HB      GLU  22   4.615  20.077   1.150
  164    HG2  GLU  22           2HG      GLU  22   5.696  20.613   3.300
  165    HG3  GLU  22           1HG      GLU  22   5.693  22.316   2.846
  166    H    GLU  23           HN       GLU  23   8.853  21.600   1.563
  167    HA   GLU  23           HA       GLU  23   8.664  24.137   0.136
  168    HB2  GLU  23           2HB      GLU  23  10.600  23.198   2.253
  169    HB3  GLU  23           1HB      GLU  23  10.630  24.777   1.493
  170    HG2  GLU  23           2HG      GLU  23   8.280  25.095   2.342
  171    HG3  GLU  23           1HG      GLU  23   8.533  23.647   3.309
  172    H    ARG  24           HN       ARG  24   9.926  21.062  -0.243
  173    HA   ARG  24           HA       ARG  24  12.248  21.845  -1.794
  174    HB2  ARG  24           2HB      ARG  24  10.914  19.142  -1.528
  175    HB3  ARG  24           1HB      ARG  24  12.463  19.451  -2.288
  176    HG2  ARG  24           2HG      ARG  24  11.848  19.893   0.628
  177    HG3  ARG  24           1HG      ARG  24  12.670  18.482  -0.039
  178    HD2  ARG  24           2HD      ARG  24  14.433  19.797   0.686
  179    HD3  ARG  24           1HD      ARG  24  14.319  20.223  -1.021
  180    HE   ARG  24           HE       ARG  24  12.759  21.963   0.608
  181   HH11  ARG  24          1HH1      ARG  24  16.021  21.304  -0.475
  182   HH12  ARG  24          2HH1      ARG  24  16.580  22.924  -0.195
  183   HH21  ARG  24          1HH2      ARG  24  13.485  24.106   0.963
  184   HH22  ARG  24          2HH2      ARG  24  15.141  24.520   0.619
  185    H    TYR  25           HN       TYR  25   9.363  19.914  -2.563
  186    HA   TYR  25           HA       TYR  25   9.038  21.376  -5.076
  187    HB2  TYR  25           2HB      TYR  25   9.117  18.355  -4.866
  188    HB3  TYR  25           1HB      TYR  25   8.689  19.265  -6.303
  189    HD1  TYR  25           2HD      TYR  25  10.525  20.821  -7.283
  190    HD2  TYR  25           1HD      TYR  25  11.299  17.701  -4.498
  191    HE1  TYR  25           2HE      TYR  25  12.881  20.776  -7.994
  192    HE2  TYR  25           1HE      TYR  25  13.651  17.644  -5.197
  193    HH   TYR  25           HH       TYR  25  15.000  18.246  -7.152
  194    H    ASP  26           HN       ASP  26   6.912  20.715  -6.123
  195    HA   ASP  26           HA       ASP  26   4.949  19.838  -4.107
  196    HB2  ASP  26           2HB      ASP  26   4.700  21.740  -6.420
  197    HB3  ASP  26           1HB      ASP  26   3.283  20.871  -5.846
  198    H    ILE  27           HN       ILE  27   3.125  18.535  -5.050
  199    HA   ILE  27           HA       ILE  27   4.361  16.488  -6.720
  200    HB   ILE  27           HB       ILE  27   1.712  16.386  -5.275
  201   HG12  ILE  27          2HG1      ILE  27   4.417  15.316  -4.429
  202   HG13  ILE  27          1HG1      ILE  27   3.595  16.696  -3.710
  203   HG21  ILE  27          1HG2      ILE  27   1.923  13.958  -5.568
  204   HG22  ILE  27          2HG2      ILE  27   3.407  14.203  -6.490
  205   HG23  ILE  27          3HG2      ILE  27   1.871  14.802  -7.116
  206   HD11  ILE  27          3HD1      ILE  27   1.793  15.221  -2.964
  207   HD12  ILE  27          1HD1      ILE  27   3.360  14.720  -2.329
  208   HD13  ILE  27          2HD1      ILE  27   2.633  13.844  -3.674
  209    H    VAL  28           HN       VAL  28   3.953  16.322  -8.816
  210    HA   VAL  28           HA       VAL  28   1.539  17.620  -9.898
  211    HB   VAL  28           HB       VAL  28   4.046  16.864 -11.408
  212   HG11  VAL  28          1HG1      VAL  28   2.015  17.013 -12.774
  213   HG12  VAL  28          2HG1      VAL  28   3.158  18.299 -13.161
  214   HG13  VAL  28          3HG1      VAL  28   1.737  18.648 -12.177
  215   HG21  VAL  28          3HG2      VAL  28   4.524  18.571  -9.719
  216   HG22  VAL  28          1HG2      VAL  28   3.213  19.565 -10.352
  217   HG23  VAL  28          2HG2      VAL  28   4.628  19.232 -11.352
  218    H    GLU  29           HN       GLU  29   3.432  14.677  -9.833
  219    HA   GLU  29           HA       GLU  29   1.076  13.192 -10.707
  220    HB2  GLU  29           2HB      GLU  29   2.536  13.547 -12.700
  221    HB3  GLU  29           1HB      GLU  29   3.852  12.760 -11.845
  222    HG2  GLU  29           2HG      GLU  29   1.414  11.156 -11.999
  223    HG3  GLU  29           1HG      GLU  29   2.124  11.548 -13.565
  224    H    GLN  30           HN       GLN  30   1.226  10.882  -9.979
  225    HA   GLN  30           HA       GLN  30   3.157  10.186  -8.008
  226    HB2  GLN  30           2HB      GLN  30   1.795  10.467  -6.009
  227    HB3  GLN  30           1HB      GLN  30   2.021  12.021  -6.802
  228    HG2  GLN  30           2HG      GLN  30  -0.213  11.789  -7.825
  229    HG3  GLN  30           1HG      GLN  30  -0.438  10.286  -6.936
  230   HE21  GLN  30          1HE2      GLN  30  -0.323  13.736  -6.751
  231   HE22  GLN  30          2HE2      GLN  30  -0.962  13.879  -5.152
  232    H    THR  31           HN       THR  31   2.511   8.262  -6.768
  233    HA   THR  31           HA       THR  31   0.548   6.619  -8.190
  234    HB   THR  31           HB       THR  31   2.561   5.769  -6.092
  235    HG1  THR  31           1HG      THR  31   3.260   6.601  -8.349
  236   HG21  THR  31          3HG2      THR  31   0.927   4.152  -8.050
  237   HG22  THR  31          1HG2      THR  31   0.641   4.262  -6.315
  238   HG23  THR  31          2HG2      THR  31   2.117   3.509  -6.921
  239    H    GLU  32           HN       GLU  32  -1.448   6.810  -7.379
  240    HA   GLU  32           HA       GLU  32  -2.080   7.875  -4.858
  241    HB2  GLU  32           2HB      GLU  32  -3.513   6.744  -7.153
  242    HB3  GLU  32           1HB      GLU  32  -4.349   6.552  -5.620
  243    HG2  GLU  32           2HG      GLU  32  -3.238   9.219  -6.299
  244    HG3  GLU  32           1HG      GLU  32  -4.690   8.672  -7.133
  245    H    THR  33           HN       THR  33  -3.162   4.678  -5.912
  246    HA   THR  33           HA       THR  33  -2.470   3.609  -3.266
  247    HB   THR  33           HB       THR  33  -4.667   2.281  -3.489
  248    HG1  THR  33           1HG      THR  33  -5.799   2.729  -5.218
  249   HG21  THR  33          3HG2      THR  33  -4.753   5.257  -2.968
  250   HG22  THR  33          1HG2      THR  33  -4.355   4.003  -1.795
  251   HG23  THR  33          2HG2      THR  33  -5.984   4.100  -2.464
  252    H    VAL  34           HN       VAL  34  -1.935   1.424  -3.223
  253    HA   VAL  34           HA       VAL  34  -1.762   0.124  -5.872
  254    HB   VAL  34           HB       VAL  34   0.259  -0.346  -3.688
  255   HG11  VAL  34          1HG1      VAL  34   0.070  -2.061  -5.371
  256   HG12  VAL  34          2HG1      VAL  34   1.607  -1.212  -5.515
  257   HG13  VAL  34          3HG1      VAL  34   0.297  -0.863  -6.644
  258   HG21  VAL  34          3HG2      VAL  34   0.373   2.028  -4.272
  259   HG22  VAL  34          1HG2      VAL  34   0.515   1.603  -5.977
  260   HG23  VAL  34          2HG2      VAL  34   1.794   1.159  -4.850
  261    H    GLN  35           HN       GLN  35  -2.059  -2.119  -5.915
  262    HA   GLN  35           HA       GLN  35  -3.513  -3.190  -3.640
  263    HB2  GLN  35           2HB      GLN  35  -4.204  -4.967  -5.126
  264    HB3  GLN  35           1HB      GLN  35  -4.426  -3.424  -5.938
  265    HG2  GLN  35           2HG      GLN  35  -2.355  -3.774  -7.176
  266    HG3  GLN  35           1HG      GLN  35  -2.126  -5.317  -6.364
  267   HE21  GLN  35          1HE2      GLN  35  -2.176  -6.540  -8.182
  268   HE22  GLN  35          2HE2      GLN  35  -3.598  -6.769  -9.138
  269    H    VAL  36           HN       VAL  36  -2.818  -4.774  -2.369
  270    HA   VAL  36           HA       VAL  36  -0.219  -6.059  -2.930
  271    HB   VAL  36           HB       VAL  36  -1.172  -5.205  -0.187
  272   HG11  VAL  36          1HG1      VAL  36   1.120  -5.712   0.497
  273   HG12  VAL  36          2HG1      VAL  36   1.492  -6.240  -1.144
  274   HG13  VAL  36          3HG1      VAL  36   0.315  -7.130  -0.178
  275   HG21  VAL  36          3HG2      VAL  36   0.520  -3.448  -0.273
  276   HG22  VAL  36          1HG2      VAL  36  -0.684  -3.230  -1.543
  277   HG23  VAL  36          2HG2      VAL  36   0.905  -3.888  -1.938
  278    H    ASP  37           HN       ASP  37  -0.149  -8.187  -2.633
  279    HA   ASP  37           HA       ASP  37  -2.419  -9.522  -1.308
  280    HB2  ASP  37           2HB      ASP  37  -1.004 -10.395  -3.843
  281    HB3  ASP  37           1HB      ASP  37  -2.166 -11.377  -2.963
  282    H    LEU  38           HN       LEU  38  -1.886 -11.570  -0.342
  283    HA   LEU  38           HA       LEU  38   0.989 -11.984   0.123
  284    HB2  LEU  38           2HB      LEU  38  -1.161 -11.870   2.242
  285    HB3  LEU  38           1HB      LEU  38   0.486 -12.393   2.525
  286    HG   LEU  38           HG       LEU  38  -0.314  -9.623   1.625
  287   HD11  LEU  38          1HD1      LEU  38  -1.061 -10.093   3.901
  288   HD12  LEU  38          2HD1      LEU  38   0.259  -8.925   3.884
  289   HD13  LEU  38          3HD1      LEU  38   0.570 -10.600   4.335
  290   HD21  LEU  38          3HD2      LEU  38   2.000  -9.041   2.140
  291   HD22  LEU  38          1HD2      LEU  38   1.913 -10.264   0.876
  292   HD23  LEU  38          2HD2      LEU  38   2.345 -10.727   2.521
  293    H    GLU  39           HN       GLU  39   1.602 -14.051   0.063
  294    HA   GLU  39           HA       GLU  39  -0.457 -16.128   0.365
  295    HB2  GLU  39           2HB      GLU  39   1.663 -15.857  -1.727
  296    HB3  GLU  39           1HB      GLU  39   1.169 -17.462  -1.211
  297    HG2  GLU  39           2HG      GLU  39  -1.129 -16.967  -1.812
  298    HG3  GLU  39           1HG      GLU  39  -0.656 -15.346  -2.307
  299    H    GLY  40           HN       GLY  40   0.116 -17.963   1.455
  300    HA2  GLY  40           2HA      GLY  40   2.392 -19.183   2.026
  301    HA3  GLY  40           1HA      GLY  40   2.569 -17.761   3.044
  302    HA   PRO  41           HA       PRO  41   0.592 -21.051   5.668
  303    HB2  PRO  41           2HB      PRO  41   2.019 -19.393   7.680
  304    HB3  PRO  41           1HB      PRO  41   1.947 -21.151   7.518
  305    HG2  PRO  41           2HG      PRO  41   4.146 -19.809   6.840
  306    HG3  PRO  41           1HG      PRO  41   3.596 -21.201   5.892
  307    HD2  PRO  41           2HD      PRO  41   3.351 -18.283   5.293
  308    HD3  PRO  41           1HD      PRO  41   3.691 -19.635   4.193
  309    H    ARG  42           HN       ARG  42  -1.493 -20.506   5.745
  310    HA   ARG  42           HA       ARG  42  -2.486 -17.930   6.170
  311    HB2  ARG  42           2HB      ARG  42  -4.682 -19.229   6.755
  312    HB3  ARG  42           1HB      ARG  42  -4.058 -19.195   5.117
  313    HG2  ARG  42           2HG      ARG  42  -4.738 -21.396   5.506
  314    HG3  ARG  42           1HG      ARG  42  -2.983 -21.424   5.618
  315    HD2  ARG  42           2HD      ARG  42  -3.096 -21.455   8.027
  316    HD3  ARG  42           1HD      ARG  42  -4.851 -21.278   7.975
  317    HE   ARG  42           HE       ARG  42  -4.481 -23.510   6.531
  318   HH11  ARG  42          1HH1      ARG  42  -3.286 -22.536   9.679
  319   HH12  ARG  42          2HH1      ARG  42  -3.187 -24.162  10.288
  320   HH21  ARG  42          1HH2      ARG  42  -4.340 -25.637   7.326
  321   HH22  ARG  42          2HH2      ARG  42  -3.770 -25.923   8.938
  322    H    GLY  43           HN       GLY  43  -1.540 -20.363   8.465
  323    HA2  GLY  43           2HA      GLY  43  -2.867 -19.497  10.751
  324    HA3  GLY  43           1HA      GLY  43  -1.252 -20.191  10.737
  325    H    VAL  44           HN       VAL  44   0.084 -18.181   9.264
  326    HA   VAL  44           HA       VAL  44   0.477 -16.154  11.228
  327    HB   VAL  44           HB       VAL  44   1.393 -16.180   8.343
  328   HG11  VAL  44          1HG1      VAL  44   3.080 -14.579   9.063
  329   HG12  VAL  44          2HG1      VAL  44   2.411 -14.588  10.693
  330   HG13  VAL  44          3HG1      VAL  44   1.458 -13.952   9.353
  331   HG21  VAL  44          3HG2      VAL  44   2.791 -17.122  10.846
  332   HG22  VAL  44          1HG2      VAL  44   3.536 -16.990   9.253
  333   HG23  VAL  44          2HG2      VAL  44   2.218 -18.130   9.519
  334    H    LEU  45           HN       LEU  45  -1.150 -16.284   8.108
  335    HA   LEU  45           HA       LEU  45  -1.750 -13.573   7.804
  336    HB2  LEU  45           2HB      LEU  45  -3.206 -16.014   6.799
  337    HB3  LEU  45           1HB      LEU  45  -3.576 -14.377   6.291
  338    HG   LEU  45           HG       LEU  45  -0.920 -15.755   5.876
  339   HD11  LEU  45          1HD1      LEU  45  -2.685 -16.769   4.537
  340   HD12  LEU  45          2HD1      LEU  45  -1.578 -15.840   3.523
  341   HD13  LEU  45          3HD1      LEU  45  -3.161 -15.178   3.942
  342   HD21  LEU  45          3HD2      LEU  45  -0.744 -13.330   6.093
  343   HD22  LEU  45          1HD2      LEU  45  -1.990 -13.123   4.862
  344   HD23  LEU  45          2HD2      LEU  45  -0.436 -13.843   4.432
  345    H    THR  46           HN       THR  46  -3.657 -16.171   9.315
  346    HA   THR  46           HA       THR  46  -5.940 -14.650   9.877
  347    HB   THR  46           HB       THR  46  -4.838 -16.973  11.475
  348    HG1  THR  46           1HG      THR  46  -6.400 -18.127  10.071
  349   HG21  THR  46          3HG2      THR  46  -6.620 -15.777  12.650
  350   HG22  THR  46          1HG2      THR  46  -7.182 -17.354  12.098
  351   HG23  THR  46          2HG2      THR  46  -7.651 -15.897  11.225
  352    H    VAL  47           HN       VAL  47  -2.994 -15.163  11.810
  353    HA   VAL  47           HA       VAL  47  -3.831 -13.710  14.086
  354    HB   VAL  47           HB       VAL  47  -1.018 -14.098  13.037
  355   HG11  VAL  47          1HG1      VAL  47  -1.141 -12.294  14.677
  356   HG12  VAL  47          2HG1      VAL  47  -0.313 -13.701  15.350
  357   HG13  VAL  47          3HG1      VAL  47  -1.984 -13.363  15.801
  358   HG21  VAL  47          3HG2      VAL  47  -0.907 -15.976  14.597
  359   HG22  VAL  47          1HG2      VAL  47  -2.178 -16.213  13.398
  360   HG23  VAL  47          2HG2      VAL  47  -2.595 -15.712  15.036
  361    H    PHE  48           HN       PHE  48  -2.226 -12.778  11.103
  362    HA   PHE  48           HA       PHE  48  -1.751 -10.064  11.790
  363    HB2  PHE  48           2HB      PHE  48  -0.623 -11.394   9.956
  364    HB3  PHE  48           1HB      PHE  48  -2.107 -11.243   9.026
  365    HD1  PHE  48           2HD      PHE  48   0.552  -9.252  10.670
  366    HD2  PHE  48           1HD      PHE  48  -2.459  -9.391   7.668
  367    HE1  PHE  48           2HE      PHE  48   1.358  -7.111   9.768
  368    HE2  PHE  48           1HE      PHE  48  -1.657  -7.252   6.760
  369    HZ   PHE  48           HZ       PHE  48   0.253  -6.108   7.812
  370    H    ARG  49           HN       ARG  49  -4.423 -11.810  10.360
  371    HA   ARG  49           HA       ARG  49  -5.878  -9.529   9.491
  372    HB2  ARG  49           2HB      ARG  49  -6.306 -12.459   9.671
  373    HB3  ARG  49           1HB      ARG  49  -7.717 -11.438   9.500
  374    HG2  ARG  49           2HG      ARG  49  -5.355 -11.287   7.656
  375    HG3  ARG  49           1HG      ARG  49  -6.747 -12.333   7.366
  376    HD2  ARG  49           2HD      ARG  49  -6.963  -9.360   7.788
  377    HD3  ARG  49           1HD      ARG  49  -6.807 -10.108   6.198
  378    HE   ARG  49           HE       ARG  49  -8.901 -11.434   7.203
  379   HH11  ARG  49          1HH1      ARG  49  -8.190  -8.005   7.121
  380   HH12  ARG  49          2HH1      ARG  49  -9.854  -7.523   7.044
  381   HH21  ARG  49          1HH2      ARG  49 -11.088 -10.821   7.074
  382   HH22  ARG  49          2HH2      ARG  49 -11.516  -9.132   7.002
  383    H    PHE  50           HN       PHE  50  -5.552 -11.118  12.530
  384    HA   PHE  50           HA       PHE  50  -8.011 -10.279  13.673
  385    HB2  PHE  50           2HB      PHE  50  -5.366 -11.118  14.834
  386    HB3  PHE  50           1HB      PHE  50  -6.688 -10.577  15.849
  387    HD1  PHE  50           2HD      PHE  50  -9.006 -11.785  14.502
  388    HD2  PHE  50           1HD      PHE  50  -5.140 -13.376  15.297
  389    HE1  PHE  50           2HE      PHE  50  -9.944 -14.059  14.491
  390    HE2  PHE  50           1HE      PHE  50  -6.072 -15.654  15.287
  391    HZ   PHE  50           HZ       PHE  50  -8.477 -15.997  14.885
  392    H    ALA  51           HN       ALA  51  -4.951  -8.770  13.099
  393    HA   ALA  51           HA       ALA  51  -5.477  -6.565  14.898
  394    HB1  ALA  51           1HB      ALA  51  -3.182  -7.019  12.990
  395    HB2  ALA  51           2HB      ALA  51  -3.196  -7.442  14.703
  396    HB3  ALA  51           3HB      ALA  51  -3.283  -5.750  14.211
  397    H    ARG  52           HN       ARG  52  -5.402  -4.365  14.120
  398    HA   ARG  52           HA       ARG  52  -6.924  -3.979  11.707
  399    HB2  ARG  52           2HB      ARG  52  -5.885  -2.051  13.783
  400    HB3  ARG  52           1HB      ARG  52  -6.968  -1.641  12.473
  401    HG2  ARG  52           2HG      ARG  52  -8.680  -3.076  13.371
  402    HG3  ARG  52           1HG      ARG  52  -7.586  -3.622  14.643
  403    HD2  ARG  52           2HD      ARG  52  -7.453  -1.265  15.435
  404    HD3  ARG  52           1HD      ARG  52  -8.690  -0.849  14.249
  405    HE   ARG  52           HE       ARG  52  -9.927  -2.792  15.552
  406   HH11  ARG  52          1HH1      ARG  52  -8.052  -0.106  16.791
  407   HH12  ARG  52          2HH1      ARG  52  -8.940  -0.014  18.287
  408   HH21  ARG  52          1HH2      ARG  52 -11.067  -2.704  17.530
  409   HH22  ARG  52          2HH2      ARG  52 -10.636  -1.511  18.720
  410    HA   PRO  53           HA       PRO  53  -3.700  -2.949   8.902
  411    HB2  PRO  53           2HB      PRO  53  -4.493  -0.329   8.207
  412    HB3  PRO  53           1HB      PRO  53  -4.861  -1.825   7.350
  413    HG2  PRO  53           2HG      PRO  53  -6.525  -0.266   9.235
  414    HG3  PRO  53           1HG      PRO  53  -7.021  -1.316   7.898
  415    HD2  PRO  53           2HD      PRO  53  -7.281  -2.044  10.483
  416    HD3  PRO  53           1HD      PRO  53  -6.938  -3.218   9.196
  417    H    SER  54           HN       SER  54  -1.756  -2.559   9.605
  418    HA   SER  54           HA       SER  54  -1.120   0.062  10.708
  419    HB2  SER  54           2HB      SER  54  -0.152  -2.666  11.522
  420    HB3  SER  54           1HB      SER  54   0.658  -1.190  11.981
  421    HG   SER  54           HG       SER  54  -1.413  -0.525  12.904
  422    H    TYR  55           HN       TYR  55  -0.997  -1.638   8.093
  423    HA   TYR  55           HA       TYR  55   1.840  -1.477   7.485
  424    HB2  TYR  55           2HB      TYR  55   0.775  -2.387   5.191
  425    HB3  TYR  55           1HB      TYR  55   1.180  -3.439   6.542
  426    HD1  TYR  55           1HD      TYR  55  -1.565  -1.858   4.677
  427    HD2  TYR  55           2HD      TYR  55  -0.549  -4.447   7.895
  428    HE1  TYR  55           1HE      TYR  55  -3.899  -2.627   4.794
  429    HE2  TYR  55           2HE      TYR  55  -2.875  -5.221   8.017
  430    HH   TYR  55           HH       TYR  55  -5.170  -4.582   5.605
  431    H    GLU  56           HN       GLU  56   2.727   0.102   6.360
  432    HA   GLU  56           HA       GLU  56   0.966   1.979   4.949
  433    HB2  GLU  56           2HB      GLU  56   3.209   2.712   6.843
  434    HB3  GLU  56           1HB      GLU  56   2.284   3.851   5.873
  435    HG2  GLU  56           2HG      GLU  56   0.273   3.322   7.072
  436    HG3  GLU  56           1HG      GLU  56   1.092   2.040   7.961
  437    H    VAL  57           HN       VAL  57   1.954   3.153   3.261
  438    HA   VAL  57           HA       VAL  57   4.512   2.026   2.321
  439    HB   VAL  57           HB       VAL  57   2.138   2.784   0.599
  440   HG11  VAL  57          1HG1      VAL  57   4.789   1.560  -0.151
  441   HG12  VAL  57          2HG1      VAL  57   4.263   3.206  -0.503
  442   HG13  VAL  57          3HG1      VAL  57   3.433   1.841  -1.244
  443   HG21  VAL  57          3HG2      VAL  57   1.940   0.410   0.102
  444   HG22  VAL  57          1HG2      VAL  57   1.739   0.712   1.827
  445   HG23  VAL  57          2HG2      VAL  57   3.259   0.056   1.218
  446    H    PHE  58           HN       PHE  58   6.022   3.550   1.996
  447    HA   PHE  58           HA       PHE  58   5.267   6.205   1.133
  448    HB2  PHE  58           2HB      PHE  58   6.532   7.292   3.006
  449    HB3  PHE  58           1HB      PHE  58   5.032   6.519   3.495
  450    HD1  PHE  58           2HD      PHE  58   8.685   6.388   3.672
  451    HD2  PHE  58           1HD      PHE  58   5.039   4.580   4.921
  452    HE1  PHE  58           2HE      PHE  58   9.904   5.132   5.401
  453    HE2  PHE  58           1HE      PHE  58   6.250   3.323   6.654
  454    HZ   PHE  58           HZ       PHE  58   8.687   3.596   6.895
  455    H    VAL  59           HN       VAL  59   6.985   7.444   0.351
  456    HA   VAL  59           HA       VAL  59   9.586   6.089   0.110
  457    HB   VAL  59           HB       VAL  59   9.789   7.018  -2.202
  458   HG11  VAL  59          1HG1      VAL  59   7.501   5.100  -1.767
  459   HG12  VAL  59          2HG1      VAL  59   9.212   4.677  -1.857
  460   HG13  VAL  59          3HG1      VAL  59   8.387   5.321  -3.276
  461   HG21  VAL  59          3HG2      VAL  59   8.111   8.781  -2.067
  462   HG22  VAL  59          1HG2      VAL  59   6.837   7.574  -1.888
  463   HG23  VAL  59          2HG2      VAL  59   7.746   7.680  -3.394
  464    H    ASP  60           HN       ASP  60  11.385   7.434   0.136
  465    HA   ASP  60           HA       ASP  60  10.828  10.213   0.940
  466    HB2  ASP  60           2HB      ASP  60  11.961   8.849   2.642
  467    HB3  ASP  60           1HB      ASP  60  13.241   8.472   1.497
  468    H    LEU  61           HN       LEU  61  10.972  11.480  -0.776
  469    HA   LEU  61           HA       LEU  61  13.363  11.283  -2.491
  470    HB2  LEU  61           2HB      LEU  61  10.551  11.917  -3.414
  471    HB3  LEU  61           1HB      LEU  61  11.983  11.911  -4.424
  472    HG   LEU  61           HG       LEU  61  10.900   9.460  -3.033
  473   HD11  LEU  61          1HD1      LEU  61   9.298  10.287  -4.668
  474   HD12  LEU  61          2HD1      LEU  61  10.057   8.796  -5.227
  475   HD13  LEU  61          3HD1      LEU  61  10.564  10.351  -5.894
  476   HD21  LEU  61          3HD2      LEU  61  12.363   8.278  -4.618
  477   HD22  LEU  61          1HD2      LEU  61  13.267   9.327  -3.525
  478   HD23  LEU  61          2HD2      LEU  61  12.975   9.829  -5.190
  479    H    THR  62           HN       THR  62  14.509  13.081  -2.103
  480    HA   THR  62           HA       THR  62  13.043  15.500  -1.337
  481    HB   THR  62           HB       THR  62  15.410  16.149  -0.448
  482    HG1  THR  62           1HG      THR  62  16.819  14.594  -0.780
  483   HG21  THR  62          3HG2      THR  62  14.889  15.038   1.690
  484   HG22  THR  62          1HG2      THR  62  13.701  14.027   0.863
  485   HG23  THR  62          2HG2      THR  62  13.455  15.770   0.966
  486    H    GLU  63           HN       GLU  63  15.581  14.334  -3.523
  487    HA   GLU  63           HA       GLU  63  15.649  17.020  -4.723
  488    HB2  GLU  63           2HB      GLU  63  17.680  14.808  -4.739
  489    HB3  GLU  63           1HB      GLU  63  17.793  16.204  -5.780
  490    HG2  GLU  63           2HG      GLU  63  17.827  17.628  -3.806
  491    HG3  GLU  63           1HG      GLU  63  17.784  16.195  -2.799
  492    H    ALA  64           HN       ALA  64  14.879  13.715  -5.302
  493    HA   ALA  64           HA       ALA  64  14.955  13.606  -8.093
  494    HB1  ALA  64           1HB      ALA  64  13.410  11.755  -7.893
  495    HB2  ALA  64           2HB      ALA  64  13.005  12.240  -6.246
  496    HB3  ALA  64           3HB      ALA  64  14.629  11.663  -6.622
  497    H    GLY  65           HN       GLY  65  13.907  14.852  -9.534
  498    HA2  GLY  65           2HA      GLY  65  11.230  15.814  -8.831
  499    HA3  GLY  65           1HA      GLY  65  12.467  16.988  -9.211
  500    H    GLU  66           HN       GLU  66  13.393  16.886 -11.352
  501    HA   GLU  66           HA       GLU  66  11.487  17.397 -13.222
  502    HB2  GLU  66           2HB      GLU  66  14.308  16.514 -13.762
  503    HB3  GLU  66           1HB      GLU  66  13.264  17.326 -14.912
  504    HG2  GLU  66           2HG      GLU  66  13.125  19.235 -13.298
  505    HG3  GLU  66           1HG      GLU  66  14.389  18.436 -12.360
  506    H    GLY  67           HN       GLY  67  10.666  16.448 -15.040
  507    HA2  GLY  67           2HA      GLY  67   9.690  14.746 -16.225
  508    HA3  GLY  67           1HA      GLY  67  11.045  13.732 -15.740
  509    H    SER  68           HN       SER  68  10.205  11.989 -14.897
  510    HA   SER  68           HA       SER  68   8.852  12.370 -12.359
  511    HB2  SER  68           2HB      SER  68   7.166  11.693 -14.100
  512    HB3  SER  68           1HB      SER  68   8.026  10.169 -14.259
  513    HG   SER  68           HG       SER  68   6.127  10.573 -12.613
  514    H    HIS  69           HN       HIS  69   9.391  10.764 -10.828
  515    HA   HIS  69           HA       HIS  69  11.874   9.398 -11.626
  516    HB2  HIS  69           2HB      HIS  69  11.863  11.309  -9.843
  517    HB3  HIS  69           1HB      HIS  69  11.280  10.041  -8.767
  518    HD1  HIS  69           1HD      HIS  69  12.986   8.407  -7.880
  519    HD2  HIS  69           2HD      HIS  69  14.473  10.793 -10.939
  520    HE1  HIS  69           1HE      HIS  69  15.455   7.929  -7.973
  521    HE2  HIS  69           2HE      HIS  69  16.357   9.486  -9.740
  522    H    THR  70           HN       THR  70  11.897   7.314 -11.625
  523    HA   THR  70           HA       THR  70   9.771   5.863 -10.212
  524    HB   THR  70           HB       THR  70  11.516   4.913 -12.496
  525    HG1  THR  70           1HG      THR  70   9.556   6.665 -12.556
  526   HG21  THR  70          3HG2      THR  70  10.590   3.102 -11.146
  527   HG22  THR  70          1HG2      THR  70   9.819   3.157 -12.731
  528   HG23  THR  70          2HG2      THR  70   8.975   3.787 -11.317
  529    H    VAL  71           HN       VAL  71  10.374   4.934  -8.361
  530    HA   VAL  71           HA       VAL  71  13.081   3.770  -8.169
  531    HB   VAL  71           HB       VAL  71  13.028   4.263  -5.720
  532   HG11  VAL  71          1HG1      VAL  71  14.287   5.687  -7.248
  533   HG12  VAL  71          2HG1      VAL  71  13.616   6.622  -5.913
  534   HG13  VAL  71          3HG1      VAL  71  12.858   6.685  -7.503
  535   HG21  VAL  71          3HG2      VAL  71  10.640   5.953  -6.457
  536   HG22  VAL  71          1HG2      VAL  71  11.475   5.988  -4.903
  537   HG23  VAL  71          2HG2      VAL  71  10.637   4.526  -5.420
  538    H    ASP  72           HN       ASP  72  13.224   1.999  -6.518
  539    HA   ASP  72           HA       ASP  72  10.806   0.383  -6.564
  540    HB2  ASP  72           2HB      ASP  72  12.103  -1.432  -5.728
  541    HB3  ASP  72           1HB      ASP  72  13.096  -0.626  -6.932
  542    H    VAL  73           HN       VAL  73   9.628  -0.221  -4.745
  543    HA   VAL  73           HA       VAL  73   9.786   1.860  -2.680
  544    HB   VAL  73           HB       VAL  73   7.427   0.149  -3.479
  545   HG11  VAL  73          1HG1      VAL  73   7.316   0.895  -1.157
  546   HG12  VAL  73          2HG1      VAL  73   6.098   1.696  -2.151
  547   HG13  VAL  73          3HG1      VAL  73   7.559   2.562  -1.680
  548   HG21  VAL  73          3HG2      VAL  73   8.057   1.651  -5.269
  549   HG22  VAL  73          1HG2      VAL  73   8.085   3.012  -4.147
  550   HG23  VAL  73          2HG2      VAL  73   6.562   2.203  -4.512
  551    H    GLU  74           HN       GLU  74  10.190   1.403  -0.649
  552    HA   GLU  74           HA       GLU  74  10.239  -1.345   0.291
  553    HB2  GLU  74           2HB      GLU  74  10.928   1.261   1.668
  554    HB3  GLU  74           1HB      GLU  74  11.099  -0.331   2.397
  555    HG2  GLU  74           2HG      GLU  74  12.739  -0.950   0.733
  556    HG3  GLU  74           1HG      GLU  74  12.525   0.597  -0.084
  557    H    HIS  75           HN       HIS  75   9.003  -2.025   2.160
  558    HA   HIS  75           HA       HIS  75   6.530  -0.449   2.480
  559    HB2  HIS  75           2HB      HIS  75   6.751  -3.466   2.439
  560    HB3  HIS  75           1HB      HIS  75   5.273  -2.543   2.664
  561    HD1  HIS  75           1HD      HIS  75   7.344  -4.091   0.122
  562    HD2  HIS  75           2HD      HIS  75   4.556  -1.000   0.249
  563    HE1  HIS  75           1HE      HIS  75   6.640  -3.707  -2.267
  564    HE2  HIS  75           2HE      HIS  75   5.031  -1.771  -2.175
  565    H    ARG  76           HN       ARG  76   5.498  -0.548   4.514
  566    HA   ARG  76           HA       ARG  76   7.111  -1.722   6.676
  567    HB2  ARG  76           2HB      ARG  76   6.272   1.046   6.292
  568    HB3  ARG  76           1HB      ARG  76   5.765   0.402   7.847
  569    HG2  ARG  76           2HG      ARG  76   8.581   0.459   6.778
  570    HG3  ARG  76           1HG      ARG  76   7.911   1.496   8.042
  571    HD2  ARG  76           2HD      ARG  76   7.399  -0.595   9.338
  572    HD3  ARG  76           1HD      ARG  76   8.325  -1.488   8.137
  573    HE   ARG  76           HE       ARG  76  10.202   0.149   8.843
  574   HH11  ARG  76          1HH1      ARG  76   7.702  -1.126  10.949
  575   HH12  ARG  76          2HH1      ARG  76   8.707  -1.117  12.366
  576   HH21  ARG  76          1HH2      ARG  76  11.543   0.145  10.724
  577   HH22  ARG  76          2HH2      ARG  76  10.880  -0.412  12.237
  578    H    GLY  77           HN       GLY  77   5.821  -2.059   8.696
  579    HA2  GLY  77           2HA      GLY  77   3.740  -2.601   9.722
  580    HA3  GLY  77           1HA      GLY  77   3.012  -2.681   8.122
  581    H    PHE  78           HN       PHE  78   3.896  -4.423   6.684
  582    HA   PHE  78           HA       PHE  78   4.151  -6.885   8.239
  583    HB2  PHE  78           2HB      PHE  78   3.629  -8.014   6.070
  584    HB3  PHE  78           1HB      PHE  78   2.361  -6.923   6.615
  585    HD1  PHE  78           2HD      PHE  78   1.978  -4.793   5.467
  586    HD2  PHE  78           1HD      PHE  78   4.867  -7.587   4.061
  587    HE1  PHE  78           2HE      PHE  78   2.049  -3.625   3.303
  588    HE2  PHE  78           1HE      PHE  78   4.945  -6.420   1.897
  589    HZ   PHE  78           HZ       PHE  78   3.533  -4.438   1.514
  590    HA   PRO  79           HA       PRO  79   8.376  -7.273   6.876
  591    HB2  PRO  79           2HB      PRO  79   8.923  -9.660   7.935
  592    HB3  PRO  79           1HB      PRO  79   8.598  -8.261   8.966
  593    HG2  PRO  79           2HG      PRO  79   6.834 -10.566   8.287
  594    HG3  PRO  79           1HG      PRO  79   6.976  -9.667   9.807
  595    HD2  PRO  79           2HD      PRO  79   5.011  -9.294   7.836
  596    HD3  PRO  79           1HD      PRO  79   5.373  -8.190   9.175
  597    H    GLY  80           HN       GLY  80   9.778  -9.129   5.855
  598    HA2  GLY  80           2HA      GLY  80   8.304  -9.982   3.481
  599    HA3  GLY  80           1HA      GLY  80  10.052  -9.932   3.657
  600    H    ASP  81           HN       ASP  81   7.974 -11.401   6.042
  601    HA   ASP  81           HA       ASP  81   9.356 -13.895   5.842
  602    HB2  ASP  81           2HB      ASP  81   8.576 -13.109   8.009
  603    HB3  ASP  81           1HB      ASP  81   6.915 -13.118   7.434
  604    H    LEU  82           HN       LEU  82   6.210 -12.692   4.926
  605    HA   LEU  82           HA       LEU  82   5.435 -15.272   3.815
  606    HB2  LEU  82           2HB      LEU  82   3.920 -12.663   3.979
  607    HB3  LEU  82           1HB      LEU  82   3.260 -14.195   3.449
  608    HG   LEU  82           HG       LEU  82   4.316 -13.695   6.232
  609   HD11  LEU  82          1HD1      LEU  82   2.383 -12.292   5.854
  610   HD12  LEU  82          2HD1      LEU  82   1.943 -13.646   6.897
  611   HD13  LEU  82          3HD1      LEU  82   1.487 -13.660   5.195
  612   HD21  LEU  82          3HD2      LEU  82   4.380 -16.030   5.550
  613   HD22  LEU  82          1HD2      LEU  82   2.687 -15.947   5.059
  614   HD23  LEU  82          2HD2      LEU  82   3.123 -15.768   6.759
  615    H    ALA  83           HN       ALA  83   4.263 -15.049   1.586
  616    HA   ALA  83           HA       ALA  83   6.148 -13.859  -0.250
  617    HB1  ALA  83           1HB      ALA  83   3.555 -15.314  -0.788
  618    HB2  ALA  83           2HB      ALA  83   5.164 -16.030  -0.783
  619    HB3  ALA  83           3HB      ALA  83   4.735 -14.836  -2.008
  620    H    VAL  84           HN       VAL  84   6.073 -11.745  -0.549
  621    HA   VAL  84           HA       VAL  84   3.550 -10.320  -0.194
  622    HB   VAL  84           HB       VAL  84   6.354  -9.245  -0.569
  623   HG11  VAL  84          1HG1      VAL  84   3.789  -7.845   0.185
  624   HG12  VAL  84          2HG1      VAL  84   4.711  -7.636  -1.306
  625   HG13  VAL  84          3HG1      VAL  84   5.395  -7.120   0.235
  626   HG21  VAL  84          3HG2      VAL  84   6.178 -10.449   1.520
  627   HG22  VAL  84          1HG2      VAL  84   4.696  -9.587   1.928
  628   HG23  VAL  84          2HG2      VAL  84   6.226  -8.716   1.841
  629    H    THR  85           HN       THR  85   2.341  -9.821  -1.871
  630    HA   THR  85           HA       THR  85   3.634  -9.580  -4.505
  631    HB   THR  85           HB       THR  85   0.729 -10.225  -4.103
  632    HG1  THR  85           1HG      THR  85   2.255 -11.801  -3.091
  633   HG21  THR  85          3HG2      THR  85   1.429  -9.476  -6.326
  634   HG22  THR  85          1HG2      THR  85   0.941 -11.171  -6.355
  635   HG23  THR  85          2HG2      THR  85   2.652 -10.747  -6.370
  636    H    VAL  86           HN       VAL  86   3.317  -7.752  -5.572
  637    HA   VAL  86           HA       VAL  86   1.380  -5.770  -4.609
  638    HB   VAL  86           HB       VAL  86   3.885  -4.542  -5.471
  639   HG11  VAL  86          1HG1      VAL  86   3.588  -3.256  -3.373
  640   HG12  VAL  86          2HG1      VAL  86   2.260  -4.330  -2.927
  641   HG13  VAL  86          3HG1      VAL  86   2.125  -3.308  -4.359
  642   HG21  VAL  86          3HG2      VAL  86   5.210  -5.020  -3.439
  643   HG22  VAL  86          1HG2      VAL  86   5.011  -6.420  -4.492
  644   HG23  VAL  86          2HG2      VAL  86   4.058  -6.285  -3.011
  645    H    GLU  87           HN       GLU  87   0.919  -4.136  -6.448
  646    HA   GLU  87           HA       GLU  87   3.052  -4.491  -8.433
  647    HB2  GLU  87           2HB      GLU  87   1.086  -5.680  -9.324
  648    HB3  GLU  87           1HB      GLU  87   0.149  -4.199  -9.207
  649    HG2  GLU  87           2HG      GLU  87   0.760  -4.410 -11.461
  650    HG3  GLU  87           1HG      GLU  87   1.801  -3.158 -10.789
  651    HA   PRO  88           HA       PRO  88   3.994  -1.308  -9.667
  652    HB2  PRO  88           2HB      PRO  88   5.349   0.297  -7.970
  653    HB3  PRO  88           1HB      PRO  88   3.663   0.593  -8.377
  654    HG2  PRO  88           2HG      PRO  88   4.767  -0.205  -5.817
  655    HG3  PRO  88           1HG      PRO  88   3.081   0.182  -6.203
  656    HD2  PRO  88           2HD      PRO  88   4.442  -2.478  -6.138
  657    HD3  PRO  88           1HD      PRO  88   2.733  -2.076  -5.830
  658    H    ARG  89           HN       ARG  89   5.891  -2.220 -10.402
  659    HA   ARG  89           HA       ARG  89   7.383  -3.780  -8.427
  660    HB2  ARG  89           2HB      ARG  89   7.725  -3.652 -11.438
  661    HB3  ARG  89           1HB      ARG  89   8.576  -4.756 -10.352
  662    HG2  ARG  89           2HG      ARG  89   6.322  -5.540  -9.571
  663    HG3  ARG  89           1HG      ARG  89   5.631  -4.628 -10.907
  664    HD2  ARG  89           2HD      ARG  89   7.040  -5.947 -12.453
  665    HD3  ARG  89           1HD      ARG  89   7.549  -6.939 -11.087
  666    HE   ARG  89           HE       ARG  89   4.698  -6.668 -11.795
  667   HH11  ARG  89          1HH1      ARG  89   7.511  -8.679 -11.176
  668   HH12  ARG  89          2HH1      ARG  89   6.598 -10.164 -11.185
  669   HH21  ARG  89          1HH2      ARG  89   3.516  -8.604 -11.791
  670   HH22  ARG  89          2HH2      ARG  89   4.324 -10.117 -11.522
  671    H    MET  90           HN       MET  90   7.568  -1.059 -10.474
  672    HA   MET  90           HA       MET  90   9.349   0.155  -8.519
  673    HB2  MET  90           2HB      MET  90   9.708   0.419 -11.525
  674    HB3  MET  90           1HB      MET  90  10.470   1.473 -10.346
  675    HG2  MET  90           2HG      MET  90  11.639  -0.471  -9.396
  676    HG3  MET  90           1HG      MET  90  10.915  -1.487 -10.639
  677    HE1  MET  90           3HE      MET  90  12.282   2.204 -10.946
  678    HE2  MET  90           1HE      MET  90  13.937   1.905 -11.480
  679    HE3  MET  90           2HE      MET  90  13.432   1.418  -9.862
  680    H    ALA  91           HN       ALA  91   8.800   2.460  -8.284
  681    HA   ALA  91           HA       ALA  91   6.060   2.890  -9.303
  682    HB1  ALA  91           1HB      ALA  91   5.514   3.968  -7.189
  683    HB2  ALA  91           2HB      ALA  91   7.154   3.674  -6.608
  684    HB3  ALA  91           3HB      ALA  91   6.077   2.316  -6.932
  685    H    ARG  92           HN       ARG  92   5.342   5.049  -9.520
  686    HA   ARG  92           HA       ARG  92   7.545   6.743 -10.475
  687    HB2  ARG  92           2HB      ARG  92   6.161   5.639 -12.206
  688    HB3  ARG  92           1HB      ARG  92   4.745   6.462 -11.576
  689    HG2  ARG  92           2HG      ARG  92   5.877   8.618 -12.094
  690    HG3  ARG  92           1HG      ARG  92   7.149   7.691 -12.892
  691    HD2  ARG  92           2HD      ARG  92   4.220   7.663 -13.614
  692    HD3  ARG  92           1HD      ARG  92   5.494   8.502 -14.496
  693    HE   ARG  92           HE       ARG  92   6.465   6.144 -14.768
  694   HH11  ARG  92          1HH1      ARG  92   3.036   6.784 -14.483
  695   HH12  ARG  92          2HH1      ARG  92   2.572   5.483 -15.545
  696   HH21  ARG  92          1HH2      ARG  92   5.871   4.430 -16.146
  697   HH22  ARG  92          2HH2      ARG  92   4.192   4.134 -16.473
  698    H    VAL  93           HN       VAL  93   7.702   8.674  -9.606
  699    HA   VAL  93           HA       VAL  93   5.317  10.078  -8.633
  700    HB   VAL  93           HB       VAL  93   7.895   9.881  -7.051
  701   HG11  VAL  93          1HG1      VAL  93   5.318  11.327  -6.443
  702   HG12  VAL  93          2HG1      VAL  93   6.871  12.067  -6.824
  703   HG13  VAL  93          3HG1      VAL  93   6.673  11.153  -5.330
  704   HG21  VAL  93          3HG2      VAL  93   6.591   7.826  -6.879
  705   HG22  VAL  93          1HG2      VAL  93   5.166   8.761  -6.427
  706   HG23  VAL  93          2HG2      VAL  93   6.568   8.719  -5.357
  707    H    GLN  94           HN       GLN  94   5.278  12.173  -9.292
  708    HA   GLN  94           HA       GLN  94   7.779  13.284 -10.383
  709    HB2  GLN  94           2HB      GLN  94   6.101  13.067 -12.108
  710    HB3  GLN  94           1HB      GLN  94   4.908  13.890 -11.111
  711    HG2  GLN  94           2HG      GLN  94   6.214  15.941 -11.225
  712    HG3  GLN  94           1HG      GLN  94   7.433  15.124 -12.191
  713   HE21  GLN  94          1HE2      GLN  94   7.204  16.527 -13.875
  714   HE22  GLN  94          2HE2      GLN  94   5.816  16.541 -14.906
  715    H    LEU  95           HN       LEU  95   8.673  14.809  -9.235
  716    HA   LEU  95           HA       LEU  95   6.973  16.574  -7.602
  717    HB2  LEU  95           2HB      LEU  95   9.859  15.782  -7.185
  718    HB3  LEU  95           1HB      LEU  95   9.001  16.962  -6.218
  719    HG   LEU  95           HG       LEU  95   8.317  14.028  -6.403
  720   HD11  LEU  95          1HD1      LEU  95   9.108  13.934  -4.089
  721   HD12  LEU  95          2HD1      LEU  95   9.611  15.622  -4.197
  722   HD13  LEU  95          3HD1      LEU  95  10.394  14.401  -5.204
  723   HD21  LEU  95          3HD2      LEU  95   6.348  15.420  -6.023
  724   HD22  LEU  95          1HD2      LEU  95   7.160  16.208  -4.669
  725   HD23  LEU  95          2HD2      LEU  95   6.761  14.491  -4.580
  726    H    GLU  96           HN       GLU  96   6.939  18.658  -8.206
  727    HA   GLU  96           HA       GLU  96   9.164  19.672  -9.816
  728    HB2  GLU  96           2HB      GLU  96   7.289  18.797 -11.284
  729    HB3  GLU  96           1HB      GLU  96   6.292  20.091 -10.637
  730    HG2  GLU  96           2HG      GLU  96   7.609  21.752 -11.639
  731    HG3  GLU  96           1HG      GLU  96   8.921  20.624 -11.974
  732    H    GLU  97           HN       GLU  97   9.496  21.876  -9.686
  733    HA   GLU  97           HA       GLU  97   8.984  22.994  -7.180
  734    HB2  GLU  97           2HB      GLU  97  10.931  23.614  -8.442
  735    HB3  GLU  97           1HB      GLU  97   9.941  24.249  -9.748
  736    HG2  GLU  97           2HG      GLU  97   9.094  25.984  -8.205
  737    HG3  GLU  97           1HG      GLU  97  10.195  25.377  -6.971
  738    H    ARG  98           HN       ARG  98   7.284  23.912  -6.381
  739    HA   ARG  98           HA       ARG  98   5.493  25.209  -6.038
  740    HB2  ARG  98           2HB      ARG  98   6.742  26.901  -7.248
  741    HB3  ARG  98           1HB      ARG  98   6.127  26.291  -8.769
  742    HG2  ARG  98           2HG      ARG  98   4.950  28.302  -8.136
  743    HG3  ARG  98           1HG      ARG  98   3.851  26.924  -8.063
  744    HD2  ARG  98           2HD      ARG  98   3.614  28.447  -6.131
  745    HD3  ARG  98           1HD      ARG  98   4.081  26.813  -5.662
  746    HE   ARG  98           HE       ARG  98   6.255  28.716  -5.996
  747   HH11  ARG  98          1HH1      ARG  98   4.083  27.069  -3.794
  748   HH12  ARG  98          2HH1      ARG  98   5.020  27.457  -2.381
  749   HH21  ARG  98          1HH2      ARG  98   7.520  29.154  -4.168
  750   HH22  ARG  98          2HH2      ARG  98   6.997  28.617  -2.592
  751    H    GLN  99           HN       GLN  99   3.332  25.096  -6.243
  752    HA   GLN  99           HA       GLN  99   2.077  22.984  -7.472
  753    HB2  GLN  99           2HB      GLN  99   0.978  24.142  -5.717
  754    HB3  GLN  99           1HB      GLN  99   1.055  25.670  -6.578
  755    HG2  GLN  99           2HG      GLN  99  -0.577  24.941  -8.152
  756    HG3  GLN  99           1HG      GLN  99  -0.561  23.310  -7.484
  757   HE21  GLN  99          1HE2      GLN  99  -0.423  24.190  -4.736
  758   HE22  GLN  99          2HE2      GLN  99  -1.986  24.818  -4.332
  759    H    THR 100           HN       THR 100   1.408  22.525  -9.447
  760    HA   THR 100           HA       THR 100   1.972  24.441 -11.565
  761    HB   THR 100           HB       THR 100   1.617  22.453 -13.070
  762    HG1  THR 100           1HG      THR 100   1.268  21.192 -10.539
  763   HG21  THR 100          3HG2      THR 100   3.660  22.135 -10.866
  764   HG22  THR 100          1HG2      THR 100   3.855  23.104 -12.327
  765   HG23  THR 100          2HG2      THR 100   3.715  21.349 -12.442
  766    H    VAL 101           HN       VAL 101   0.291  23.521 -13.563
  767    HA   VAL 101           HA       VAL 101  -2.023  25.054 -13.138
  768    HB   VAL 101           HB       VAL 101  -1.622  22.914 -15.233
  769   HG11  VAL 101          1HG1      VAL 101  -3.201  24.233 -16.556
  770   HG12  VAL 101          2HG1      VAL 101  -3.404  25.347 -15.203
  771   HG13  VAL 101          3HG1      VAL 101  -3.926  23.669 -15.051
  772   HG21  VAL 101          3HG2      VAL 101  -0.849  25.827 -15.270
  773   HG22  VAL 101          1HG2      VAL 101  -0.828  24.759 -16.673
  774   HG23  VAL 101          2HG2      VAL 101   0.241  24.440 -15.308
  775    H    SER 102           HN       SER 102  -3.996  24.578 -12.359
  776    HA   SER 102           HA       SER 102  -4.360  21.996 -11.114
  777    HB2  SER 102           2HB      SER 102  -6.163  24.428 -11.140
  778    HB3  SER 102           1HB      SER 102  -6.360  23.009 -10.113
  779    HG   SER 102           HG       SER 102  -4.126  24.777 -10.104
  780    H    VAL 103           HN       VAL 103  -4.532  20.715 -13.024
  781    HA   VAL 103           HA       VAL 103  -7.172  20.940 -14.303
  782    HB   VAL 103           HB       VAL 103  -5.505  21.296 -15.981
  783   HG11  VAL 103          1HG1      VAL 103  -4.219  18.704 -15.130
  784   HG12  VAL 103          2HG1      VAL 103  -3.585  20.320 -14.820
  785   HG13  VAL 103          3HG1      VAL 103  -3.714  19.727 -16.475
  786   HG21  VAL 103          3HG2      VAL 103  -5.945  19.440 -17.525
  787   HG22  VAL 103          1HG2      VAL 103  -7.402  19.944 -16.668
  788   HG23  VAL 103          2HG2      VAL 103  -6.556  18.475 -16.180
  789    HA   PRO 104           HA       PRO 104  -7.616  17.044 -12.120
  790    HB2  PRO 104           2HB      PRO 104 -10.448  17.386 -12.258
  791    HB3  PRO 104           1HB      PRO 104  -9.398  17.624 -10.861
  792    HG2  PRO 104           2HG      PRO 104 -10.775  19.634 -12.174
  793    HG3  PRO 104           1HG      PRO 104  -9.362  19.878 -11.135
  794    HD2  PRO 104           2HD      PRO 104  -9.532  19.775 -14.117
  795    HD3  PRO 104           1HD      PRO 104  -8.512  20.794 -13.075
  796    H    VAL 105           HN       VAL 105  -6.971  15.693 -13.800
  797    HA   VAL 105           HA       VAL 105  -9.200  14.660 -15.398
  798    HB   VAL 105           HB       VAL 105  -7.939  15.996 -16.950
  799   HG11  VAL 105          1HG1      VAL 105  -5.497  14.462 -16.069
  800   HG12  VAL 105          2HG1      VAL 105  -5.832  16.168 -15.762
  801   HG13  VAL 105          3HG1      VAL 105  -5.560  15.604 -17.411
  802   HG21  VAL 105          3HG2      VAL 105  -7.221  14.284 -18.581
  803   HG22  VAL 105          1HG2      VAL 105  -8.785  13.927 -17.851
  804   HG23  VAL 105          2HG2      VAL 105  -7.346  13.062 -17.318
  805    H    THR 106           HN       THR 106  -9.541  12.641 -14.798
  806    HA   THR 106           HA       THR 106  -7.304  11.077 -13.722
  807    HB   THR 106           HB       THR 106 -10.236  10.397 -13.588
  808    HG1  THR 106           1HG      THR 106 -10.096  12.252 -12.405
  809   HG21  THR 106          3HG2      THR 106  -8.731   8.518 -13.205
  810   HG22  THR 106          1HG2      THR 106  -9.528   8.980 -11.703
  811   HG23  THR 106          2HG2      THR 106  -7.854   9.449 -11.993
  812    H    VAL 107           HN       VAL 107  -6.355  10.438 -15.618
  813    HA   VAL 107           HA       VAL 107  -7.938   8.929 -17.539
  814    HB   VAL 107           HB       VAL 107  -5.710   8.773 -18.791
  815   HG11  VAL 107          1HG1      VAL 107  -7.496  10.299 -19.441
  816   HG12  VAL 107          2HG1      VAL 107  -5.922  11.068 -19.649
  817   HG13  VAL 107          3HG1      VAL 107  -6.930  11.484 -18.265
  818   HG21  VAL 107          3HG2      VAL 107  -4.949  10.908 -16.800
  819   HG22  VAL 107          1HG2      VAL 107  -4.019  10.431 -18.219
  820   HG23  VAL 107          2HG2      VAL 107  -4.246   9.294 -16.891
  821    H    GLU 108           HN       GLU 108  -8.438   7.075 -16.446
  822    HA   GLU 108           HA       GLU 108  -6.185   5.383 -15.619
  823    HB2  GLU 108           2HB      GLU 108  -8.074   5.992 -13.980
  824    HB3  GLU 108           1HB      GLU 108  -9.080   4.910 -14.926
  825    HG2  GLU 108           2HG      GLU 108  -6.485   3.960 -13.789
  826    HG3  GLU 108           1HG      GLU 108  -7.933   4.033 -12.791
  827    H    MET 109           HN       MET 109  -5.610   4.516 -17.549
  828    HA   MET 109           HA       MET 109  -7.188   2.353 -18.513
  829    HB2  MET 109           2HB      MET 109  -7.263   3.163 -20.900
  830    HB3  MET 109           1HB      MET 109  -8.365   3.975 -19.799
  831    HG2  MET 109           2HG      MET 109  -6.869   5.878 -19.669
  832    HG3  MET 109           1HG      MET 109  -5.706   5.058 -20.707
  833    HE1  MET 109           3HE      MET 109  -7.110   7.940 -22.981
  834    HE2  MET 109           1HE      MET 109  -5.668   7.224 -22.262
  835    HE3  MET 109           2HE      MET 109  -6.865   8.008 -21.235
  836    H    ILE 110           HN       ILE 110  -5.328   1.247 -17.879
  837    HA   ILE 110           HA       ILE 110  -3.030   1.629 -19.672
  838    HB   ILE 110           HB       ILE 110  -2.308   2.160 -17.471
  839   HG12  ILE 110          2HG1      ILE 110  -1.438  -0.672 -18.074
  840   HG13  ILE 110          1HG1      ILE 110  -0.777   0.775 -18.826
  841   HG21  ILE 110          1HG2      ILE 110  -3.531  -0.443 -16.572
  842   HG22  ILE 110          2HG2      ILE 110  -4.074   1.185 -16.159
  843   HG23  ILE 110          3HG2      ILE 110  -2.518   0.598 -15.569
  844   HD11  ILE 110          3HD1      ILE 110   0.039   1.526 -16.652
  845   HD12  ILE 110          1HD1      ILE 110   0.686  -0.058 -17.083
  846   HD13  ILE 110          2HD1      ILE 110  -0.623   0.071 -15.906
  847    H    ASN 111           HN       ASN 111  -3.238   0.196 -21.233
  848    HA   ASN 111           HA       ASN 111  -3.566  -2.629 -20.476
  849    HB2  ASN 111           2HB      ASN 111  -5.685  -1.811 -21.437
  850    HB3  ASN 111           1HB      ASN 111  -4.821  -1.275 -22.877
  851   HD21  ASN 111          1HD2      ASN 111  -6.126  -3.965 -21.147
  852   HD22  ASN 111          2HD2      ASN 111  -5.883  -5.148 -22.392
  853    H    LEU 112           HN       LEU 112  -1.652  -3.514 -20.880
  854    HA   LEU 112           HA       LEU 112  -0.124  -2.609 -23.212
  855    HB2  LEU 112           2HB      LEU 112   1.822  -3.578 -22.192
  856    HB3  LEU 112           1HB      LEU 112   1.021  -2.563 -21.013
  857    HG   LEU 112           HG       LEU 112   0.669  -5.558 -21.067
  858   HD11  LEU 112          1HD1      LEU 112   3.046  -5.049 -20.808
  859   HD12  LEU 112          2HD1      LEU 112   2.357  -5.672 -19.308
  860   HD13  LEU 112          3HD1      LEU 112   2.667  -3.944 -19.485
  861   HD21  LEU 112          3HD2      LEU 112   0.231  -3.482 -18.921
  862   HD22  LEU 112          1HD2      LEU 112   0.018  -5.224 -18.727
  863   HD23  LEU 112          2HD2      LEU 112  -1.026  -4.324 -19.828
  864    H    GLU 113           HN       GLU 113   0.706  -4.107 -24.718
  865    HA   GLU 113           HA       GLU 113  -0.671  -6.714 -24.674
  866    HB2  GLU 113           2HB      GLU 113  -0.567  -6.726 -27.099
  867    HB3  GLU 113           1HB      GLU 113  -1.354  -5.255 -26.547
  868    HG2  GLU 113           2HG      GLU 113   0.591  -3.955 -27.002
  869    HG3  GLU 113           1HG      GLU 113   1.546  -5.399 -27.332
  870    H    HIS 114           HN       HIS 114   0.506  -8.566 -25.048
  871    HA   HIS 114           HA       HIS 114   3.222  -8.519 -25.900
  872    HB2  HIS 114           2HB      HIS 114   2.988  -7.839 -23.279
  873    HB3  HIS 114           1HB      HIS 114   3.115  -9.589 -23.146
  874    HD1  HIS 114           1HD      HIS 114   5.455  -9.505 -22.104
  875    HD2  HIS 114           2HD      HIS 114   5.210  -7.671 -25.830
  876    HE1  HIS 114           1HE      HIS 114   7.829  -9.088 -22.813
  877    HE2  HIS 114           2HE      HIS 114   7.645  -7.783 -24.959
  878    H    HIS 115           HN       HIS 115   2.022  -9.948 -27.314
  879    HA   HIS 115           HA       HIS 115   1.604 -12.640 -26.166
  880    HB2  HIS 115           2HB      HIS 115  -0.477 -11.630 -26.968
  881    HB3  HIS 115           1HB      HIS 115   0.254 -11.317 -28.534
  882    HD1  HIS 115           1HD      HIS 115  -0.115 -13.039 -30.272
  883    HD2  HIS 115           2HD      HIS 115  -0.769 -14.519 -26.432
  884    HE1  HIS 115           1HE      HIS 115  -1.014 -15.370 -30.581
  885    HE2  HIS 115           2HE      HIS 115  -1.354 -16.272 -28.254
  886    H    HIS 116           HN       HIS 116   3.180 -13.996 -26.714
  887    HA   HIS 116           HA       HIS 116   4.160 -14.098 -29.430
  888    HB2  HIS 116           2HB      HIS 116   6.563 -13.876 -28.708
  889    HB3  HIS 116           1HB      HIS 116   5.628 -12.388 -28.682
  890    HD1  HIS 116           1HD      HIS 116   5.495 -11.149 -26.523
  891    HD2  HIS 116           2HD      HIS 116   7.134 -14.944 -26.084
  892    HE1  HIS 116           1HE      HIS 116   6.325 -11.261 -24.149
  893    HE2  HIS 116           2HE      HIS 116   7.199 -13.608 -23.866
  894    H    HIS 117           HN       HIS 117   4.644 -16.061 -30.007
  895    HA   HIS 117           HA       HIS 117   6.071 -17.947 -28.496
  896    HB2  HIS 117           2HB      HIS 117   4.002 -18.172 -27.184
  897    HB3  HIS 117           1HB      HIS 117   3.083 -18.472 -28.654
  898    HD1  HIS 117           1HD      HIS 117   2.947 -20.842 -29.460
  899    HD2  HIS 117           2HD      HIS 117   5.841 -20.311 -26.515
  900    HE1  HIS 117           1HE      HIS 117   3.720 -23.154 -28.837
  901    HE2  HIS 117           2HE      HIS 117   5.637 -22.789 -27.245
  902    H    HIS 118           HN       HIS 118   7.170 -18.829 -30.123
  903    HA   HIS 118           HA       HIS 118   5.672 -19.899 -32.382
  904    HB2  HIS 118           2HB      HIS 118   7.437 -18.973 -33.968
  905    HB3  HIS 118           1HB      HIS 118   6.242 -17.840 -33.362
  906    HD1  HIS 118           1HD      HIS 118   9.869 -18.421 -33.570
  907    HD2  HIS 118           2HD      HIS 118   7.268 -16.021 -31.380
  908    HE1  HIS 118           1HE      HIS 118  11.294 -16.616 -32.558
  909    HE2  HIS 118           2HE      HIS 118   9.675 -15.078 -31.386
  910    H    HIS 119           HN       HIS 119   6.090 -21.902 -31.630
  911    HA   HIS 119           HA       HIS 119   8.481 -23.104 -32.561
  912    HB2  HIS 119           2HB      HIS 119   9.314 -22.211 -30.376
  913    HB3  HIS 119           1HB      HIS 119   8.072 -23.149 -29.555
  914    HD1  HIS 119           1HD      HIS 119  11.470 -23.373 -30.915
  915    HD2  HIS 119           2HD      HIS 119   8.466 -26.017 -29.771
  916    HE1  HIS 119           1HE      HIS 119  12.586 -25.623 -30.688
  917    HE2  HIS 119           2HE      HIS 119  10.750 -27.209 -29.999
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1  -4.299 -35.020   7.014
    2    H2   MET   1           H2       MET   1  -3.191 -35.735   8.074
    3    H3   MET   1           H3       MET   1  -4.376 -36.686   7.328
    4    HA   MET   1           HA       MET   1  -2.268 -37.040   6.254
    5    HB2  MET   1           2HB      MET   1  -4.230 -35.404   4.630
    6    HB3  MET   1           1HB      MET   1  -2.895 -36.299   3.928
    7    HG2  MET   1           2HG      MET   1  -4.855 -37.596   3.657
    8    HG3  MET   1           1HG      MET   1  -3.871 -38.376   4.892
    9    HE1  MET   1           2HE      MET   1  -6.974 -38.950   4.300
   10    HE2  MET   1           3HE      MET   1  -7.605 -39.084   5.939
   11    HE3  MET   1           1HE      MET   1  -6.057 -39.824   5.529
   12    HA   PRO   2           HA       PRO   2   0.714 -33.726   6.018
   13    HB2  PRO   2           2HB      PRO   2   1.421 -34.775   3.332
   14    HB3  PRO   2           1HB      PRO   2   2.452 -34.521   4.744
   15    HG2  PRO   2           2HG      PRO   2   1.725 -36.976   3.999
   16    HG3  PRO   2           1HG      PRO   2   1.847 -36.536   5.713
   17    HD2  PRO   2           2HD      PRO   2  -0.586 -36.848   4.000
   18    HD3  PRO   2           1HD      PRO   2  -0.335 -37.298   5.700
   19    H    THR   3           HN       THR   3   0.043 -31.706   5.614
   20    HA   THR   3           HA       THR   3  -1.086 -31.097   2.971
   21    HB   THR   3           HB       THR   3  -2.201 -29.907   5.481
   22    HG1  THR   3           1HG      THR   3  -2.417 -32.356   5.169
   23   HG21  THR   3          3HG2      THR   3  -4.116 -29.388   4.072
   24   HG22  THR   3          1HG2      THR   3  -3.347 -30.204   2.710
   25   HG23  THR   3          2HG2      THR   3  -2.636 -28.730   3.371
   26    H    PHE   4           HN       PHE   4  -0.784 -28.942   2.274
   27    HA   PHE   4           HA       PHE   4   1.466 -27.604   3.498
   28    HB2  PHE   4           2HB      PHE   4   1.350 -26.180   1.458
   29    HB3  PHE   4           1HB      PHE   4   1.559 -27.885   1.106
   30    HD1  PHE   4           1HD      PHE   4  -0.379 -29.202   0.259
   31    HD2  PHE   4           2HD      PHE   4  -0.528 -24.971   0.687
   32    HE1  PHE   4           1HE      PHE   4  -2.333 -29.122  -1.237
   33    HE2  PHE   4           2HE      PHE   4  -2.482 -24.884  -0.801
   34    HZ   PHE   4           HZ       PHE   4  -3.389 -26.960  -1.766
   35    H    ASP   5           HN       ASP   5   1.393 -25.638   4.460
   36    HA   ASP   5           HA       ASP   5  -1.273 -24.546   5.007
   37    HB2  ASP   5           2HB      ASP   5   0.322 -25.169   6.911
   38    HB3  ASP   5           1HB      ASP   5   1.309 -23.807   6.396
   39    H    HIS   6           HN       HIS   6  -1.215 -23.725   2.789
   40    HA   HIS   6           HA       HIS   6   0.322 -21.225   2.593
   41    HB2  HIS   6           2HB      HIS   6   1.324 -23.125   1.266
   42    HB3  HIS   6           1HB      HIS   6  -0.139 -23.120   0.290
   43    HD1  HIS   6           1HD      HIS   6   0.063 -21.814  -1.792
   44    HD2  HIS   6           2HD      HIS   6   2.585 -20.386   1.200
   45    HE1  HIS   6           1HE      HIS   6   1.374 -19.938  -2.839
   46    HE2  HIS   6           2HE      HIS   6   2.814 -19.014  -0.985
   47    H    GLY   7           HN       GLY   7  -0.868 -19.501   2.144
   48    HA2  GLY   7           2HA      GLY   7  -3.205 -19.728   0.420
   49    HA3  GLY   7           1HA      GLY   7  -3.520 -19.218   2.072
   50    H    ASN   8           HN       ASN   8  -4.362 -17.369   0.603
   51    HA   ASN   8           HA       ASN   8  -2.225 -15.342   0.464
   52    HB2  ASN   8           2HB      ASN   8  -4.422 -15.864  -1.528
   53    HB3  ASN   8           1HB      ASN   8  -3.620 -14.304  -1.423
   54   HD21  ASN   8          1HD2      ASN   8  -1.575 -14.061  -2.198
   55   HD22  ASN   8          2HD2      ASN   8  -0.757 -15.297  -3.093
   56    H    LEU   9           HN       LEU   9  -3.067 -13.127   0.548
   57    HA   LEU   9           HA       LEU   9  -5.683 -12.751   1.727
   58    HB2  LEU   9           2HB      LEU   9  -4.406 -13.326   3.697
   59    HB3  LEU   9           1HB      LEU   9  -3.136 -12.202   3.253
   60    HG   LEU   9           HG       LEU   9  -4.733 -10.328   3.581
   61   HD11  LEU   9          1HD1      LEU   9  -6.816 -10.771   4.803
   62   HD12  LEU   9          2HD1      LEU   9  -6.537 -12.504   4.623
   63   HD13  LEU   9          3HD1      LEU   9  -6.811 -11.502   3.198
   64   HD21  LEU   9          3HD2      LEU   9  -3.187 -10.940   5.343
   65   HD22  LEU   9          1HD2      LEU   9  -4.311 -12.159   5.940
   66   HD23  LEU   9          2HD2      LEU   9  -4.730 -10.450   6.038
   67    H    SER  10           HN       SER  10  -6.470 -10.964   0.826
   68    HA   SER  10           HA       SER  10  -4.600  -9.037  -0.312
   69    HB2  SER  10           2HB      SER  10  -6.836  -8.154  -1.329
   70    HB3  SER  10           1HB      SER  10  -6.132  -9.644  -1.955
   71    HG   SER  10           HG       SER  10  -7.852 -10.662  -1.337
   72    H    LEU  11           HN       LEU  11  -4.043  -7.395   0.925
   73    HA   LEU  11           HA       LEU  11  -5.469  -6.530   3.208
   74    HB2  LEU  11           2HB      LEU  11  -3.379  -5.066   1.590
   75    HB3  LEU  11           1HB      LEU  11  -3.930  -4.599   3.184
   76    HG   LEU  11           HG       LEU  11  -2.481  -7.167   2.541
   77   HD11  LEU  11          1HD1      LEU  11  -0.615  -6.143   3.764
   78   HD12  LEU  11          2HD1      LEU  11  -1.522  -4.634   3.856
   79   HD13  LEU  11          3HD1      LEU  11  -1.013  -5.264   2.289
   80   HD21  LEU  11          3HD2      LEU  11  -2.300  -7.406   4.964
   81   HD22  LEU  11          1HD2      LEU  11  -3.986  -7.390   4.447
   82   HD23  LEU  11          2HD2      LEU  11  -3.275  -5.954   5.183
   83    H    GLY  12           HN       GLY  12  -5.353  -5.447  -0.126
   84    HA2  GLY  12           2HA      GLY  12  -7.539  -4.670  -0.983
   85    HA3  GLY  12           1HA      GLY  12  -7.630  -3.664   0.457
   86    H    GLU  13           HN       GLU  13  -7.881  -1.845  -0.877
   87    HA   GLU  13           HA       GLU  13  -5.616  -1.039  -2.516
   88    HB2  GLU  13           2HB      GLU  13  -7.087   0.938  -3.027
   89    HB3  GLU  13           1HB      GLU  13  -7.751  -0.617  -3.504
   90    HG2  GLU  13           2HG      GLU  13  -9.066  -0.606  -1.372
   91    HG3  GLU  13           1HG      GLU  13  -8.518   1.049  -1.125
   92    H    LEU  14           HN       LEU  14  -4.075   0.302  -1.825
   93    HA   LEU  14           HA       LEU  14  -4.564   1.802   0.665
   94    HB2  LEU  14           2HB      LEU  14  -2.056   0.343  -0.170
   95    HB3  LEU  14           1HB      LEU  14  -2.151   1.435   1.199
   96    HG   LEU  14           HG       LEU  14  -3.764  -1.098   0.924
   97   HD11  LEU  14          1HD1      LEU  14  -1.295  -0.559   2.571
   98   HD12  LEU  14          2HD1      LEU  14  -1.370  -1.568   1.127
   99   HD13  LEU  14          3HD1      LEU  14  -2.254  -2.040   2.576
  100   HD21  LEU  14          3HD2      LEU  14  -3.332   0.743   3.272
  101   HD22  LEU  14          1HD2      LEU  14  -4.279  -0.745   3.273
  102   HD23  LEU  14          2HD2      LEU  14  -4.804   0.635   2.309
  103    H    GLU  15           HN       GLU  15  -4.034   3.886   0.648
  104    HA   GLU  15           HA       GLU  15  -3.077   5.116  -1.762
  105    HB2  GLU  15           2HB      GLU  15  -3.687   6.240   0.974
  106    HB3  GLU  15           1HB      GLU  15  -3.165   7.223  -0.387
  107    HG2  GLU  15           2HG      GLU  15  -5.137   6.561  -1.641
  108    HG3  GLU  15           1HG      GLU  15  -5.650   5.531  -0.304
  109    H    LEU  16           HN       LEU  16  -1.067   5.734  -2.253
  110    HA   LEU  16           HA       LEU  16   1.058   4.884  -0.469
  111    HB2  LEU  16           2HB      LEU  16   1.138   4.262  -2.832
  112    HB3  LEU  16           1HB      LEU  16   1.114   5.950  -3.295
  113    HG   LEU  16           HG       LEU  16   3.349   5.002  -1.557
  114   HD11  LEU  16          1HD1      LEU  16   4.613   4.280  -3.512
  115   HD12  LEU  16          2HD1      LEU  16   3.196   4.527  -4.534
  116   HD13  LEU  16          3HD1      LEU  16   3.179   3.279  -3.287
  117   HD21  LEU  16          3HD2      LEU  16   3.186   6.942  -3.865
  118   HD22  LEU  16          1HD2      LEU  16   4.589   6.662  -2.835
  119   HD23  LEU  16          2HD2      LEU  16   3.127   7.373  -2.156
  120    H    THR  17           HN       THR  17   2.353   6.192   0.670
  121    HA   THR  17           HA       THR  17   1.889   9.088   0.421
  122    HB   THR  17           HB       THR  17   3.078   7.644   2.798
  123    HG1  THR  17           1HG      THR  17   0.620   7.437   1.966
  124   HG21  THR  17          3HG2      THR  17   3.563  10.042   2.669
  125   HG22  THR  17          1HG2      THR  17   2.458   9.692   4.000
  126   HG23  THR  17          2HG2      THR  17   1.841  10.388   2.499
  127    H    VAL  18           HN       VAL  18   3.596  10.461   0.079
  128    HA   VAL  18           HA       VAL  18   6.160   9.150  -0.539
  129    HB   VAL  18           HB       VAL  18   5.070  11.790  -1.541
  130   HG11  VAL  18          1HG1      VAL  18   7.495  11.825  -1.404
  131   HG12  VAL  18          2HG1      VAL  18   6.974  11.756  -3.088
  132   HG13  VAL  18          3HG1      VAL  18   7.585  10.305  -2.292
  133   HG21  VAL  18          3HG2      VAL  18   5.392   9.144  -2.955
  134   HG22  VAL  18          1HG2      VAL  18   4.862  10.655  -3.696
  135   HG23  VAL  18          2HG2      VAL  18   3.866   9.882  -2.463
  136    H    LEU  19           HN       LEU  19   7.846   9.545   0.705
  137    HA   LEU  19           HA       LEU  19   7.778  11.884   2.489
  138    HB2  LEU  19           2HB      LEU  19   9.404   9.341   2.702
  139    HB3  LEU  19           1HB      LEU  19   9.450  10.673   3.839
  140    HG   LEU  19           HG       LEU  19   7.080   8.887   3.299
  141   HD11  LEU  19          1HD1      LEU  19   8.845   7.776   4.540
  142   HD12  LEU  19          2HD1      LEU  19   7.468   8.114   5.589
  143   HD13  LEU  19          3HD1      LEU  19   8.914   9.121   5.678
  144   HD21  LEU  19          3HD2      LEU  19   6.014  10.059   5.154
  145   HD22  LEU  19          1HD2      LEU  19   6.389  11.167   3.834
  146   HD23  LEU  19          2HD2      LEU  19   7.405  11.140   5.276
  147    H    TYR  20           HN       TYR  20   9.001  13.522   1.886
  148    HA   TYR  20           HA       TYR  20  11.628  13.019   0.739
  149    HB2  TYR  20           2HB      TYR  20  11.279  14.633  -1.090
  150    HB3  TYR  20           1HB      TYR  20  10.205  13.248  -1.233
  151    HD1  TYR  20           1HD      TYR  20   7.790  13.506  -0.778
  152    HD2  TYR  20           2HD      TYR  20  10.421  16.846  -0.746
  153    HE1  TYR  20           1HE      TYR  20   5.861  15.021  -0.956
  154    HE2  TYR  20           2HE      TYR  20   8.501  18.371  -0.918
  155    HH   TYR  20           HH       TYR  20   6.181  18.330  -1.693
  156    H    ASP  21           HN       ASP  21  13.064  14.782   0.941
  157    HA   ASP  21           HA       ASP  21  12.226  16.729   2.978
  158    HB2  ASP  21           2HB      ASP  21  14.036  15.072   3.573
  159    HB3  ASP  21           1HB      ASP  21  15.042  15.818   2.337
  160    H    GLU  22           HN       GLU  22  11.690  17.031   0.249
  161    HA   GLU  22           HA       GLU  22  13.535  19.132  -0.613
  162    HB2  GLU  22           2HB      GLU  22  11.886  17.276  -2.318
  163    HB3  GLU  22           1HB      GLU  22  13.027  18.489  -2.892
  164    HG2  GLU  22           2HG      GLU  22  13.831  16.240  -1.092
  165    HG3  GLU  22           1HG      GLU  22  13.824  16.115  -2.832
  166    H    GLU  23           HN       GLU  23  12.098  20.254   0.809
  167    HA   GLU  23           HA       GLU  23   9.391  20.784   0.280
  168    HB2  GLU  23           2HB      GLU  23  11.423  22.553   1.647
  169    HB3  GLU  23           1HB      GLU  23   9.675  22.683   1.787
  170    HG2  GLU  23           2HG      GLU  23   9.559  20.520   2.854
  171    HG3  GLU  23           1HG      GLU  23  11.296  20.300   2.645
  172    H    ARG  24           HN       ARG  24  11.915  21.486  -1.672
  173    HA   ARG  24           HA       ARG  24  11.120  24.116  -2.564
  174    HB2  ARG  24           2HB      ARG  24  12.942  22.208  -4.020
  175    HB3  ARG  24           1HB      ARG  24  12.911  23.962  -4.106
  176    HG2  ARG  24           2HG      ARG  24  13.850  24.154  -1.917
  177    HG3  ARG  24           1HG      ARG  24  13.709  22.413  -1.652
  178    HD2  ARG  24           2HD      ARG  24  15.203  22.168  -3.715
  179    HD3  ARG  24           1HD      ARG  24  15.543  23.886  -3.520
  180    HE   ARG  24           HE       ARG  24  16.426  23.331  -1.289
  181   HH11  ARG  24          1HH1      ARG  24  16.112  20.765  -3.654
  182   HH12  ARG  24          2HH1      ARG  24  17.314  19.759  -2.912
  183   HH21  ARG  24          1HH2      ARG  24  18.014  22.017  -0.322
  184   HH22  ARG  24          2HH2      ARG  24  18.415  20.483  -1.037
  185    H    TYR  25           HN       TYR  25  10.238  20.871  -3.172
  186    HA   TYR  25           HA       TYR  25   9.021  21.614  -5.757
  187    HB2  TYR  25           2HB      TYR  25  10.065  18.867  -5.049
  188    HB3  TYR  25           1HB      TYR  25   9.512  19.427  -6.623
  189    HD1  TYR  25           1HD      TYR  25  10.896  21.149  -7.845
  190    HD2  TYR  25           2HD      TYR  25  12.302  19.128  -4.380
  191    HE1  TYR  25           1HE      TYR  25  13.201  21.775  -8.421
  192    HE2  TYR  25           2HE      TYR  25  14.611  19.748  -4.948
  193    HH   TYR  25           HH       TYR  25  15.913  20.391  -6.894
  194    H    ASP  26           HN       ASP  26   6.997  20.747  -6.226
  195    HA   ASP  26           HA       ASP  26   5.690  19.320  -4.013
  196    HB2  ASP  26           2HB      ASP  26   3.623  20.300  -4.560
  197    HB3  ASP  26           1HB      ASP  26   4.773  21.619  -4.676
  198    H    ILE  27           HN       ILE  27   3.940  17.836  -4.736
  199    HA   ILE  27           HA       ILE  27   5.105  16.100  -6.772
  200    HB   ILE  27           HB       ILE  27   2.813  15.529  -4.886
  201   HG12  ILE  27          2HG1      ILE  27   5.726  14.746  -4.647
  202   HG13  ILE  27          1HG1      ILE  27   4.953  16.025  -3.714
  203   HG21  ILE  27          1HG2      ILE  27   2.844  14.106  -6.873
  204   HG22  ILE  27          2HG2      ILE  27   3.255  13.187  -5.425
  205   HG23  ILE  27          3HG2      ILE  27   4.523  13.680  -6.548
  206   HD11  ILE  27          3HD1      ILE  27   4.285  13.086  -3.628
  207   HD12  ILE  27          1HD1      ILE  27   3.444  14.348  -2.725
  208   HD13  ILE  27          2HD1      ILE  27   5.142  14.009  -2.392
  209    H    VAL  28           HN       VAL  28   4.459  16.553  -8.787
  210    HA   VAL  28           HA       VAL  28   1.763  17.478  -9.325
  211    HB   VAL  28           HB       VAL  28   4.001  16.818 -11.252
  212   HG11  VAL  28          1HG1      VAL  28   1.380  18.244 -11.697
  213   HG12  VAL  28          2HG1      VAL  28   1.841  16.670 -12.343
  214   HG13  VAL  28          3HG1      VAL  28   2.687  18.124 -12.875
  215   HG21  VAL  28          3HG2      VAL  28   3.057  19.462 -10.152
  216   HG22  VAL  28          1HG2      VAL  28   4.275  19.251 -11.411
  217   HG23  VAL  28          2HG2      VAL  28   4.580  18.655  -9.779
  218    H    GLU  29           HN       GLU  29   3.711  14.592  -9.943
  219    HA   GLU  29           HA       GLU  29   1.241  13.106 -10.512
  220    HB2  GLU  29           2HB      GLU  29   3.149  13.778 -12.450
  221    HB3  GLU  29           1HB      GLU  29   3.509  12.110 -12.035
  222    HG2  GLU  29           2HG      GLU  29   0.778  13.083 -12.830
  223    HG3  GLU  29           1HG      GLU  29   1.955  12.420 -13.960
  224    H    GLN  30           HN       GLN  30   1.424  10.812 -10.067
  225    HA   GLN  30           HA       GLN  30   3.647   9.592  -8.877
  226    HB2  GLN  30           2HB      GLN  30   2.966   9.614  -6.497
  227    HB3  GLN  30           1HB      GLN  30   3.416  11.211  -7.078
  228    HG2  GLN  30           2HG      GLN  30   1.126  11.883  -7.213
  229    HG3  GLN  30           1HG      GLN  30   0.571  10.246  -6.868
  230   HE21  GLN  30          1HE2      GLN  30   0.073  12.800  -5.490
  231   HE22  GLN  30          2HE2      GLN  30   0.559  12.537  -3.850
  232    H    THR  31           HN       THR  31   3.069   7.557  -7.773
  233    HA   THR  31           HA       THR  31   0.695   6.319  -8.823
  234    HB   THR  31           HB       THR  31   2.565   5.191  -6.728
  235    HG1  THR  31           1HG      THR  31   2.810   5.188  -9.583
  236   HG21  THR  31          3HG2      THR  31   0.498   3.938  -7.086
  237   HG22  THR  31          1HG2      THR  31   1.882   3.038  -7.707
  238   HG23  THR  31          2HG2      THR  31   0.811   3.891  -8.820
  239    H    GLU  32           HN       GLU  32  -1.232   6.696  -7.923
  240    HA   GLU  32           HA       GLU  32  -1.404   7.998  -5.380
  241    HB2  GLU  32           2HB      GLU  32  -3.589   7.049  -7.234
  242    HB3  GLU  32           1HB      GLU  32  -3.815   8.112  -5.850
  243    HG2  GLU  32           2HG      GLU  32  -2.412   9.797  -6.889
  244    HG3  GLU  32           1HG      GLU  32  -2.121   8.733  -8.262
  245    H    THR  33           HN       THR  33  -2.845   4.957  -6.596
  246    HA   THR  33           HA       THR  33  -2.835   4.016  -3.815
  247    HB   THR  33           HB       THR  33  -4.948   2.739  -4.390
  248    HG1  THR  33           1HG      THR  33  -6.165   3.521  -6.137
  249   HG21  THR  33          3HG2      THR  33  -4.995   4.674  -2.921
  250   HG22  THR  33          1HG2      THR  33  -6.417   4.671  -3.964
  251   HG23  THR  33          2HG2      THR  33  -5.071   5.757  -4.311
  252    H    VAL  34           HN       VAL  34  -2.459   1.866  -3.476
  253    HA   VAL  34           HA       VAL  34  -1.662   0.269  -5.819
  254    HB   VAL  34           HB       VAL  34   0.234  -0.619  -4.596
  255   HG11  VAL  34          1HG1      VAL  34   1.625   1.398  -4.418
  256   HG12  VAL  34          2HG1      VAL  34   0.169   2.391  -4.499
  257   HG13  VAL  34          3HG1      VAL  34   0.634   1.393  -5.876
  258   HG21  VAL  34          3HG2      VAL  34  -0.719  -0.534  -2.338
  259   HG22  VAL  34          1HG2      VAL  34  -0.559   1.223  -2.340
  260   HG23  VAL  34          2HG2      VAL  34   0.882   0.205  -2.392
  261    H    GLN  35           HN       GLN  35  -1.819  -2.047  -5.492
  262    HA   GLN  35           HA       GLN  35  -3.645  -2.761  -3.300
  263    HB2  GLN  35           2HB      GLN  35  -4.434  -3.087  -5.706
  264    HB3  GLN  35           1HB      GLN  35  -3.227  -4.363  -5.822
  265    HG2  GLN  35           2HG      GLN  35  -4.307  -5.504  -3.917
  266    HG3  GLN  35           1HG      GLN  35  -5.550  -4.258  -3.912
  267   HE21  GLN  35          1HE2      GLN  35  -7.219  -5.617  -4.352
  268   HE22  GLN  35          2HE2      GLN  35  -7.416  -6.439  -5.862
  269    H    VAL  36           HN       VAL  36  -3.037  -4.271  -1.864
  270    HA   VAL  36           HA       VAL  36  -0.421  -5.579  -2.300
  271    HB   VAL  36           HB       VAL  36  -1.478  -4.669   0.380
  272   HG11  VAL  36          1HG1      VAL  36   1.253  -5.607  -0.494
  273   HG12  VAL  36          2HG1      VAL  36   0.096  -6.530   0.466
  274   HG13  VAL  36          3HG1      VAL  36   0.821  -5.062   1.127
  275   HG21  VAL  36          3HG2      VAL  36   0.197  -2.859   0.245
  276   HG22  VAL  36          1HG2      VAL  36  -1.065  -2.706  -0.977
  277   HG23  VAL  36          2HG2      VAL  36   0.525  -3.317  -1.426
  278    H    ASP  37           HN       ASP  37  -0.307  -7.661  -2.000
  279    HA   ASP  37           HA       ASP  37  -2.437  -9.078  -0.537
  280    HB2  ASP  37           2HB      ASP  37  -2.875  -9.650  -2.791
  281    HB3  ASP  37           1HB      ASP  37  -1.165  -9.727  -3.195
  282    H    LEU  38           HN       LEU  38  -1.723 -10.756   0.776
  283    HA   LEU  38           HA       LEU  38   1.205 -11.004   1.009
  284    HB2  LEU  38           2HB      LEU  38  -0.904 -11.342   3.149
  285    HB3  LEU  38           1HB      LEU  38   0.812 -11.621   3.375
  286    HG   LEU  38           HG       LEU  38  -0.456  -8.960   2.718
  287   HD11  LEU  38          1HD1      LEU  38   0.784  -9.968   5.274
  288   HD12  LEU  38          2HD1      LEU  38  -0.940  -9.726   4.991
  289   HD13  LEU  38          3HD1      LEU  38   0.155  -8.345   4.989
  290   HD21  LEU  38          3HD2      LEU  38   1.777  -9.178   1.772
  291   HD22  LEU  38          1HD2      LEU  38   2.405  -9.679   3.342
  292   HD23  LEU  38          2HD2      LEU  38   1.770  -8.048   3.125
  293    H    GLU  39           HN       GLU  39   2.019 -12.921   0.555
  294    HA   GLU  39           HA       GLU  39   0.174 -15.212   0.418
  295    HB2  GLU  39           2HB      GLU  39   0.865 -14.403  -1.799
  296    HB3  GLU  39           1HB      GLU  39   2.549 -14.581  -1.345
  297    HG2  GLU  39           2HG      GLU  39   1.136 -17.047  -0.949
  298    HG3  GLU  39           1HG      GLU  39   0.917 -16.456  -2.596
  299    H    GLY  40           HN       GLY  40   0.785 -17.078   1.398
  300    HA2  GLY  40           2HA      GLY  40   3.164 -18.207   1.877
  301    HA3  GLY  40           1HA      GLY  40   3.138 -16.938   3.096
  302    HA   PRO  41           HA       PRO  41   1.297 -20.638   5.160
  303    HB2  PRO  41           2HB      PRO  41   1.999 -19.601   7.643
  304    HB3  PRO  41           1HB      PRO  41   2.941 -20.773   6.717
  305    HG2  PRO  41           2HG      PRO  41   3.280 -17.820   6.943
  306    HG3  PRO  41           1HG      PRO  41   4.514 -19.089   6.837
  307    HD2  PRO  41           2HD      PRO  41   3.895 -17.546   4.730
  308    HD3  PRO  41           1HD      PRO  41   4.322 -19.258   4.535
  309    H    ARG  42           HN       ARG  42  -0.832 -20.516   5.307
  310    HA   ARG  42           HA       ARG  42  -2.253 -18.116   5.621
  311    HB2  ARG  42           2HB      ARG  42  -4.275 -19.582   5.877
  312    HB3  ARG  42           1HB      ARG  42  -3.335 -19.841   4.421
  313    HG2  ARG  42           2HG      ARG  42  -3.870 -21.978   5.095
  314    HG3  ARG  42           1HG      ARG  42  -2.240 -21.771   5.729
  315    HD2  ARG  42           2HD      ARG  42  -3.711 -22.836   7.365
  316    HD3  ARG  42           1HD      ARG  42  -3.141 -21.266   7.931
  317    HE   ARG  42           HE       ARG  42  -5.679 -21.090   6.615
  318   HH11  ARG  42          1HH1      ARG  42  -4.157 -21.986   9.635
  319   HH12  ARG  42          2HH1      ARG  42  -5.536 -21.578  10.606
  320   HH21  ARG  42          1HH2      ARG  42  -7.495 -20.545   7.876
  321   HH22  ARG  42          2HH2      ARG  42  -7.438 -20.745   9.607
  322    H    GLY  43           HN       GLY  43  -1.097 -20.447   7.923
  323    HA2  GLY  43           2HA      GLY  43  -2.613 -19.776  10.171
  324    HA3  GLY  43           1HA      GLY  43  -0.940 -20.314  10.215
  325    H    VAL  44           HN       VAL  44   0.423 -18.298   9.043
  326    HA   VAL  44           HA       VAL  44   0.573 -16.313  11.041
  327    HB   VAL  44           HB       VAL  44   1.680 -16.208   8.224
  328   HG11  VAL  44          1HG1      VAL  44   3.294 -14.595   9.149
  329   HG12  VAL  44          2HG1      VAL  44   2.428 -14.630  10.686
  330   HG13  VAL  44          3HG1      VAL  44   1.633 -14.007   9.239
  331   HG21  VAL  44          3HG2      VAL  44   2.498 -18.163   9.410
  332   HG22  VAL  44          1HG2      VAL  44   2.965 -17.159  10.784
  333   HG23  VAL  44          2HG2      VAL  44   3.787 -16.971   9.233
  334    H    LEU  45           HN       LEU  45  -0.834 -16.336   7.804
  335    HA   LEU  45           HA       LEU  45  -1.557 -13.647   7.615
  336    HB2  LEU  45           2HB      LEU  45  -2.950 -16.067   6.465
  337    HB3  LEU  45           1HB      LEU  45  -3.229 -14.411   5.962
  338    HG   LEU  45           HG       LEU  45  -0.598 -15.871   5.698
  339   HD11  LEU  45          1HD1      LEU  45  -2.684 -15.206   3.629
  340   HD12  LEU  45          2HD1      LEU  45  -2.278 -16.816   4.222
  341   HD13  LEU  45          3HD1      LEU  45  -1.094 -15.891   3.300
  342   HD21  LEU  45          3HD2      LEU  45   0.001 -13.956   4.253
  343   HD22  LEU  45          1HD2      LEU  45  -0.272 -13.488   5.934
  344   HD23  LEU  45          2HD2      LEU  45  -1.507 -13.169   4.717
  345    H    THR  46           HN       THR  46  -3.265 -16.376   9.066
  346    HA   THR  46           HA       THR  46  -5.691 -15.014   9.566
  347    HB   THR  46           HB       THR  46  -4.535 -17.377  11.064
  348    HG1  THR  46           1HG      THR  46  -4.691 -17.854   8.859
  349   HG21  THR  46          3HG2      THR  46  -7.381 -16.409  10.756
  350   HG22  THR  46          1HG2      THR  46  -6.420 -16.359  12.233
  351   HG23  THR  46          2HG2      THR  46  -6.893 -17.911  11.541
  352    H    VAL  47           HN       VAL  47  -2.738 -15.447  11.474
  353    HA   VAL  47           HA       VAL  47  -3.698 -14.217  13.836
  354    HB   VAL  47           HB       VAL  47  -0.835 -14.342  12.856
  355   HG11  VAL  47          1HG1      VAL  47  -1.145 -12.732  14.654
  356   HG12  VAL  47          2HG1      VAL  47  -0.251 -14.140  15.230
  357   HG13  VAL  47          3HG1      VAL  47  -1.960 -13.956  15.628
  358   HG21  VAL  47          3HG2      VAL  47  -2.398 -16.274  14.569
  359   HG22  VAL  47          1HG2      VAL  47  -0.663 -16.359  14.262
  360   HG23  VAL  47          2HG2      VAL  47  -1.804 -16.565  12.934
  361    H    PHE  48           HN       PHE  48  -2.059 -12.980  10.973
  362    HA   PHE  48           HA       PHE  48  -1.790 -10.306  11.887
  363    HB2  PHE  48           2HB      PHE  48  -0.463 -11.288  10.024
  364    HB3  PHE  48           1HB      PHE  48  -1.922 -11.329   9.040
  365    HD1  PHE  48           2HD      PHE  48   0.369  -9.044  10.835
  366    HD2  PHE  48           1HD      PHE  48  -2.581  -9.456   7.799
  367    HE1  PHE  48           2HE      PHE  48   0.824  -6.743  10.085
  368    HE2  PHE  48           1HE      PHE  48  -2.131  -7.162   7.043
  369    HZ   PHE  48           HZ       PHE  48  -0.424  -5.800   8.181
  370    H    ARG  49           HN       ARG  49  -4.362 -12.115  10.421
  371    HA   ARG  49           HA       ARG  49  -5.923  -9.946   9.507
  372    HB2  ARG  49           2HB      ARG  49  -6.248 -12.862   9.865
  373    HB3  ARG  49           1HB      ARG  49  -7.718 -11.913   9.813
  374    HG2  ARG  49           2HG      ARG  49  -5.908 -11.116   7.726
  375    HG3  ARG  49           1HG      ARG  49  -6.240 -12.848   7.660
  376    HD2  ARG  49           2HD      ARG  49  -8.413 -10.782   7.895
  377    HD3  ARG  49           1HD      ARG  49  -7.800 -11.347   6.342
  378    HE   ARG  49           HE       ARG  49  -8.583 -13.491   8.079
  379   HH11  ARG  49          1HH1      ARG  49  -9.821 -11.099   5.822
  380   HH12  ARG  49          2HH1      ARG  49 -11.167 -12.089   5.326
  381   HH21  ARG  49          1HH2      ARG  49 -10.335 -14.759   7.465
  382   HH22  ARG  49          2HH2      ARG  49 -11.475 -14.177   6.290
  383    H    PHE  50           HN       PHE  50  -5.340 -11.175  12.636
  384    HA   PHE  50           HA       PHE  50  -7.799 -10.074  13.722
  385    HB2  PHE  50           2HB      PHE  50  -5.527 -11.683  14.824
  386    HB3  PHE  50           1HB      PHE  50  -6.576 -10.791  15.911
  387    HD1  PHE  50           2HD      PHE  50  -9.155 -11.158  15.486
  388    HD2  PHE  50           1HD      PHE  50  -6.083 -13.849  14.299
  389    HE1  PHE  50           2HE      PHE  50 -10.798 -12.985  15.397
  390    HE2  PHE  50           1HE      PHE  50  -7.722 -15.684  14.205
  391    HZ   PHE  50           HZ       PHE  50 -10.084 -15.251  14.757
  392    H    ALA  51           HN       ALA  51  -4.564  -9.170  13.152
  393    HA   ALA  51           HA       ALA  51  -4.478  -7.101  15.156
  394    HB1  ALA  51           1HB      ALA  51  -2.587  -7.700  12.882
  395    HB2  ALA  51           2HB      ALA  51  -2.419  -8.253  14.550
  396    HB3  ALA  51           3HB      ALA  51  -2.305  -6.533  14.173
  397    H    ARG  52           HN       ARG  52  -4.879  -4.977  14.857
  398    HA   ARG  52           HA       ARG  52  -6.358  -4.194  12.557
  399    HB2  ARG  52           2HB      ARG  52  -5.363  -2.703  14.972
  400    HB3  ARG  52           1HB      ARG  52  -6.342  -1.971  13.723
  401    HG2  ARG  52           2HG      ARG  52  -8.089  -3.684  14.169
  402    HG3  ARG  52           1HG      ARG  52  -7.117  -4.234  15.535
  403    HD2  ARG  52           2HD      ARG  52  -7.301  -2.069  16.588
  404    HD3  ARG  52           1HD      ARG  52  -8.169  -1.432  15.189
  405    HE   ARG  52           HE       ARG  52  -9.266  -3.651  16.788
  406   HH11  ARG  52          1HH1      ARG  52  -9.562  -0.458  15.377
  407   HH12  ARG  52          2HH1      ARG  52 -11.238  -0.293  15.805
  408   HH21  ARG  52          1HH2      ARG  52 -11.463  -3.460  17.320
  409   HH22  ARG  52          2HH2      ARG  52 -12.339  -2.013  16.900
  410    HA   PRO  53           HA       PRO  53  -3.185  -2.768   9.987
  411    HB2  PRO  53           2HB      PRO  53  -4.650  -0.371   9.221
  412    HB3  PRO  53           1HB      PRO  53  -4.276  -1.802   8.260
  413    HG2  PRO  53           2HG      PRO  53  -6.787  -1.218   9.097
  414    HG3  PRO  53           1HG      PRO  53  -6.211  -2.879   8.863
  415    HD2  PRO  53           2HD      PRO  53  -6.549  -1.323  11.393
  416    HD3  PRO  53           1HD      PRO  53  -6.864  -3.042  11.074
  417    H    SER  54           HN       SER  54  -1.382  -1.966  10.696
  418    HA   SER  54           HA       SER  54  -1.230   0.837  11.473
  419    HB2  SER  54           2HB      SER  54  -0.068  -1.597  12.779
  420    HB3  SER  54           1HB      SER  54   0.694  -0.035  12.948
  421    HG   SER  54           HG       SER  54  -1.685   0.552  13.521
  422    H    TYR  55           HN       TYR  55  -0.800  -0.893   9.027
  423    HA   TYR  55           HA       TYR  55   2.060  -0.472   8.564
  424    HB2  TYR  55           2HB      TYR  55   1.669  -1.930   6.539
  425    HB3  TYR  55           1HB      TYR  55   1.430  -2.724   8.091
  426    HD1  TYR  55           1HD      TYR  55  -0.271  -1.385   5.108
  427    HD2  TYR  55           2HD      TYR  55  -0.724  -3.549   8.745
  428    HE1  TYR  55           1HE      TYR  55  -2.501  -2.121   4.384
  429    HE2  TYR  55           2HE      TYR  55  -2.960  -4.290   8.030
  430    HH   TYR  55           HH       TYR  55  -4.740  -3.577   6.480
  431    H    GLU  56           HN       GLU  56   2.796   0.814   6.942
  432    HA   GLU  56           HA       GLU  56   0.774   2.290   5.398
  433    HB2  GLU  56           2HB      GLU  56   3.167   3.411   6.852
  434    HB3  GLU  56           1HB      GLU  56   2.361   4.277   5.559
  435    HG2  GLU  56           2HG      GLU  56   1.444   5.183   7.476
  436    HG3  GLU  56           1HG      GLU  56   0.236   4.012   6.960
  437    H    VAL  57           HN       VAL  57   1.500   3.113   3.373
  438    HA   VAL  57           HA       VAL  57   3.839   1.700   2.278
  439    HB   VAL  57           HB       VAL  57   1.490   2.884   0.776
  440   HG11  VAL  57          1HG1      VAL  57   3.745   1.125  -0.177
  441   HG12  VAL  57          2HG1      VAL  57   3.560   2.846  -0.516
  442   HG13  VAL  57          3HG1      VAL  57   2.387   1.691  -1.150
  443   HG21  VAL  57          3HG2      VAL  57   0.828   0.546   0.361
  444   HG22  VAL  57          1HG2      VAL  57   0.755   0.975   2.071
  445   HG23  VAL  57          2HG2      VAL  57   2.100   0.009   1.461
  446    H    PHE  58           HN       PHE  58   5.554   2.909   1.724
  447    HA   PHE  58           HA       PHE  58   5.167   5.795   1.325
  448    HB2  PHE  58           2HB      PHE  58   7.244   4.497   3.100
  449    HB3  PHE  58           1HB      PHE  58   7.286   6.182   2.607
  450    HD1  PHE  58           1HD      PHE  58   4.963   7.454   3.109
  451    HD2  PHE  58           2HD      PHE  58   6.447   4.048   5.180
  452    HE1  PHE  58           1HE      PHE  58   3.624   8.072   5.083
  453    HE2  PHE  58           2HE      PHE  58   5.107   4.654   7.149
  454    HZ   PHE  58           HZ       PHE  58   3.695   6.671   7.105
  455    H    VAL  59           HN       VAL  59   6.720   6.822   0.062
  456    HA   VAL  59           HA       VAL  59   8.886   5.138  -1.020
  457    HB   VAL  59           HB       VAL  59   7.647   7.477  -2.465
  458   HG11  VAL  59          1HG1      VAL  59   9.972   7.118  -3.005
  459   HG12  VAL  59          2HG1      VAL  59   8.947   6.681  -4.372
  460   HG13  VAL  59          3HG1      VAL  59   9.648   5.420  -3.357
  461   HG21  VAL  59          3HG2      VAL  59   6.660   5.855  -3.998
  462   HG22  VAL  59          1HG2      VAL  59   6.052   5.631  -2.359
  463   HG23  VAL  59          2HG2      VAL  59   7.276   4.535  -3.003
  464    H    ASP  60           HN       ASP  60  10.898   5.969  -0.774
  465    HA   ASP  60           HA       ASP  60  11.065   8.473   0.741
  466    HB2  ASP  60           2HB      ASP  60  12.062   6.406   1.763
  467    HB3  ASP  60           1HB      ASP  60  13.218   6.371   0.433
  468    H    LEU  61           HN       LEU  61  11.598  10.188  -0.343
  469    HA   LEU  61           HA       LEU  61  13.413   9.899  -2.640
  470    HB2  LEU  61           2HB      LEU  61  11.008  11.714  -2.437
  471    HB3  LEU  61           1HB      LEU  61  12.128  11.647  -3.787
  472    HG   LEU  61           HG       LEU  61  10.415   9.328  -2.893
  473   HD11  LEU  61          1HD1      LEU  61   9.040   9.785  -4.827
  474   HD12  LEU  61          2HD1      LEU  61  10.020  11.203  -5.213
  475   HD13  LEU  61          3HD1      LEU  61   9.052  11.172  -3.739
  476   HD21  LEU  61          3HD2      LEU  61  11.057   8.369  -5.054
  477   HD22  LEU  61          1HD2      LEU  61  12.461   8.664  -4.030
  478   HD23  LEU  61          2HD2      LEU  61  12.096   9.762  -5.359
  479    H    THR  62           HN       THR  62  14.206  10.442  -0.036
  480    HA   THR  62           HA       THR  62  14.625  13.292   0.225
  481    HB   THR  62           HB       THR  62  16.024  12.676   2.187
  482    HG1  THR  62           1HG      THR  62  15.200   9.986   1.639
  483   HG21  THR  62          3HG2      THR  62  13.628  13.063   2.467
  484   HG22  THR  62          1HG2      THR  62  14.191  11.807   3.568
  485   HG23  THR  62          2HG2      THR  62  13.300  11.367   2.112
  486    H    GLU  63           HN       GLU  63  16.215  10.587  -1.196
  487    HA   GLU  63           HA       GLU  63  18.721  12.052  -1.520
  488    HB2  GLU  63           2HB      GLU  63  17.955   9.238  -2.274
  489    HB3  GLU  63           1HB      GLU  63  19.568   9.930  -2.401
  490    HG2  GLU  63           2HG      GLU  63  18.141   9.914   0.216
  491    HG3  GLU  63           1HG      GLU  63  18.950   8.472  -0.371
  492    H    ALA  64           HN       ALA  64  15.935  10.981  -3.252
  493    HA   ALA  64           HA       ALA  64  16.919  11.117  -5.889
  494    HB1  ALA  64           1HB      ALA  64  14.857   9.946  -5.267
  495    HB2  ALA  64           2HB      ALA  64  14.593  11.099  -6.576
  496    HB3  ALA  64           3HB      ALA  64  14.087  11.496  -4.934
  497    H    GLY  65           HN       GLY  65  16.514  12.682  -7.535
  498    HA2  GLY  65           2HA      GLY  65  16.707  15.398  -6.486
  499    HA3  GLY  65           1HA      GLY  65  17.198  14.869  -8.087
  500    H    GLU  66           HN       GLU  66  16.086  16.127  -9.401
  501    HA   GLU  66           HA       GLU  66  13.372  16.921  -8.740
  502    HB2  GLU  66           2HB      GLU  66  13.636  18.622 -10.359
  503    HB3  GLU  66           1HB      GLU  66  15.172  18.516  -9.528
  504    HG2  GLU  66           2HG      GLU  66  14.507  17.507 -12.284
  505    HG3  GLU  66           1HG      GLU  66  15.595  18.821 -11.850
  506    H    GLY  67           HN       GLY  67  11.977  17.230 -10.896
  507    HA2  GLY  67           2HA      GLY  67  10.880  16.345 -12.681
  508    HA3  GLY  67           1HA      GLY  67  12.300  15.360 -12.984
  509    H    SER  68           HN       SER  68  10.294  14.015 -13.590
  510    HA   SER  68           HA       SER  68   9.283  12.514 -11.329
  511    HB2  SER  68           2HB      SER  68   7.896  12.861 -13.356
  512    HB3  SER  68           1HB      SER  68   9.034  11.880 -14.276
  513    HG   SER  68           HG       SER  68   6.967  11.044 -12.925
  514    H    HIS  69           HN       HIS  69  10.018  10.687 -10.618
  515    HA   HIS  69           HA       HIS  69  12.252   9.392 -11.986
  516    HB2  HIS  69           2HB      HIS  69  13.229   9.132  -9.537
  517    HB3  HIS  69           1HB      HIS  69  13.589  10.542 -10.524
  518    HD1  HIS  69           1HD      HIS  69  12.975  12.778  -9.578
  519    HD2  HIS  69           2HD      HIS  69  11.186   9.635  -7.525
  520    HE1  HIS  69           1HE      HIS  69  11.891  13.818  -7.568
  521    HE2  HIS  69           2HE      HIS  69  10.663  11.928  -6.448
  522    H    THR  70           HN       THR  70  12.055   7.292 -12.083
  523    HA   THR  70           HA       THR  70   9.868   6.048 -10.596
  524    HB   THR  70           HB       THR  70  11.406   4.902 -12.930
  525    HG1  THR  70           1HG      THR  70  10.419   6.847 -13.576
  526   HG21  THR  70          3HG2      THR  70   9.353   3.560 -13.215
  527   HG22  THR  70          1HG2      THR  70   8.699   4.286 -11.745
  528   HG23  THR  70          2HG2      THR  70  10.135   3.265 -11.662
  529    H    VAL  71           HN       VAL  71  10.345   4.947  -8.838
  530    HA   VAL  71           HA       VAL  71  12.799   3.323  -8.741
  531    HB   VAL  71           HB       VAL  71  13.109   3.923  -6.344
  532   HG11  VAL  71          1HG1      VAL  71  14.135   6.111  -6.723
  533   HG12  VAL  71          2HG1      VAL  71  13.253   6.262  -8.242
  534   HG13  VAL  71          3HG1      VAL  71  14.473   5.002  -8.053
  535   HG21  VAL  71          3HG2      VAL  71  10.864   4.677  -5.829
  536   HG22  VAL  71          1HG2      VAL  71  11.043   6.036  -6.938
  537   HG23  VAL  71          2HG2      VAL  71  12.026   5.957  -5.476
  538    H    ASP  72           HN       ASP  72  12.649   1.696  -6.847
  539    HA   ASP  72           HA       ASP  72  10.014   0.495  -6.990
  540    HB2  ASP  72           2HB      ASP  72  11.011  -1.430  -5.870
  541    HB3  ASP  72           1HB      ASP  72  11.996  -0.932  -7.239
  542    H    VAL  73           HN       VAL  73   8.814  -0.168  -5.135
  543    HA   VAL  73           HA       VAL  73   8.807   2.001  -3.189
  544    HB   VAL  73           HB       VAL  73   6.710  -0.092  -3.770
  545   HG11  VAL  73          1HG1      VAL  73   6.560   2.396  -2.073
  546   HG12  VAL  73          2HG1      VAL  73   6.542   0.734  -1.485
  547   HG13  VAL  73          3HG1      VAL  73   5.205   1.338  -2.468
  548   HG21  VAL  73          3HG2      VAL  73   5.509   1.720  -4.885
  549   HG22  VAL  73          1HG2      VAL  73   7.076   1.431  -5.642
  550   HG23  VAL  73          2HG2      VAL  73   6.858   2.813  -4.567
  551    H    GLU  74           HN       GLU  74   9.387   1.797  -1.162
  552    HA   GLU  74           HA       GLU  74   9.827  -0.827   0.028
  553    HB2  GLU  74           2HB      GLU  74  10.861   1.873   0.463
  554    HB3  GLU  74           1HB      GLU  74  10.426   1.064   1.963
  555    HG2  GLU  74           2HG      GLU  74  12.177  -0.215  -0.116
  556    HG3  GLU  74           1HG      GLU  74  12.814   0.805   1.172
  557    H    HIS  75           HN       HIS  75   8.923  -1.340   2.132
  558    HA   HIS  75           HA       HIS  75   6.543   0.137   2.902
  559    HB2  HIS  75           2HB      HIS  75   5.182  -2.062   2.705
  560    HB3  HIS  75           1HB      HIS  75   5.447  -1.101   1.256
  561    HD1  HIS  75           1HD      HIS  75   6.774  -2.158  -0.630
  562    HD2  HIS  75           2HD      HIS  75   6.701  -4.498   2.805
  563    HE1  HIS  75           1HE      HIS  75   7.716  -4.381  -1.312
  564    HE2  HIS  75           2HE      HIS  75   7.854  -5.711   0.820
  565    H    ARG  76           HN       ARG  76   5.709  -0.442   4.937
  566    HA   ARG  76           HA       ARG  76   7.037  -2.563   6.423
  567    HB2  ARG  76           2HB      ARG  76   7.465   0.336   6.910
  568    HB3  ARG  76           1HB      ARG  76   7.253  -0.688   8.324
  569    HG2  ARG  76           2HG      ARG  76   9.317  -1.073   6.164
  570    HG3  ARG  76           1HG      ARG  76   9.606  -0.411   7.777
  571    HD2  ARG  76           2HD      ARG  76   8.919  -2.508   8.786
  572    HD3  ARG  76           1HD      ARG  76   8.534  -3.172   7.203
  573    HE   ARG  76           HE       ARG  76  11.258  -2.317   7.418
  574   HH11  ARG  76          1HH1      ARG  76   9.030  -4.911   8.175
  575   HH12  ARG  76          2HH1      ARG  76  10.252  -6.150   8.145
  576   HH21  ARG  76          1HH2      ARG  76  12.879  -3.936   7.387
  577   HH22  ARG  76          2HH2      ARG  76  12.449  -5.595   7.698
  578    H    GLY  77           HN       GLY  77   6.018  -3.105   8.390
  579    HA2  GLY  77           2HA      GLY  77   4.100  -2.402   9.914
  580    HA3  GLY  77           1HA      GLY  77   3.171  -2.339   8.419
  581    H    PHE  78           HN       PHE  78   3.533  -4.418   7.053
  582    HA   PHE  78           HA       PHE  78   2.934  -6.712   8.720
  583    HB2  PHE  78           2HB      PHE  78   2.747  -7.800   6.354
  584    HB3  PHE  78           1HB      PHE  78   1.508  -6.664   6.877
  585    HD1  PHE  78           1HD      PHE  78   4.527  -7.033   4.768
  586    HD2  PHE  78           2HD      PHE  78   1.127  -4.654   5.722
  587    HE1  PHE  78           1HE      PHE  78   4.926  -5.658   2.769
  588    HE2  PHE  78           2HE      PHE  78   1.523  -3.278   3.725
  589    HZ   PHE  78           HZ       PHE  78   3.423  -3.780   2.244
  590    HA   PRO  79           HA       PRO  79   6.948  -8.479   8.804
  591    HB2  PRO  79           2HB      PRO  79   5.802 -11.104   8.084
  592    HB3  PRO  79           1HB      PRO  79   6.667 -10.615   9.544
  593    HG2  PRO  79           2HG      PRO  79   4.033 -11.062   9.581
  594    HG3  PRO  79           1HG      PRO  79   4.768  -9.770  10.548
  595    HD2  PRO  79           2HD      PRO  79   3.278  -9.585   7.956
  596    HD3  PRO  79           1HD      PRO  79   3.201  -8.522   9.377
  597    H    GLY  80           HN       GLY  80   8.619  -8.692   7.437
  598    HA2  GLY  80           2HA      GLY  80   8.125  -8.759   4.602
  599    HA3  GLY  80           1HA      GLY  80   9.692  -8.639   5.386
  600    H    ASP  81           HN       ASP  81   8.414 -11.163   6.883
  601    HA   ASP  81           HA       ASP  81   9.902 -13.159   5.616
  602    HB2  ASP  81           2HB      ASP  81   9.028 -13.327   7.942
  603    HB3  ASP  81           1HB      ASP  81   7.413 -13.523   7.280
  604    H    LEU  82           HN       LEU  82   6.444 -12.561   5.551
  605    HA   LEU  82           HA       LEU  82   5.757 -14.590   3.739
  606    HB2  LEU  82           2HB      LEU  82   4.309 -11.988   4.240
  607    HB3  LEU  82           1HB      LEU  82   3.620 -13.448   3.559
  608    HG   LEU  82           HG       LEU  82   4.684 -13.217   6.375
  609   HD11  LEU  82          1HD1      LEU  82   2.718 -11.816   6.078
  610   HD12  LEU  82          2HD1      LEU  82   2.334 -13.234   7.056
  611   HD13  LEU  82          3HD1      LEU  82   1.846 -13.171   5.363
  612   HD21  LEU  82          3HD2      LEU  82   3.078 -15.379   5.026
  613   HD22  LEU  82          1HD2      LEU  82   3.557 -15.350   6.723
  614   HD23  LEU  82          2HD2      LEU  82   4.784 -15.478   5.460
  615    H    ALA  83           HN       ALA  83   4.855 -14.267   1.571
  616    HA   ALA  83           HA       ALA  83   6.584 -12.624  -0.051
  617    HB1  ALA  83           1HB      ALA  83   5.365 -13.600  -1.947
  618    HB2  ALA  83           2HB      ALA  83   4.239 -14.366  -0.827
  619    HB3  ALA  83           3HB      ALA  83   5.934 -14.848  -0.837
  620    H    VAL  84           HN       VAL  84   6.196 -10.532  -0.240
  621    HA   VAL  84           HA       VAL  84   3.496  -9.534   0.216
  622    HB   VAL  84           HB       VAL  84   6.083  -8.005  -0.121
  623   HG11  VAL  84          1HG1      VAL  84   3.359  -7.077   0.780
  624   HG12  VAL  84          2HG1      VAL  84   4.142  -6.676  -0.749
  625   HG13  VAL  84          3HG1      VAL  84   4.826  -6.099   0.772
  626   HG21  VAL  84          3HG2      VAL  84   6.094  -9.376   1.894
  627   HG22  VAL  84          1HG2      VAL  84   4.544  -8.689   2.381
  628   HG23  VAL  84          2HG2      VAL  84   5.978  -7.663   2.299
  629    H    THR  85           HN       THR  85   2.225  -9.361  -1.479
  630    HA   THR  85           HA       THR  85   3.424  -8.901  -4.114
  631    HB   THR  85           HB       THR  85   0.541  -9.544  -3.677
  632    HG1  THR  85           1HG      THR  85   1.045 -11.474  -2.959
  633   HG21  THR  85          3HG2      THR  85   1.248  -8.935  -5.916
  634   HG22  THR  85          1HG2      THR  85   0.798 -10.641  -5.868
  635   HG23  THR  85          2HG2      THR  85   2.501 -10.178  -5.880
  636    H    VAL  86           HN       VAL  86   3.298  -6.996  -4.926
  637    HA   VAL  86           HA       VAL  86   1.107  -5.166  -4.202
  638    HB   VAL  86           HB       VAL  86   3.549  -3.754  -4.887
  639   HG11  VAL  86          1HG1      VAL  86   1.621  -2.698  -3.864
  640   HG12  VAL  86          2HG1      VAL  86   3.036  -2.501  -2.827
  641   HG13  VAL  86          3HG1      VAL  86   1.802  -3.694  -2.419
  642   HG21  VAL  86          3HG2      VAL  86   4.786  -4.145  -2.774
  643   HG22  VAL  86          1HG2      VAL  86   4.787  -5.522  -3.877
  644   HG23  VAL  86          2HG2      VAL  86   3.736  -5.529  -2.457
  645    H    GLU  87           HN       GLU  87   0.409  -3.895  -6.139
  646    HA   GLU  87           HA       GLU  87   2.653  -3.936  -8.040
  647    HB2  GLU  87           2HB      GLU  87  -0.265  -4.095  -8.733
  648    HB3  GLU  87           1HB      GLU  87   0.957  -3.607  -9.896
  649    HG2  GLU  87           2HG      GLU  87   2.107  -5.796  -9.416
  650    HG3  GLU  87           1HG      GLU  87   0.653  -6.259  -8.534
  651    HA   PRO  88           HA       PRO  88   3.331  -0.793  -9.382
  652    HB2  PRO  88           2HB      PRO  88   4.704   0.905  -7.791
  653    HB3  PRO  88           1HB      PRO  88   3.005   1.157  -8.174
  654    HG2  PRO  88           2HG      PRO  88   4.191   0.484  -5.614
  655    HG3  PRO  88           1HG      PRO  88   2.495   0.857  -5.966
  656    HD2  PRO  88           2HD      PRO  88   3.843  -1.797  -5.768
  657    HD3  PRO  88           1HD      PRO  88   2.132  -1.377  -5.503
  658    H    ARG  89           HN       ARG  89   5.252  -1.677 -10.129
  659    HA   ARG  89           HA       ARG  89   6.780  -3.162  -8.111
  660    HB2  ARG  89           2HB      ARG  89   6.984  -3.258 -11.139
  661    HB3  ARG  89           1HB      ARG  89   7.949  -4.232 -10.033
  662    HG2  ARG  89           2HG      ARG  89   5.647  -4.951  -9.083
  663    HG3  ARG  89           1HG      ARG  89   5.035  -4.392 -10.639
  664    HD2  ARG  89           2HD      ARG  89   6.687  -5.874 -11.743
  665    HD3  ARG  89           1HD      ARG  89   7.123  -6.508 -10.162
  666    HE   ARG  89           HE       ARG  89   4.431  -6.764 -11.353
  667   HH11  ARG  89          1HH1      ARG  89   7.087  -8.025  -9.454
  668   HH12  ARG  89          2HH1      ARG  89   6.267  -9.503  -9.036
  669   HH21  ARG  89          1HH2      ARG  89   3.352  -8.704 -10.836
  670   HH22  ARG  89          2HH2      ARG  89   4.136  -9.901  -9.848
  671    H    MET  90           HN       MET  90   7.162  -0.821 -10.667
  672    HA   MET  90           HA       MET  90   9.045   0.589  -8.916
  673    HB2  MET  90           2HB      MET  90   9.082   0.556 -11.956
  674    HB3  MET  90           1HB      MET  90  10.085   1.583 -10.942
  675    HG2  MET  90           2HG      MET  90  11.174  -0.395 -10.013
  676    HG3  MET  90           1HG      MET  90  10.167  -1.425 -11.028
  677    HE1  MET  90           3HE      MET  90  11.825   2.037 -11.968
  678    HE2  MET  90           1HE      MET  90  13.364   1.493 -12.636
  679    HE3  MET  90           2HE      MET  90  13.011   1.254 -10.924
  680    H    ALA  91           HN       ALA  91   8.434   2.708  -8.560
  681    HA   ALA  91           HA       ALA  91   5.862   3.448  -9.798
  682    HB1  ALA  91           1HB      ALA  91   5.217   4.455  -7.674
  683    HB2  ALA  91           2HB      ALA  91   6.750   3.954  -6.961
  684    HB3  ALA  91           3HB      ALA  91   5.579   2.739  -7.477
  685    H    ARG  92           HN       ARG  92   5.458   5.641 -10.116
  686    HA   ARG  92           HA       ARG  92   7.921   7.213 -10.377
  687    HB2  ARG  92           2HB      ARG  92   6.786   8.446 -12.151
  688    HB3  ARG  92           1HB      ARG  92   6.761   6.722 -12.494
  689    HG2  ARG  92           2HG      ARG  92   4.491   6.535 -12.070
  690    HG3  ARG  92           1HG      ARG  92   4.445   8.021 -11.122
  691    HD2  ARG  92           2HD      ARG  92   3.382   8.493 -13.179
  692    HD3  ARG  92           1HD      ARG  92   4.964   9.266 -13.237
  693    HE   ARG  92           HE       ARG  92   5.587   7.093 -14.511
  694   HH11  ARG  92          1HH1      ARG  92   2.548   8.825 -14.673
  695   HH12  ARG  92          2HH1      ARG  92   2.200   8.330 -16.302
  696   HH21  ARG  92          1HH2      ARG  92   5.131   6.424 -16.654
  697   HH22  ARG  92          2HH2      ARG  92   3.676   6.967 -17.436
  698    H    VAL  93           HN       VAL  93   8.149   8.944  -9.155
  699    HA   VAL  93           HA       VAL  93   5.722  10.406  -8.364
  700    HB   VAL  93           HB       VAL  93   8.210  10.194  -6.651
  701   HG11  VAL  93          1HG1      VAL  93   6.834  11.328  -4.964
  702   HG12  VAL  93          2HG1      VAL  93   5.513  11.442  -6.126
  703   HG13  VAL  93          3HG1      VAL  93   7.023  12.307  -6.419
  704   HG21  VAL  93          3HG2      VAL  93   5.515   8.893  -6.253
  705   HG22  VAL  93          1HG2      VAL  93   6.851   8.864  -5.106
  706   HG23  VAL  93          2HG2      VAL  93   7.013   8.062  -6.669
  707    H    GLN  94           HN       GLN  94   5.719  12.382  -9.195
  708    HA   GLN  94           HA       GLN  94   8.237  13.364 -10.331
  709    HB2  GLN  94           2HB      GLN  94   6.285  13.142 -11.833
  710    HB3  GLN  94           1HB      GLN  94   5.395  14.275 -10.828
  711    HG2  GLN  94           2HG      GLN  94   6.942  16.044 -11.392
  712    HG3  GLN  94           1HG      GLN  94   7.926  14.920 -12.322
  713   HE21  GLN  94          1HE2      GLN  94   6.676  17.340 -13.207
  714   HE22  GLN  94          2HE2      GLN  94   5.611  16.891 -14.487
  715    H    LEU  95           HN       LEU  95   9.339  14.788  -9.212
  716    HA   LEU  95           HA       LEU  95   7.883  16.713  -7.536
  717    HB2  LEU  95           2HB      LEU  95  10.812  15.966  -7.598
  718    HB3  LEU  95           1HB      LEU  95  10.138  17.235  -6.593
  719    HG   LEU  95           HG       LEU  95   9.473  14.293  -6.399
  720   HD11  LEU  95          1HD1      LEU  95  10.668  14.388  -4.273
  721   HD12  LEU  95          2HD1      LEU  95  11.088  16.073  -4.578
  722   HD13  LEU  95          3HD1      LEU  95  11.728  14.803  -5.620
  723   HD21  LEU  95          3HD2      LEU  95   8.256  14.926  -4.369
  724   HD22  LEU  95          1HD2      LEU  95   7.573  15.696  -5.802
  725   HD23  LEU  95          2HD2      LEU  95   8.590  16.625  -4.700
  726    H    GLU  96           HN       GLU  96   7.718  18.758  -8.253
  727    HA   GLU  96           HA       GLU  96   9.184  19.341 -10.740
  728    HB2  GLU  96           2HB      GLU  96   6.751  18.897 -11.008
  729    HB3  GLU  96           1HB      GLU  96   6.416  20.257  -9.950
  730    HG2  GLU  96           2HG      GLU  96   6.114  20.884 -12.256
  731    HG3  GLU  96           1HG      GLU  96   7.472  21.764 -11.554
  732    H    GLU  97           HN       GLU  97  10.261  21.210 -10.889
  733    HA   GLU  97           HA       GLU  97  10.322  23.004  -8.645
  734    HB2  GLU  97           2HB      GLU  97  11.858  24.315 -10.211
  735    HB3  GLU  97           1HB      GLU  97  12.415  22.739  -9.686
  736    HG2  GLU  97           2HG      GLU  97  11.679  21.795 -11.838
  737    HG3  GLU  97           1HG      GLU  97  11.185  23.407 -12.354
  738    H    ARG  98           HN       ARG  98   8.063  23.429  -8.717
  739    HA   ARG  98           HA       ARG  98   7.066  24.961 -10.989
  740    HB2  ARG  98           2HB      ARG  98   5.779  23.036 -10.058
  741    HB3  ARG  98           1HB      ARG  98   5.579  23.923  -8.562
  742    HG2  ARG  98           2HG      ARG  98   4.085  25.403  -9.495
  743    HG3  ARG  98           1HG      ARG  98   4.675  25.130 -11.135
  744    HD2  ARG  98           2HD      ARG  98   2.483  24.149 -10.852
  745    HD3  ARG  98           1HD      ARG  98   3.686  22.893 -11.111
  746    HE   ARG  98           HE       ARG  98   3.572  22.470  -8.670
  747   HH11  ARG  98          1HH1      ARG  98   0.971  24.289 -10.168
  748   HH12  ARG  98          2HH1      ARG  98  -0.252  23.685  -9.090
  749   HH21  ARG  98          1HH2      ARG  98   1.954  21.639  -7.271
  750   HH22  ARG  98          2HH2      ARG  98   0.307  22.187  -7.442
  751    H    GLN  99           HN       GLN  99   5.411  26.714 -10.183
  752    HA   GLN  99           HA       GLN  99   7.055  28.714  -8.981
  753    HB2  GLN  99           2HB      GLN  99   5.383  28.936 -10.923
  754    HB3  GLN  99           1HB      GLN  99   4.141  28.992  -9.679
  755    HG2  GLN  99           2HG      GLN  99   5.031  30.979  -8.760
  756    HG3  GLN  99           1HG      GLN  99   6.483  30.857  -9.753
  757   HE21  GLN  99          1HE2      GLN  99   4.499  33.017  -9.538
  758   HE22  GLN  99          2HE2      GLN  99   3.913  33.269 -11.150
  759    H    THR 100           HN       THR 100   5.259  26.342  -7.625
  760    HA   THR 100           HA       THR 100   4.537  27.944  -5.274
  761    HB   THR 100           HB       THR 100   3.283  25.781  -4.637
  762    HG1  THR 100           1HG      THR 100   4.185  24.415  -6.216
  763   HG21  THR 100          3HG2      THR 100   2.376  27.412  -7.013
  764   HG22  THR 100          1HG2      THR 100   2.143  27.832  -5.318
  765   HG23  THR 100          2HG2      THR 100   1.332  26.419  -5.996
  766    H    VAL 101           HN       VAL 101   6.409  28.039  -4.115
  767    HA   VAL 101           HA       VAL 101   7.767  25.480  -3.546
  768    HB   VAL 101           HB       VAL 101   9.764  26.833  -2.957
  769   HG11  VAL 101          1HG1      VAL 101  10.381  27.440  -5.258
  770   HG12  VAL 101          2HG1      VAL 101   8.692  27.291  -5.743
  771   HG13  VAL 101          3HG1      VAL 101   9.579  25.873  -5.184
  772   HG21  VAL 101          3HG2      VAL 101   8.646  28.910  -2.355
  773   HG22  VAL 101          1HG2      VAL 101   8.139  29.139  -4.028
  774   HG23  VAL 101          2HG2      VAL 101   9.851  29.194  -3.610
  775    H    SER 102           HN       SER 102   5.431  26.994  -2.233
  776    HA   SER 102           HA       SER 102   6.511  27.417   0.446
  777    HB2  SER 102           2HB      SER 102   4.079  28.182   0.846
  778    HB3  SER 102           1HB      SER 102   5.091  29.183  -0.196
  779    HG   SER 102           HG       SER 102   2.779  28.275  -0.815
  780    H    VAL 103           HN       VAL 103   6.486  24.752  -0.523
  781    HA   VAL 103           HA       VAL 103   4.226  23.468   0.809
  782    HB   VAL 103           HB       VAL 103   6.491  22.189  -0.734
  783   HG11  VAL 103          1HG1      VAL 103   5.001  20.228  -0.823
  784   HG12  VAL 103          2HG1      VAL 103   3.859  21.067   0.226
  785   HG13  VAL 103          3HG1      VAL 103   5.463  20.642   0.829
  786   HG21  VAL 103          3HG2      VAL 103   5.152  23.657  -2.155
  787   HG22  VAL 103          1HG2      VAL 103   3.686  22.833  -1.625
  788   HG23  VAL 103          2HG2      VAL 103   4.897  21.960  -2.564
  789    HA   PRO 104           HA       PRO 104   7.101  22.862   4.232
  790    HB2  PRO 104           2HB      PRO 104   5.272  23.052   6.194
  791    HB3  PRO 104           1HB      PRO 104   5.880  24.472   5.338
  792    HG2  PRO 104           2HG      PRO 104   3.245  23.166   5.166
  793    HG3  PRO 104           1HG      PRO 104   3.705  24.829   4.774
  794    HD2  PRO 104           2HD      PRO 104   3.348  22.608   2.974
  795    HD3  PRO 104           1HD      PRO 104   3.777  24.283   2.580
  796    H    VAL 105           HN       VAL 105   7.772  20.937   4.997
  797    HA   VAL 105           HA       VAL 105   6.048  18.623   4.798
  798    HB   VAL 105           HB       VAL 105   7.986  17.334   5.635
  799   HG11  VAL 105          1HG1      VAL 105   9.441  17.705   3.687
  800   HG12  VAL 105          2HG1      VAL 105   8.599  19.218   3.362
  801   HG13  VAL 105          3HG1      VAL 105   7.733  17.687   3.251
  802   HG21  VAL 105          3HG2      VAL 105   8.964  19.045   7.091
  803   HG22  VAL 105          1HG2      VAL 105   9.410  19.996   5.677
  804   HG23  VAL 105          2HG2      VAL 105  10.152  18.418   5.945
  805    H    THR 106           HN       THR 106   6.913  20.911   7.196
  806    HA   THR 106           HA       THR 106   6.258  19.228   9.451
  807    HB   THR 106           HB       THR 106   6.376  22.232   9.498
  808    HG1  THR 106           1HG      THR 106   8.301  21.730   8.542
  809   HG21  THR 106          3HG2      THR 106   7.121  20.130  11.537
  810   HG22  THR 106          1HG2      THR 106   5.648  21.100  11.551
  811   HG23  THR 106          2HG2      THR 106   7.216  21.875  11.768
  812    H    VAL 107           HN       VAL 107   4.200  18.721   8.148
  813    HA   VAL 107           HA       VAL 107   2.089  20.639   8.075
  814    HB   VAL 107           HB       VAL 107   1.893  17.628   7.893
  815   HG11  VAL 107          1HG1      VAL 107   0.019  19.767   6.890
  816   HG12  VAL 107          2HG1      VAL 107  -0.246  18.750   8.306
  817   HG13  VAL 107          3HG1      VAL 107  -0.181  18.026   6.698
  818   HG21  VAL 107          3HG2      VAL 107   2.267  19.661   5.692
  819   HG22  VAL 107          1HG2      VAL 107   1.986  17.936   5.461
  820   HG23  VAL 107          2HG2      VAL 107   3.469  18.490   6.241
  821    H    GLU 108           HN       GLU 108   2.901  17.945  10.237
  822    HA   GLU 108           HA       GLU 108   1.281  19.140  12.326
  823    HB2  GLU 108           2HB      GLU 108  -0.183  17.568  10.948
  824    HB3  GLU 108           1HB      GLU 108   0.821  16.257  11.551
  825    HG2  GLU 108           2HG      GLU 108  -1.224  16.469  12.833
  826    HG3  GLU 108           1HG      GLU 108   0.189  16.811  13.834
  827    H    MET 109           HN       MET 109   2.337  18.960  14.216
  828    HA   MET 109           HA       MET 109   4.730  17.389  14.349
  829    HB2  MET 109           2HB      MET 109   3.326  19.137  16.355
  830    HB3  MET 109           1HB      MET 109   4.750  18.198  16.772
  831    HG2  MET 109           2HG      MET 109   5.971  19.352  14.934
  832    HG3  MET 109           1HG      MET 109   4.558  20.380  14.717
  833    HE1  MET 109           3HE      MET 109   5.825  18.997  18.156
  834    HE2  MET 109           1HE      MET 109   6.961  20.252  18.654
  835    HE3  MET 109           2HE      MET 109   7.332  19.230  17.268
  836    H    ILE 110           HN       ILE 110   3.536  15.410  13.860
  837    HA   ILE 110           HA       ILE 110   2.703  14.081  16.358
  838    HB   ILE 110           HB       ILE 110   1.082  14.219  14.342
  839   HG12  ILE 110          2HG1      ILE 110   1.108  12.533  16.379
  840   HG13  ILE 110          1HG1      ILE 110  -0.016  12.319  15.044
  841   HG21  ILE 110          1HG2      ILE 110   2.661  13.695  12.599
  842   HG22  ILE 110          2HG2      ILE 110   1.367  12.495  12.623
  843   HG23  ILE 110          3HG2      ILE 110   2.950  12.103  13.298
  844   HD11  ILE 110          3HD1      ILE 110   2.593  10.858  15.396
  845   HD12  ILE 110          1HD1      ILE 110   1.435  10.618  14.087
  846   HD13  ILE 110          2HD1      ILE 110   0.987  10.216  15.745
  847    H    ASN 111           HN       ASN 111   5.240  14.681  14.520
  848    HA   ASN 111           HA       ASN 111   6.319  12.065  14.070
  849    HB2  ASN 111           2HB      ASN 111   8.355  13.256  13.350
  850    HB3  ASN 111           1HB      ASN 111   6.916  13.877  12.555
  851   HD21  ASN 111          1HD2      ASN 111   9.575  15.064  13.089
  852   HD22  ASN 111          2HD2      ASN 111   9.258  16.558  13.900
  853    H    LEU 112           HN       LEU 112   7.346  10.856  15.469
  854    HA   LEU 112           HA       LEU 112   8.282  12.004  17.984
  855    HB2  LEU 112           2HB      LEU 112   8.190   9.134  17.038
  856    HB3  LEU 112           1HB      LEU 112   8.649   9.657  18.647
  857    HG   LEU 112           HG       LEU 112   5.919   9.997  17.402
  858   HD11  LEU 112          1HD1      LEU 112   6.395   7.679  17.932
  859   HD12  LEU 112          2HD1      LEU 112   5.212   8.340  19.059
  860   HD13  LEU 112          3HD1      LEU 112   6.888   8.133  19.564
  861   HD21  LEU 112          3HD2      LEU 112   6.410  11.805  18.939
  862   HD22  LEU 112          1HD2      LEU 112   6.911  10.650  20.174
  863   HD23  LEU 112          2HD2      LEU 112   5.230  10.704  19.649
  864    H    GLU 113           HN       GLU 113  10.437  10.612  18.675
  865    HA   GLU 113           HA       GLU 113  12.443  11.589  16.870
  866    HB2  GLU 113           2HB      GLU 113  14.014  10.528  18.591
  867    HB3  GLU 113           1HB      GLU 113  13.016  11.875  19.118
  868    HG2  GLU 113           2HG      GLU 113  11.464  10.342  20.178
  869    HG3  GLU 113           1HG      GLU 113  12.408   8.967  19.603
  870    H    HIS 114           HN       HIS 114  12.543  10.500  15.028
  871    HA   HIS 114           HA       HIS 114  13.351   7.680  15.183
  872    HB2  HIS 114           2HB      HIS 114  11.005   7.664  14.491
  873    HB3  HIS 114           1HB      HIS 114  11.340   8.848  13.234
  874    HD1  HIS 114           1HD      HIS 114  11.705   5.210  14.048
  875    HD2  HIS 114           2HD      HIS 114  12.514   7.816  10.901
  876    HE1  HIS 114           1HE      HIS 114  12.238   3.750  12.068
  877    HE2  HIS 114           2HE      HIS 114  12.890   5.344  10.226
  878    H    HIS 115           HN       HIS 115  15.431   7.826  14.614
  879    HA   HIS 115           HA       HIS 115  16.393   9.897  12.901
  880    HB2  HIS 115           2HB      HIS 115  17.573   7.784  14.529
  881    HB3  HIS 115           1HB      HIS 115  18.431   8.037  13.011
  882    HD1  HIS 115           1HD      HIS 115  19.520  10.375  12.633
  883    HD2  HIS 115           2HD      HIS 115  17.832   9.827  16.401
  884    HE1  HIS 115           1HE      HIS 115  20.407  12.253  14.059
  885    HE2  HIS 115           2HE      HIS 115  19.454  11.847  16.360
  886    H    HIS 116           HN       HIS 116  15.848   9.901  10.847
  887    HA   HIS 116           HA       HIS 116  15.574   7.590   9.222
  888    HB2  HIS 116           2HB      HIS 116  14.484   9.721   8.658
  889    HB3  HIS 116           1HB      HIS 116  16.054  10.488   8.456
  890    HD1  HIS 116           1HD      HIS 116  17.274  10.103   6.255
  891    HD2  HIS 116           2HD      HIS 116  13.705   8.006   6.559
  892    HE1  HIS 116           1HE      HIS 116  16.806   9.230   3.941
  893    HE2  HIS 116           2HE      HIS 116  14.509   8.201   4.104
  894    H    HIS 117           HN       HIS 117  17.332   6.287   9.203
  895    HA   HIS 117           HA       HIS 117  19.985   7.221   9.287
  896    HB2  HIS 117           2HB      HIS 117  20.612   4.855   8.690
  897    HB3  HIS 117           1HB      HIS 117  19.606   5.034  10.118
  898    HD1  HIS 117           1HD      HIS 117  19.675   3.516   6.725
  899    HD2  HIS 117           2HD      HIS 117  16.987   4.005   9.863
  900    HE1  HIS 117           1HE      HIS 117  17.789   1.915   6.264
  901    HE2  HIS 117           2HE      HIS 117  16.339   2.032   8.324
  902    H    HIS 118           HN       HIS 118  21.487   7.564   7.808
  903    HA   HIS 118           HA       HIS 118  22.498   7.989   5.846
  904    HB2  HIS 118           2HB      HIS 118  20.934   5.672   5.263
  905    HB3  HIS 118           1HB      HIS 118  20.905   6.744   3.865
  906    HD1  HIS 118           1HD      HIS 118  23.192   7.276   2.729
  907    HD2  HIS 118           2HD      HIS 118  23.369   4.439   5.766
  908    HE1  HIS 118           1HE      HIS 118  25.423   6.142   2.475
  909    HE2  HIS 118           2HE      HIS 118  25.585   4.561   4.428
  910    H    HIS 119           HN       HIS 119  21.464  10.098   6.464
  911    HA   HIS 119           HA       HIS 119  21.151  11.498   4.123
  912    HB2  HIS 119           2HB      HIS 119  18.849  10.532   4.016
  913    HB3  HIS 119           1HB      HIS 119  18.487  11.307   5.556
  914    HD1  HIS 119           1HD      HIS 119  17.485  13.589   5.394
  915    HD2  HIS 119           2HD      HIS 119  19.574  12.548   1.950
  916    HE1  HIS 119           1HE      HIS 119  17.136  15.489   3.789
  917    HE2  HIS 119           2HE      HIS 119  18.595  14.938   1.809
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1  -4.767 -31.975  10.792
    2    H2   MET   1           H2       MET   1  -3.591 -30.927  10.165
    3    H3   MET   1           H3       MET   1  -3.156 -32.107  11.301
    4    HA   MET   1           HA       MET   1  -3.565 -33.861   9.793
    5    HB2  MET   1           2HB      MET   1  -4.575 -31.667   7.973
    6    HB3  MET   1           1HB      MET   1  -4.204 -33.292   7.412
    7    HG2  MET   1           2HG      MET   1  -5.873 -34.184   8.989
    8    HG3  MET   1           1HG      MET   1  -6.286 -32.533   9.447
    9    HE1  MET   1           2HE      MET   1  -8.394 -34.704   8.412
   10    HE2  MET   1           3HE      MET   1  -9.381 -33.704   7.343
   11    HE3  MET   1           1HE      MET   1  -8.829 -33.062   8.892
   12    HA   PRO   2           HA       PRO   2   0.567 -33.186   8.403
   13    HB2  PRO   2           2HB      PRO   2   0.883 -35.202   6.628
   14    HB3  PRO   2           1HB      PRO   2   0.770 -35.475   8.370
   15    HG2  PRO   2           2HG      PRO   2  -1.338 -35.768   6.266
   16    HG3  PRO   2           1HG      PRO   2  -0.967 -36.833   7.635
   17    HD2  PRO   2           2HD      PRO   2  -3.013 -35.038   7.656
   18    HD3  PRO   2           1HD      PRO   2  -2.142 -35.532   9.122
   19    H    THR   3           HN       THR   3  -2.067 -32.846   6.305
   20    HA   THR   3           HA       THR   3  -0.572 -32.214   3.935
   21    HB   THR   3           HB       THR   3  -3.001 -31.270   3.363
   22    HG1  THR   3           1HG      THR   3  -4.403 -31.725   4.878
   23   HG21  THR   3          3HG2      THR   3  -1.905 -33.144   2.229
   24   HG22  THR   3          1HG2      THR   3  -3.599 -33.513   2.562
   25   HG23  THR   3          2HG2      THR   3  -2.331 -34.209   3.569
   26    H    PHE   4           HN       PHE   4  -0.145 -30.196   3.105
   27    HA   PHE   4           HA       PHE   4  -0.354 -28.018   5.028
   28    HB2  PHE   4           2HB      PHE   4   1.491 -28.581   2.763
   29    HB3  PHE   4           1HB      PHE   4   1.369 -26.974   3.446
   30    HD1  PHE   4           2HD      PHE   4   2.309 -30.465   4.135
   31    HD2  PHE   4           1HD      PHE   4   2.338 -26.450   5.559
   32    HE1  PHE   4           2HE      PHE   4   3.878 -31.109   5.919
   33    HE2  PHE   4           1HE      PHE   4   3.903 -27.090   7.344
   34    HZ   PHE   4           HZ       PHE   4   4.676 -29.422   7.525
   35    H    ASP   5           HN       ASP   5  -1.138 -26.034   4.499
   36    HA   ASP   5           HA       ASP   5  -2.490 -25.693   1.947
   37    HB2  ASP   5           2HB      ASP   5  -4.234 -26.685   3.215
   38    HB3  ASP   5           1HB      ASP   5  -3.821 -25.762   4.651
   39    H    HIS   6           HN       HIS   6  -1.071 -24.056   1.485
   40    HA   HIS   6           HA       HIS   6  -0.744 -21.798   3.227
   41    HB2  HIS   6           2HB      HIS   6   0.599 -20.828   1.537
   42    HB3  HIS   6           1HB      HIS   6   0.916 -22.552   1.415
   43    HD1  HIS   6           1HD      HIS   6  -0.148 -23.797  -0.674
   44    HD2  HIS   6           2HD      HIS   6  -0.454 -19.648  -0.720
   45    HE1  HIS   6           1HE      HIS   6  -0.754 -23.183  -3.039
   46    HE2  HIS   6           2HE      HIS   6  -0.999 -20.672  -3.031
   47    H    GLY   7           HN       GLY   7  -1.695 -19.762   3.047
   48    HA2  GLY   7           2HA      GLY   7  -4.233 -19.833   1.548
   49    HA3  GLY   7           1HA      GLY   7  -4.012 -19.005   3.082
   50    H    ASN   8           HN       ASN   8  -5.136 -17.591   1.200
   51    HA   ASN   8           HA       ASN   8  -3.012 -15.751   0.318
   52    HB2  ASN   8           2HB      ASN   8  -5.683 -15.984  -1.055
   53    HB3  ASN   8           1HB      ASN   8  -4.228 -15.200  -1.644
   54   HD21  ASN   8          1HD2      ASN   8  -2.661 -16.399  -2.656
   55   HD22  ASN   8          2HD2      ASN   8  -2.883 -18.059  -3.103
   56    H    LEU   9           HN       LEU   9  -3.385 -13.598   0.714
   57    HA   LEU   9           HA       LEU   9  -5.926 -12.707   1.768
   58    HB2  LEU   9           2HB      LEU   9  -4.807 -13.668   3.748
   59    HB3  LEU   9           1HB      LEU   9  -3.433 -12.616   3.476
   60    HG   LEU   9           HG       LEU   9  -4.910 -10.650   3.861
   61   HD11  LEU   9          1HD1      LEU   9  -7.107 -10.992   4.854
   62   HD12  LEU   9          2HD1      LEU   9  -6.933 -12.738   4.666
   63   HD13  LEU   9          3HD1      LEU   9  -7.033 -11.704   3.240
   64   HD21  LEU   9          3HD2      LEU   9  -3.536 -11.556   5.663
   65   HD22  LEU   9          1HD2      LEU   9  -4.824 -12.682   6.090
   66   HD23  LEU   9          2HD2      LEU   9  -5.069 -10.947   6.286
   67    H    SER  10           HN       SER  10  -6.261 -10.742   0.960
   68    HA   SER  10           HA       SER  10  -3.921  -9.275  -0.008
   69    HB2  SER  10           2HB      SER  10  -5.806  -8.061  -1.365
   70    HB3  SER  10           1HB      SER  10  -5.247  -9.659  -1.867
   71    HG   SER  10           HG       SER  10  -7.687  -8.871  -0.815
   72    H    LEU  11           HN       LEU  11  -3.413  -7.340   0.750
   73    HA   LEU  11           HA       LEU  11  -4.899  -6.179   2.916
   74    HB2  LEU  11           2HB      LEU  11  -2.557  -5.088   1.345
   75    HB3  LEU  11           1HB      LEU  11  -3.199  -4.390   2.820
   76    HG   LEU  11           HG       LEU  11  -1.874  -7.094   2.563
   77   HD11  LEU  11          1HD1      LEU  11  -0.961  -4.552   3.901
   78   HD12  LEU  11          2HD1      LEU  11  -0.314  -5.232   2.408
   79   HD13  LEU  11          3HD1      LEU  11  -0.116  -6.101   3.930
   80   HD21  LEU  11          3HD2      LEU  11  -2.047  -7.211   4.993
   81   HD22  LEU  11          1HD2      LEU  11  -3.644  -7.124   4.250
   82   HD23  LEU  11          2HD2      LEU  11  -2.946  -5.693   5.011
   83    H    GLY  12           HN       GLY  12  -4.811  -5.885  -0.498
   84    HA2  GLY  12           2HA      GLY  12  -6.628  -5.001  -1.714
   85    HA3  GLY  12           1HA      GLY  12  -7.037  -4.002  -0.328
   86    H    GLU  13           HN       GLU  13  -7.219  -2.579  -2.385
   87    HA   GLU  13           HA       GLU  13  -4.826  -1.390  -3.330
   88    HB2  GLU  13           2HB      GLU  13  -7.620  -0.238  -3.311
   89    HB3  GLU  13           1HB      GLU  13  -6.283   0.260  -4.341
   90    HG2  GLU  13           2HG      GLU  13  -7.332  -1.076  -5.811
   91    HG3  GLU  13           1HG      GLU  13  -6.371  -2.310  -5.016
   92    H    LEU  14           HN       LEU  14  -3.496  -0.469  -1.946
   93    HA   LEU  14           HA       LEU  14  -4.565   1.192   0.223
   94    HB2  LEU  14           2HB      LEU  14  -1.776   0.111  -0.221
   95    HB3  LEU  14           1HB      LEU  14  -2.283   1.060   1.165
   96    HG   LEU  14           HG       LEU  14  -3.313  -1.687   0.445
   97   HD11  LEU  14          1HD1      LEU  14  -2.080  -2.419   2.419
   98   HD12  LEU  14          2HD1      LEU  14  -1.452  -0.786   2.637
   99   HD13  LEU  14          3HD1      LEU  14  -1.001  -1.721   1.210
  100   HD21  LEU  14          3HD2      LEU  14  -5.006  -0.349   1.570
  101   HD22  LEU  14          1HD2      LEU  14  -3.859   0.053   2.848
  102   HD23  LEU  14          2HD2      LEU  14  -4.395  -1.613   2.636
  103    H    GLU  15           HN       GLU  15  -3.154   3.131   0.750
  104    HA   GLU  15           HA       GLU  15  -2.947   4.749  -1.648
  105    HB2  GLU  15           2HB      GLU  15  -2.426   5.578   1.211
  106    HB3  GLU  15           1HB      GLU  15  -2.766   6.626  -0.157
  107    HG2  GLU  15           2HG      GLU  15  -5.028   5.783  -0.281
  108    HG3  GLU  15           1HG      GLU  15  -4.702   4.655   1.036
  109    H    LEU  16           HN       LEU  16  -1.063   5.415  -2.576
  110    HA   LEU  16           HA       LEU  16   1.437   4.469  -1.431
  111    HB2  LEU  16           2HB      LEU  16   1.105   4.247  -3.846
  112    HB3  LEU  16           1HB      LEU  16   0.882   5.981  -3.988
  113    HG   LEU  16           HG       LEU  16   3.223   6.310  -3.222
  114   HD11  LEU  16          1HD1      LEU  16   3.513   4.250  -1.973
  115   HD12  LEU  16          2HD1      LEU  16   4.745   4.398  -3.227
  116   HD13  LEU  16          3HD1      LEU  16   3.376   3.310  -3.460
  117   HD21  LEU  16          3HD2      LEU  16   2.898   4.552  -5.646
  118   HD22  LEU  16          1HD2      LEU  16   4.277   5.597  -5.304
  119   HD23  LEU  16          2HD2      LEU  16   2.686   6.302  -5.594
  120    H    THR  17           HN       THR  17   2.400   5.647   0.060
  121    HA   THR  17           HA       THR  17   1.845   8.505   0.245
  122    HB   THR  17           HB       THR  17   3.483   6.785   2.119
  123    HG1  THR  17           1HG      THR  17   1.225   6.101   1.789
  124   HG21  THR  17          3HG2      THR  17   3.819   9.188   2.401
  125   HG22  THR  17          1HG2      THR  17   2.920   8.526   3.766
  126   HG23  THR  17          2HG2      THR  17   2.076   9.434   2.512
  127    H    VAL  18           HN       VAL  18   3.350  10.083  -0.119
  128    HA   VAL  18           HA       VAL  18   6.003   9.158  -1.019
  129    HB   VAL  18           HB       VAL  18   4.572  11.712  -1.774
  130   HG11  VAL  18          1HG1      VAL  18   6.371  11.997  -3.407
  131   HG12  VAL  18          2HG1      VAL  18   7.167  10.555  -2.779
  132   HG13  VAL  18          3HG1      VAL  18   6.993  11.980  -1.757
  133   HG21  VAL  18          3HG2      VAL  18   5.050   9.194  -3.369
  134   HG22  VAL  18          1HG2      VAL  18   4.383  10.696  -4.014
  135   HG23  VAL  18          2HG2      VAL  18   3.495   9.789  -2.789
  136    H    LEU  19           HN       LEU  19   7.614   9.601   0.306
  137    HA   LEU  19           HA       LEU  19   7.281  11.649   2.364
  138    HB2  LEU  19           2HB      LEU  19   8.225   9.225   2.670
  139    HB3  LEU  19           1HB      LEU  19   9.701   9.903   2.019
  140    HG   LEU  19           HG       LEU  19   9.685   9.788   4.487
  141   HD11  LEU  19          1HD1      LEU  19  11.068  11.463   3.376
  142   HD12  LEU  19          2HD1      LEU  19  10.458  12.052   4.922
  143   HD13  LEU  19          3HD1      LEU  19   9.724  12.603   3.415
  144   HD21  LEU  19          3HD2      LEU  19   8.269  11.342   5.747
  145   HD22  LEU  19          1HD2      LEU  19   7.324  10.133   4.881
  146   HD23  LEU  19          2HD2      LEU  19   7.435  11.778   4.255
  147    H    TYR  20           HN       TYR  20   7.970  13.649   1.943
  148    HA   TYR  20           HA       TYR  20  10.428  14.076   0.473
  149    HB2  TYR  20           2HB      TYR  20   9.423  15.577  -1.192
  150    HB3  TYR  20           1HB      TYR  20   8.764  13.953  -1.340
  151    HD1  TYR  20           2HD      TYR  20   6.464  13.496  -0.388
  152    HD2  TYR  20           1HD      TYR  20   8.016  17.432  -0.820
  153    HE1  TYR  20           2HE      TYR  20   4.188  14.405  -0.216
  154    HE2  TYR  20           1HE      TYR  20   5.742  18.354  -0.647
  155    HH   TYR  20           HH       TYR  20   3.387  17.554  -1.061
  156    H    ASP  21           HN       ASP  21  10.629  16.634   0.193
  157    HA   ASP  21           HA       ASP  21  10.105  17.696   2.876
  158    HB2  ASP  21           2HB      ASP  21  12.469  17.615   2.170
  159    HB3  ASP  21           1HB      ASP  21  12.086  18.646   0.792
  160    H    GLU  22           HN       GLU  22   8.643  19.205   3.144
  161    HA   GLU  22           HA       GLU  22   6.934  20.176   1.227
  162    HB2  GLU  22           2HB      GLU  22   7.342  20.428   4.004
  163    HB3  GLU  22           1HB      GLU  22   7.204  22.062   3.367
  164    HG2  GLU  22           2HG      GLU  22   5.175  20.956   2.102
  165    HG3  GLU  22           1HG      GLU  22   5.215  19.902   3.506
  166    H    GLU  23           HN       GLU  23   9.959  21.522   2.374
  167    HA   GLU  23           HA       GLU  23   9.463  24.082   1.125
  168    HB2  GLU  23           2HB      GLU  23  11.900  23.036   2.579
  169    HB3  GLU  23           1HB      GLU  23  11.604  24.707   2.124
  170    HG2  GLU  23           2HG      GLU  23   9.743  24.852   3.618
  171    HG3  GLU  23           1HG      GLU  23   9.842  23.131   3.974
  172    H    ARG  24           HN       ARG  24  10.190  21.242  -0.138
  173    HA   ARG  24           HA       ARG  24  12.225  22.277  -1.982
  174    HB2  ARG  24           2HB      ARG  24  11.923  19.766  -0.756
  175    HB3  ARG  24           1HB      ARG  24  11.516  19.515  -2.448
  176    HG2  ARG  24           2HG      ARG  24  13.791  19.108  -2.399
  177    HG3  ARG  24           1HG      ARG  24  13.706  20.786  -2.937
  178    HD2  ARG  24           2HD      ARG  24  14.259  19.832  -0.127
  179    HD3  ARG  24           1HD      ARG  24  15.443  20.492  -1.252
  180    HE   ARG  24           HE       ARG  24  13.426  22.390  -0.933
  181   HH11  ARG  24          1HH1      ARG  24  15.948  20.867   0.945
  182   HH12  ARG  24          2HH1      ARG  24  16.094  22.185   2.064
  183   HH21  ARG  24          1HH2      ARG  24  13.609  24.133   0.531
  184   HH22  ARG  24          2HH2      ARG  24  14.760  24.046   1.833
  185    H    TYR  25           HN       TYR  25   9.570  19.940  -2.394
  186    HA   TYR  25           HA       TYR  25   8.381  21.559  -4.492
  187    HB2  TYR  25           2HB      TYR  25   9.447  18.772  -5.020
  188    HB3  TYR  25           1HB      TYR  25   8.468  19.712  -6.131
  189    HD1  TYR  25           2HD      TYR  25   9.454  21.976  -6.925
  190    HD2  TYR  25           1HD      TYR  25  11.770  18.903  -5.104
  191    HE1  TYR  25           2HE      TYR  25  11.496  22.956  -7.878
  192    HE2  TYR  25           1HE      TYR  25  13.819  19.880  -6.049
  193    HH   TYR  25           HH       TYR  25  14.374  21.385  -8.121
  194    H    ASP  26           HN       ASP  26   6.479  20.037  -5.476
  195    HA   ASP  26           HA       ASP  26   5.358  18.402  -3.314
  196    HB2  ASP  26           2HB      ASP  26   4.315  20.679  -3.250
  197    HB3  ASP  26           1HB      ASP  26   3.716  20.402  -4.883
  198    H    ILE  27           HN       ILE  27   3.537  17.042  -4.087
  199    HA   ILE  27           HA       ILE  27   4.531  15.539  -6.321
  200    HB   ILE  27           HB       ILE  27   1.960  15.018  -4.839
  201   HG12  ILE  27          2HG1      ILE  27   4.720  14.063  -4.056
  202   HG13  ILE  27          1HG1      ILE  27   3.867  15.374  -3.250
  203   HG21  ILE  27          1HG2      ILE  27   2.327  13.694  -6.837
  204   HG22  ILE  27          2HG2      ILE  27   2.478  12.681  -5.402
  205   HG23  ILE  27          3HG2      ILE  27   3.923  13.220  -6.259
  206   HD11  ILE  27          3HD1      ILE  27   2.091  13.829  -2.622
  207   HD12  ILE  27          1HD1      ILE  27   3.661  13.304  -2.013
  208   HD13  ILE  27          2HD1      ILE  27   2.954  12.516  -3.424
  209    H    VAL  28           HN       VAL  28   4.072  16.083  -8.341
  210    HA   VAL  28           HA       VAL  28   1.558  17.394  -9.004
  211    HB   VAL  28           HB       VAL  28   3.966  16.705 -10.697
  212   HG11  VAL  28          1HG1      VAL  28   2.961  18.122 -12.418
  213   HG12  VAL  28          2HG1      VAL  28   1.518  18.315 -11.422
  214   HG13  VAL  28          3HG1      VAL  28   1.943  16.728 -12.063
  215   HG21  VAL  28          3HG2      VAL  28   2.970  19.320  -9.573
  216   HG22  VAL  28          1HG2      VAL  28   4.341  19.135 -10.666
  217   HG23  VAL  28          2HG2      VAL  28   4.401  18.433  -9.050
  218    H    GLU  29           HN       GLU  29   3.338  14.466  -9.979
  219    HA   GLU  29           HA       GLU  29   0.781  13.113 -10.249
  220    HB2  GLU  29           2HB      GLU  29   1.400  12.070 -12.388
  221    HB3  GLU  29           1HB      GLU  29   1.241  13.812 -12.529
  222    HG2  GLU  29           2HG      GLU  29   3.226  13.860 -13.489
  223    HG3  GLU  29           1HG      GLU  29   3.937  13.355 -11.958
  224    H    GLN  30           HN       GLN  30   0.987  10.779 -10.212
  225    HA   GLN  30           HA       GLN  30   3.381   9.507  -9.405
  226    HB2  GLN  30           2HB      GLN  30   3.113   9.359  -7.050
  227    HB3  GLN  30           1HB      GLN  30   2.906  11.060  -7.431
  228    HG2  GLN  30           2HG      GLN  30   0.648   9.119  -6.967
  229    HG3  GLN  30           1HG      GLN  30   1.305  10.206  -5.749
  230   HE21  GLN  30          1HE2      GLN  30  -1.390   9.987  -6.896
  231   HE22  GLN  30          2HE2      GLN  30  -1.765  11.556  -7.514
  232    H    THR  31           HN       THR  31   2.668   7.402  -8.069
  233    HA   THR  31           HA       THR  31   0.423   6.215  -9.472
  234    HB   THR  31           HB       THR  31   2.234   5.005  -7.368
  235    HG1  THR  31           1HG      THR  31   2.617   5.576 -10.026
  236   HG21  THR  31          3HG2      THR  31   0.401   3.723  -9.402
  237   HG22  THR  31          1HG2      THR  31   0.150   3.768  -7.655
  238   HG23  THR  31          2HG2      THR  31   1.502   2.860  -8.330
  239    H    GLU  32           HN       GLU  32  -1.558   6.595  -8.707
  240    HA   GLU  32           HA       GLU  32  -2.071   7.820  -6.241
  241    HB2  GLU  32           2HB      GLU  32  -3.993   6.322  -8.030
  242    HB3  GLU  32           1HB      GLU  32  -4.448   7.441  -6.756
  243    HG2  GLU  32           2HG      GLU  32  -4.652   8.717  -8.659
  244    HG3  GLU  32           1HG      GLU  32  -3.055   9.163  -8.071
  245    H    THR  33           HN       THR  33  -2.832   4.483  -7.261
  246    HA   THR  33           HA       THR  33  -2.913   3.751  -4.416
  247    HB   THR  33           HB       THR  33  -4.744   2.081  -5.152
  248    HG1  THR  33           1HG      THR  33  -5.510   3.978  -7.047
  249   HG21  THR  33          3HG2      THR  33  -6.517   3.758  -4.780
  250   HG22  THR  33          1HG2      THR  33  -5.329   5.043  -5.002
  251   HG23  THR  33          2HG2      THR  33  -5.186   3.934  -3.637
  252    H    VAL  34           HN       VAL  34  -2.385   1.599  -3.913
  253    HA   VAL  34           HA       VAL  34  -1.097   0.068  -6.088
  254    HB   VAL  34           HB       VAL  34  -0.213   0.125  -3.205
  255   HG11  VAL  34          1HG1      VAL  34   1.742  -1.083  -3.994
  256   HG12  VAL  34          2HG1      VAL  34   1.066  -1.102  -5.623
  257   HG13  VAL  34          3HG1      VAL  34   0.250  -1.965  -4.320
  258   HG21  VAL  34          3HG2      VAL  34   1.055   1.485  -5.578
  259   HG22  VAL  34          1HG2      VAL  34   1.753   1.387  -3.962
  260   HG23  VAL  34          2HG2      VAL  34   0.259   2.285  -4.224
  261    H    GLN  35           HN       GLN  35  -1.405  -2.175  -6.016
  262    HA   GLN  35           HA       GLN  35  -3.413  -3.093  -4.084
  263    HB2  GLN  35           2HB      GLN  35  -3.991  -3.416  -6.449
  264    HB3  GLN  35           1HB      GLN  35  -2.519  -4.349  -6.687
  265    HG2  GLN  35           2HG      GLN  35  -3.312  -6.094  -5.266
  266    HG3  GLN  35           1HG      GLN  35  -4.703  -5.131  -4.771
  267   HE21  GLN  35          1HE2      GLN  35  -3.287  -7.026  -7.307
  268   HE22  GLN  35          2HE2      GLN  35  -4.716  -7.184  -8.262
  269    H    VAL  36           HN       VAL  36  -2.795  -4.310  -2.456
  270    HA   VAL  36           HA       VAL  36  -0.194  -5.701  -2.643
  271    HB   VAL  36           HB       VAL  36  -1.493  -4.725  -0.096
  272   HG11  VAL  36          1HG1      VAL  36   1.305  -5.687  -0.691
  273   HG12  VAL  36          2HG1      VAL  36   0.062  -6.581   0.183
  274   HG13  VAL  36          3HG1      VAL  36   0.730  -5.100   0.868
  275   HG21  VAL  36          3HG2      VAL  36   0.686  -3.405  -1.713
  276   HG22  VAL  36          1HG2      VAL  36   0.160  -2.905  -0.107
  277   HG23  VAL  36          2HG2      VAL  36  -0.952  -2.795  -1.472
  278    H    ASP  37           HN       ASP  37  -0.201  -7.824  -2.371
  279    HA   ASP  37           HA       ASP  37  -2.459  -9.121  -1.005
  280    HB2  ASP  37           2HB      ASP  37  -2.954  -9.302  -3.374
  281    HB3  ASP  37           1HB      ASP  37  -1.330  -9.892  -3.703
  282    H    LEU  38           HN       LEU  38  -1.922 -11.063   0.057
  283    HA   LEU  38           HA       LEU  38   0.975 -11.584   0.241
  284    HB2  LEU  38           2HB      LEU  38  -1.000 -11.546   2.523
  285    HB3  LEU  38           1HB      LEU  38   0.709 -11.913   2.646
  286    HG   LEU  38           HG       LEU  38  -0.436  -9.238   1.829
  287   HD11  LEU  38          1HD1      LEU  38  -0.876  -9.766   4.177
  288   HD12  LEU  38          2HD1      LEU  38   0.315  -8.475   4.018
  289   HD13  LEU  38          3HD1      LEU  38   0.835 -10.111   4.423
  290   HD21  LEU  38          3HD2      LEU  38   1.743  -9.670   0.838
  291   HD22  LEU  38          1HD2      LEU  38   2.392 -10.098   2.421
  292   HD23  LEU  38          2HD2      LEU  38   1.865  -8.445   2.104
  293    H    GLU  39           HN       GLU  39   1.612 -13.674   0.427
  294    HA   GLU  39           HA       GLU  39  -0.471 -15.733   0.757
  295    HB2  GLU  39           2HB      GLU  39   1.798 -15.611  -1.191
  296    HB3  GLU  39           1HB      GLU  39   1.250 -17.173  -0.603
  297    HG2  GLU  39           2HG      GLU  39  -0.948 -16.789  -1.458
  298    HG3  GLU  39           1HG      GLU  39  -0.529 -15.138  -1.897
  299    H    GLY  40           HN       GLY  40  -0.043 -17.345   2.171
  300    HA2  GLY  40           2HA      GLY  40   2.496 -18.115   3.087
  301    HA3  GLY  40           1HA      GLY  40   1.889 -16.879   4.176
  302    HA   PRO  41           HA       PRO  41   0.348 -21.114   5.507
  303    HB2  PRO  41           2HB      PRO  41   1.443 -20.283   8.106
  304    HB3  PRO  41           1HB      PRO  41   1.696 -21.785   7.213
  305    HG2  PRO  41           2HG      PRO  41   3.637 -19.941   7.466
  306    HG3  PRO  41           1HG      PRO  41   3.456 -20.917   5.993
  307    HD2  PRO  41           2HD      PRO  41   2.621 -18.085   6.512
  308    HD3  PRO  41           1HD      PRO  41   3.375 -18.792   5.067
  309    H    ARG  42           HN       ARG  42  -1.406 -21.534   6.893
  310    HA   ARG  42           HA       ARG  42  -3.290 -19.481   7.104
  311    HB2  ARG  42           2HB      ARG  42  -3.193 -22.152   8.512
  312    HB3  ARG  42           1HB      ARG  42  -4.598 -21.099   8.474
  313    HG2  ARG  42           2HG      ARG  42  -3.285 -22.312   6.054
  314    HG3  ARG  42           1HG      ARG  42  -4.736 -22.929   6.847
  315    HD2  ARG  42           2HD      ARG  42  -5.929 -20.891   6.340
  316    HD3  ARG  42           1HD      ARG  42  -4.470 -20.168   5.662
  317    HE   ARG  42           HE       ARG  42  -5.055 -22.586   4.319
  318   HH11  ARG  42          1HH1      ARG  42  -6.284 -19.323   4.634
  319   HH12  ARG  42          2HH1      ARG  42  -6.879 -19.246   3.004
  320   HH21  ARG  42          1HH2      ARG  42  -5.812 -22.507   2.180
  321   HH22  ARG  42          2HH2      ARG  42  -6.591 -21.065   1.588
  322    H    GLY  43           HN       GLY  43  -1.074 -20.838   9.497
  323    HA2  GLY  43           2HA      GLY  43  -2.126 -19.692  11.806
  324    HA3  GLY  43           1HA      GLY  43  -0.434 -20.098  11.574
  325    H    VAL  44           HN       VAL  44   0.358 -18.330   9.638
  326    HA   VAL  44           HA       VAL  44   0.732 -15.994  11.202
  327    HB   VAL  44           HB       VAL  44   1.361 -16.393   8.268
  328   HG11  VAL  44          1HG1      VAL  44   2.387 -14.352  10.235
  329   HG12  VAL  44          2HG1      VAL  44   1.303 -14.037   8.881
  330   HG13  VAL  44          3HG1      VAL  44   2.961 -14.561   8.582
  331   HG21  VAL  44          3HG2      VAL  44   3.676 -16.795   9.093
  332   HG22  VAL  44          1HG2      VAL  44   2.523 -18.045   9.565
  333   HG23  VAL  44          2HG2      VAL  44   3.035 -16.830  10.736
  334    H    LEU  45           HN       LEU  45  -1.174 -16.642   8.276
  335    HA   LEU  45           HA       LEU  45  -1.976 -13.992   7.810
  336    HB2  LEU  45           2HB      LEU  45  -3.311 -16.585   7.049
  337    HB3  LEU  45           1HB      LEU  45  -3.784 -15.009   6.442
  338    HG   LEU  45           HG       LEU  45  -1.089 -16.305   6.001
  339   HD11  LEU  45          1HD1      LEU  45  -3.414 -15.888   4.122
  340   HD12  LEU  45          2HD1      LEU  45  -2.866 -17.433   4.773
  341   HD13  LEU  45          3HD1      LEU  45  -1.828 -16.522   3.678
  342   HD21  LEU  45          3HD2      LEU  45  -0.954 -13.867   6.074
  343   HD22  LEU  45          1HD2      LEU  45  -2.261 -13.751   4.897
  344   HD23  LEU  45          2HD2      LEU  45  -0.716 -14.463   4.430
  345    H    THR  46           HN       THR  46  -3.556 -16.598   9.634
  346    HA   THR  46           HA       THR  46  -5.957 -15.200  10.131
  347    HB   THR  46           HB       THR  46  -4.748 -17.395  11.830
  348    HG1  THR  46           1HG      THR  46  -4.883 -18.332   9.876
  349   HG21  THR  46          3HG2      THR  46  -6.679 -16.254  12.838
  350   HG22  THR  46          1HG2      THR  46  -7.081 -17.906  12.371
  351   HG23  THR  46          2HG2      THR  46  -7.617 -16.554  11.373
  352    H    VAL  47           HN       VAL  47  -2.977 -15.550  12.055
  353    HA   VAL  47           HA       VAL  47  -3.869 -14.040  14.271
  354    HB   VAL  47           HB       VAL  47  -1.049 -14.521  13.276
  355   HG11  VAL  47          1HG1      VAL  47  -1.094 -12.561  14.711
  356   HG12  VAL  47          2HG1      VAL  47  -0.346 -13.914  15.560
  357   HG13  VAL  47          3HG1      VAL  47  -2.006 -13.451  15.931
  358   HG21  VAL  47          3HG2      VAL  47  -2.200 -16.575  13.859
  359   HG22  VAL  47          1HG2      VAL  47  -2.687 -15.887  15.410
  360   HG23  VAL  47          2HG2      VAL  47  -0.984 -16.203  15.079
  361    H    PHE  48           HN       PHE  48  -2.160 -13.160  11.302
  362    HA   PHE  48           HA       PHE  48  -1.754 -10.442  11.927
  363    HB2  PHE  48           2HB      PHE  48  -0.591 -11.621  10.088
  364    HB3  PHE  48           1HB      PHE  48  -2.109 -11.723   9.203
  365    HD1  PHE  48           1HD      PHE  48   0.347  -9.322  10.601
  366    HD2  PHE  48           2HD      PHE  48  -2.796  -9.980   7.811
  367    HE1  PHE  48           1HE      PHE  48   0.812  -7.141   9.566
  368    HE2  PHE  48           2HE      PHE  48  -2.338  -7.796   6.771
  369    HZ   PHE  48           HZ       PHE  48  -0.532  -6.374   7.653
  370    H    ARG  49           HN       ARG  49  -4.524 -12.203  10.753
  371    HA   ARG  49           HA       ARG  49  -5.995  -9.939   9.877
  372    HB2  ARG  49           2HB      ARG  49  -6.327 -12.798   9.974
  373    HB3  ARG  49           1HB      ARG  49  -7.795 -11.994  10.506
  374    HG2  ARG  49           2HG      ARG  49  -6.347 -11.532   7.911
  375    HG3  ARG  49           1HG      ARG  49  -7.867 -12.396   8.131
  376    HD2  ARG  49           2HD      ARG  49  -8.918 -10.349   8.958
  377    HD3  ARG  49           1HD      ARG  49  -7.397  -9.482   8.756
  378    HE   ARG  49           HE       ARG  49  -8.953 -10.629   6.521
  379   HH11  ARG  49          1HH1      ARG  49  -6.864  -8.140   7.873
  380   HH12  ARG  49          2HH1      ARG  49  -6.877  -7.186   6.420
  381   HH21  ARG  49          1HH2      ARG  49  -8.966  -9.354   4.630
  382   HH22  ARG  49          2HH2      ARG  49  -8.063  -7.863   4.591
  383    H    PHE  50           HN       PHE  50  -5.329 -11.204  12.982
  384    HA   PHE  50           HA       PHE  50  -7.684 -10.208  14.268
  385    HB2  PHE  50           2HB      PHE  50  -5.009 -11.183  15.236
  386    HB3  PHE  50           1HB      PHE  50  -6.176 -10.475  16.334
  387    HD1  PHE  50           1HD      PHE  50  -8.657 -11.517  15.956
  388    HD2  PHE  50           2HD      PHE  50  -4.960 -13.457  15.154
  389    HE1  PHE  50           1HE      PHE  50  -9.761 -13.705  16.188
  390    HE2  PHE  50           2HE      PHE  50  -6.055 -15.648  15.379
  391    HZ   PHE  50           HZ       PHE  50  -8.455 -15.775  15.896
  392    H    ALA  51           HN       ALA  51  -4.709  -8.902  13.209
  393    HA   ALA  51           HA       ALA  51  -4.891  -6.558  14.919
  394    HB1  ALA  51           1HB      ALA  51  -2.694  -7.596  14.591
  395    HB2  ALA  51           2HB      ALA  51  -2.728  -5.945  13.975
  396    HB3  ALA  51           3HB      ALA  51  -2.818  -7.306  12.858
  397    H    ARG  52           HN       ARG  52  -5.315  -4.531  14.201
  398    HA   ARG  52           HA       ARG  52  -6.561  -4.249  11.613
  399    HB2  ARG  52           2HB      ARG  52  -6.252  -2.493  14.020
  400    HB3  ARG  52           1HB      ARG  52  -6.840  -1.851  12.504
  401    HG2  ARG  52           2HG      ARG  52  -8.587  -3.688  12.569
  402    HG3  ARG  52           1HG      ARG  52  -8.094  -3.940  14.243
  403    HD2  ARG  52           2HD      ARG  52  -9.049  -1.318  13.109
  404    HD3  ARG  52           1HD      ARG  52 -10.065  -2.457  13.990
  405    HE   ARG  52           HE       ARG  52  -7.844  -1.863  15.590
  406   HH11  ARG  52          1HH1      ARG  52 -10.606  -0.224  14.205
  407   HH12  ARG  52          2HH1      ARG  52 -10.800   0.870  15.542
  408   HH21  ARG  52          1HH2      ARG  52  -8.084  -0.422  17.367
  409   HH22  ARG  52          2HH2      ARG  52  -9.363   0.753  17.345
  410    HA   PRO  53           HA       PRO  53  -3.205  -2.632   9.386
  411    HB2  PRO  53           2HB      PRO  53  -4.623  -0.215   8.569
  412    HB3  PRO  53           1HB      PRO  53  -4.057  -1.562   7.587
  413    HG2  PRO  53           2HG      PRO  53  -6.677  -1.146   8.084
  414    HG3  PRO  53           1HG      PRO  53  -5.993  -2.768   7.877
  415    HD2  PRO  53           2HD      PRO  53  -6.783  -1.346  10.378
  416    HD3  PRO  53           1HD      PRO  53  -6.929  -3.066   9.964
  417    H    SER  54           HN       SER  54  -1.489  -1.842  10.340
  418    HA   SER  54           HA       SER  54  -1.464   0.959  11.161
  419    HB2  SER  54           2HB      SER  54   0.418   0.126  12.676
  420    HB3  SER  54           1HB      SER  54  -1.218  -0.297  13.140
  421    HG   SER  54           HG       SER  54   0.672  -1.962  12.959
  422    H    TYR  55           HN       TYR  55  -0.720  -1.005   8.839
  423    HA   TYR  55           HA       TYR  55   2.090  -0.455   8.477
  424    HB2  TYR  55           2HB      TYR  55   1.666  -1.809   6.311
  425    HB3  TYR  55           1HB      TYR  55   1.598  -2.649   7.855
  426    HD1  TYR  55           1HD      TYR  55  -0.507  -1.171   5.171
  427    HD2  TYR  55           2HD      TYR  55  -0.354  -3.763   8.544
  428    HE1  TYR  55           1HE      TYR  55  -2.759  -2.000   4.631
  429    HE2  TYR  55           2HE      TYR  55  -2.603  -4.597   8.012
  430    HH   TYR  55           HH       TYR  55  -4.145  -3.989   5.055
  431    H    GLU  56           HN       GLU  56   2.920   0.402   6.491
  432    HA   GLU  56           HA       GLU  56   1.138   2.177   5.011
  433    HB2  GLU  56           2HB      GLU  56   1.978   3.473   6.945
  434    HB3  GLU  56           1HB      GLU  56   3.628   3.143   6.436
  435    HG2  GLU  56           2HG      GLU  56   3.287   4.415   4.406
  436    HG3  GLU  56           1HG      GLU  56   1.592   4.669   4.822
  437    H    VAL  57           HN       VAL  57   1.818   2.623   2.962
  438    HA   VAL  57           HA       VAL  57   4.359   1.412   2.089
  439    HB   VAL  57           HB       VAL  57   1.851   1.857   0.441
  440   HG11  VAL  57          1HG1      VAL  57   4.441   0.484  -0.273
  441   HG12  VAL  57          2HG1      VAL  57   3.889   2.041  -0.888
  442   HG13  VAL  57          3HG1      VAL  57   3.004   0.570  -1.292
  443   HG21  VAL  57          3HG2      VAL  57   1.549   0.060   2.058
  444   HG22  VAL  57          1HG2      VAL  57   3.034  -0.708   1.499
  445   HG23  VAL  57          2HG2      VAL  57   1.647  -0.580   0.419
  446    H    PHE  58           HN       PHE  58   5.842   2.833   1.251
  447    HA   PHE  58           HA       PHE  58   4.960   5.437   0.336
  448    HB2  PHE  58           2HB      PHE  58   6.353   6.652   1.997
  449    HB3  PHE  58           1HB      PHE  58   4.986   5.814   2.719
  450    HD1  PHE  58           2HD      PHE  58   5.348   3.778   4.059
  451    HD2  PHE  58           1HD      PHE  58   8.604   6.065   2.535
  452    HE1  PHE  58           2HE      PHE  58   6.864   2.671   5.644
  453    HE2  PHE  58           1HE      PHE  58  10.123   4.957   4.123
  454    HZ   PHE  58           HZ       PHE  58   9.253   3.257   5.682
  455    H    VAL  59           HN       VAL  59   6.697   6.767  -0.484
  456    HA   VAL  59           HA       VAL  59   9.180   5.284  -1.059
  457    HB   VAL  59           HB       VAL  59   9.317   6.537  -3.219
  458   HG11  VAL  59          1HG1      VAL  59   8.537   4.220  -3.128
  459   HG12  VAL  59          2HG1      VAL  59   7.741   5.121  -4.416
  460   HG13  VAL  59          3HG1      VAL  59   6.880   4.787  -2.913
  461   HG21  VAL  59          3HG2      VAL  59   7.274   7.545  -4.129
  462   HG22  VAL  59          1HG2      VAL  59   7.822   8.383  -2.676
  463   HG23  VAL  59          2HG2      VAL  59   6.458   7.267  -2.589
  464    H    ASP  60           HN       ASP  60  11.087   6.427  -0.846
  465    HA   ASP  60           HA       ASP  60  10.827   8.941   0.631
  466    HB2  ASP  60           2HB      ASP  60  12.138   7.069   1.618
  467    HB3  ASP  60           1HB      ASP  60  13.262   7.179   0.269
  468    H    LEU  61           HN       LEU  61  10.923  10.732  -0.559
  469    HA   LEU  61           HA       LEU  61  12.929  10.859  -2.704
  470    HB2  LEU  61           2HB      LEU  61  10.075  11.826  -2.872
  471    HB3  LEU  61           1HB      LEU  61  11.313  12.147  -4.070
  472    HG   LEU  61           HG       LEU  61  10.356   9.383  -3.325
  473   HD11  LEU  61          1HD1      LEU  61   9.169   9.411  -5.451
  474   HD12  LEU  61          2HD1      LEU  61   9.653  11.090  -5.707
  475   HD13  LEU  61          3HD1      LEU  61   8.574  10.675  -4.373
  476   HD21  LEU  61          3HD2      LEU  61  12.086  10.369  -5.591
  477   HD22  LEU  61          1HD2      LEU  61  11.530   8.709  -5.362
  478   HD23  LEU  61          2HD2      LEU  61  12.633   9.439  -4.194
  479    H    THR  62           HN       THR  62  14.049  11.905  -0.839
  480    HA   THR  62           HA       THR  62  13.334  14.746  -0.630
  481    HB   THR  62           HB       THR  62  15.222  14.730   1.118
  482    HG1  THR  62           1HG      THR  62  16.200  12.891   1.432
  483   HG21  THR  62          3HG2      THR  62  12.853  14.845   1.719
  484   HG22  THR  62          1HG2      THR  62  13.750  13.847   2.865
  485   HG23  THR  62          2HG2      THR  62  12.743  13.087   1.634
  486    H    GLU  63           HN       GLU  63  15.760  12.493  -1.729
  487    HA   GLU  63           HA       GLU  63  17.643  14.426  -2.633
  488    HB2  GLU  63           2HB      GLU  63  17.157  11.522  -3.228
  489    HB3  GLU  63           1HB      GLU  63  18.435  12.436  -4.022
  490    HG2  GLU  63           2HG      GLU  63  18.206  12.343  -1.044
  491    HG3  GLU  63           1HG      GLU  63  19.025  11.078  -1.952
  492    H    ALA  64           HN       ALA  64  14.991  12.675  -4.080
  493    HA   ALA  64           HA       ALA  64  15.459  13.664  -6.728
  494    HB1  ALA  64           1HB      ALA  64  14.416  11.491  -6.377
  495    HB2  ALA  64           2HB      ALA  64  13.341  12.560  -7.279
  496    HB3  ALA  64           3HB      ALA  64  13.053  12.263  -5.563
  497    H    GLY  65           HN       GLY  65  14.672  15.445  -7.665
  498    HA2  GLY  65           2HA      GLY  65  12.534  16.910  -6.252
  499    HA3  GLY  65           1HA      GLY  65  13.929  17.731  -6.936
  500    H    GLU  66           HN       GLU  66  13.841  18.402  -8.972
  501    HA   GLU  66           HA       GLU  66  11.355  18.307 -10.349
  502    HB2  GLU  66           2HB      GLU  66  12.564  19.570 -12.125
  503    HB3  GLU  66           1HB      GLU  66  12.664  20.300 -10.536
  504    HG2  GLU  66           2HG      GLU  66  14.838  18.558 -11.659
  505    HG3  GLU  66           1HG      GLU  66  14.772  20.296 -11.934
  506    H    GLY  67           HN       GLY  67  10.904  17.456 -12.386
  507    HA2  GLY  67           2HA      GLY  67  11.015  15.843 -14.048
  508    HA3  GLY  67           1HA      GLY  67  12.640  15.440 -13.518
  509    H    SER  68           HN       SER  68   9.954  13.943 -14.007
  510    HA   SER  68           HA       SER  68   9.247  12.907 -11.459
  511    HB2  SER  68           2HB      SER  68   7.774  12.929 -13.494
  512    HB3  SER  68           1HB      SER  68   8.718  11.584 -14.123
  513    HG   SER  68           HG       SER  68   6.643  11.360 -12.651
  514    H    HIS  69           HN       HIS  69   9.908  11.149 -10.415
  515    HA   HIS  69           HA       HIS  69  12.314   9.839 -11.515
  516    HB2  HIS  69           2HB      HIS  69  11.862  11.031  -8.808
  517    HB3  HIS  69           1HB      HIS  69  12.977   9.682  -8.992
  518    HD1  HIS  69           1HD      HIS  69  12.569  13.311  -9.832
  519    HD2  HIS  69           2HD      HIS  69  15.357  10.268 -10.369
  520    HE1  HIS  69           1HE      HIS  69  14.695  14.453 -10.528
  521    HE2  HIS  69           2HE      HIS  69  16.394  12.610 -10.767
  522    H    THR  70           HN       THR  70  12.343   7.740 -11.551
  523    HA   THR  70           HA       THR  70  10.174   6.275 -10.242
  524    HB   THR  70           HB       THR  70  12.120   5.071 -12.192
  525    HG1  THR  70           1HG      THR  70  11.374   6.957 -13.222
  526   HG21  THR  70          3HG2      THR  70  10.496   3.621 -11.046
  527   HG22  THR  70          1HG2      THR  70  10.188   3.692 -12.779
  528   HG23  THR  70          2HG2      THR  70   9.179   4.614 -11.665
  529    H    VAL  71           HN       VAL  71  10.631   5.384  -8.335
  530    HA   VAL  71           HA       VAL  71  13.328   4.278  -7.871
  531    HB   VAL  71           HB       VAL  71  13.159   4.945  -5.499
  532   HG11  VAL  71          1HG1      VAL  71  13.630   7.330  -5.817
  533   HG12  VAL  71          2HG1      VAL  71  12.967   7.237  -7.449
  534   HG13  VAL  71          3HG1      VAL  71  14.425   6.333  -7.037
  535   HG21  VAL  71          3HG2      VAL  71  10.741   6.521  -6.383
  536   HG22  VAL  71          1HG2      VAL  71  11.506   6.610  -4.797
  537   HG23  VAL  71          2HG2      VAL  71  10.727   5.115  -5.319
  538    H    ASP  72           HN       ASP  72  13.271   2.698  -5.927
  539    HA   ASP  72           HA       ASP  72  11.076   0.881  -6.422
  540    HB2  ASP  72           2HB      ASP  72  12.271  -0.716  -5.078
  541    HB3  ASP  72           1HB      ASP  72  13.417   0.063  -6.162
  542    H    VAL  73           HN       VAL  73   9.754  -0.024  -4.718
  543    HA   VAL  73           HA       VAL  73   8.755   2.214  -3.146
  544    HB   VAL  73           HB       VAL  73   7.487  -0.477  -3.659
  545   HG11  VAL  73          1HG1      VAL  73   5.416   0.602  -2.942
  546   HG12  VAL  73          2HG1      VAL  73   6.303   2.086  -2.592
  547   HG13  VAL  73          3HG1      VAL  73   6.622   0.627  -1.654
  548   HG21  VAL  73          3HG2      VAL  73   7.121   2.181  -5.031
  549   HG22  VAL  73          1HG2      VAL  73   6.103   0.763  -5.288
  550   HG23  VAL  73          2HG2      VAL  73   7.810   0.713  -5.729
  551    H    GLU  74           HN       GLU  74   8.799   2.371  -1.019
  552    HA   GLU  74           HA       GLU  74   9.962   0.180   0.532
  553    HB2  GLU  74           2HB      GLU  74  10.427   2.914   0.523
  554    HB3  GLU  74           1HB      GLU  74   9.428   2.679   1.947
  555    HG2  GLU  74           2HG      GLU  74  11.985   1.201   1.363
  556    HG3  GLU  74           1HG      GLU  74  11.834   2.593   2.432
  557    H    HIS  75           HN       HIS  75   8.965  -0.452   2.551
  558    HA   HIS  75           HA       HIS  75   6.222   0.357   3.029
  559    HB2  HIS  75           2HB      HIS  75   5.347  -1.994   2.866
  560    HB3  HIS  75           1HB      HIS  75   5.781  -1.276   1.319
  561    HD1  HIS  75           1HD      HIS  75   6.933  -3.908   3.767
  562    HD2  HIS  75           2HD      HIS  75   7.808  -2.536  -0.055
  563    HE1  HIS  75           1HE      HIS  75   8.490  -5.616   2.777
  564    HE2  HIS  75           2HE      HIS  75   9.172  -4.637   0.553
  565    H    ARG  76           HN       ARG  76   5.437  -0.313   5.056
  566    HA   ARG  76           HA       ARG  76   7.124  -1.966   6.729
  567    HB2  ARG  76           2HB      ARG  76   7.958   0.511   6.684
  568    HB3  ARG  76           1HB      ARG  76   6.570   0.809   7.721
  569    HG2  ARG  76           2HG      ARG  76   7.441  -0.393   9.468
  570    HG3  ARG  76           1HG      ARG  76   8.463  -1.381   8.419
  571    HD2  ARG  76           2HD      ARG  76   8.862   1.527   9.109
  572    HD3  ARG  76           1HD      ARG  76   9.835   0.166   9.672
  573    HE   ARG  76           HE       ARG  76   9.677   0.961   6.830
  574   HH11  ARG  76          1HH1      ARG  76  11.504  -0.124   9.621
  575   HH12  ARG  76          2HH1      ARG  76  13.013  -0.192   8.748
  576   HH21  ARG  76          1HH2      ARG  76  11.629   0.841   5.689
  577   HH22  ARG  76          2HH2      ARG  76  13.084   0.351   6.518
  578    H    GLY  77           HN       GLY  77   6.121  -2.227   8.928
  579    HA2  GLY  77           2HA      GLY  77   4.147  -2.074  10.296
  580    HA3  GLY  77           1HA      GLY  77   3.209  -1.801   8.830
  581    H    PHE  78           HN       PHE  78   3.513  -3.694   7.178
  582    HA   PHE  78           HA       PHE  78   2.894  -6.144   8.618
  583    HB2  PHE  78           2HB      PHE  78   2.248  -7.029   6.393
  584    HB3  PHE  78           1HB      PHE  78   1.398  -5.544   6.797
  585    HD1  PHE  78           2HD      PHE  78   1.992  -3.433   5.669
  586    HD2  PHE  78           1HD      PHE  78   3.701  -7.159   4.514
  587    HE1  PHE  78           2HE      PHE  78   2.693  -2.445   3.531
  588    HE2  PHE  78           1HE      PHE  78   4.403  -6.174   2.372
  589    HZ   PHE  78           HZ       PHE  78   3.899  -3.814   1.877
  590    HA   PRO  79           HA       PRO  79   6.925  -7.813   8.056
  591    HB2  PRO  79           2HB      PRO  79   5.871 -10.503   8.308
  592    HB3  PRO  79           1HB      PRO  79   6.775  -9.558   9.491
  593    HG2  PRO  79           2HG      PRO  79   4.147 -10.208   9.796
  594    HG3  PRO  79           1HG      PRO  79   4.886  -8.759  10.498
  595    HD2  PRO  79           2HD      PRO  79   3.222  -9.026   8.020
  596    HD3  PRO  79           1HD      PRO  79   3.187  -7.765   9.274
  597    H    GLY  80           HN       GLY  80   8.106  -8.279   6.327
  598    HA2  GLY  80           2HA      GLY  80   6.809  -9.326   3.937
  599    HA3  GLY  80           1HA      GLY  80   8.450  -8.701   4.052
  600    H    ASP  81           HN       ASP  81   7.274 -11.049   6.312
  601    HA   ASP  81           HA       ASP  81   9.341 -12.907   5.604
  602    HB2  ASP  81           2HB      ASP  81   8.528 -12.534   7.948
  603    HB3  ASP  81           1HB      ASP  81   7.022 -13.312   7.491
  604    H    LEU  82           HN       LEU  82   5.997 -12.479   4.931
  605    HA   LEU  82           HA       LEU  82   5.632 -15.150   3.858
  606    HB2  LEU  82           2HB      LEU  82   3.782 -12.763   3.822
  607    HB3  LEU  82           1HB      LEU  82   3.347 -14.409   3.414
  608    HG   LEU  82           HG       LEU  82   4.184 -13.449   6.150
  609   HD11  LEU  82          1HD1      LEU  82   1.481 -14.234   5.073
  610   HD12  LEU  82          2HD1      LEU  82   1.998 -12.604   5.504
  611   HD13  LEU  82          3HD1      LEU  82   1.848 -13.839   6.753
  612   HD21  LEU  82          3HD2      LEU  82   4.821 -15.773   5.714
  613   HD22  LEU  82          1HD2      LEU  82   3.158 -16.138   5.255
  614   HD23  LEU  82          2HD2      LEU  82   3.531 -15.660   6.912
  615    H    ALA  83           HN       ALA  83   4.278 -14.975   1.629
  616    HA   ALA  83           HA       ALA  83   6.080 -13.759  -0.278
  617    HB1  ALA  83           1HB      ALA  83   3.481 -15.239  -0.696
  618    HB2  ALA  83           2HB      ALA  83   5.098 -15.938  -0.772
  619    HB3  ALA  83           3HB      ALA  83   4.595 -14.744  -1.969
  620    H    VAL  84           HN       VAL  84   5.961 -11.620  -0.372
  621    HA   VAL  84           HA       VAL  84   3.382 -10.288  -0.052
  622    HB   VAL  84           HB       VAL  84   6.172  -9.112  -0.123
  623   HG11  VAL  84          1HG1      VAL  84   4.454  -7.513  -0.817
  624   HG12  VAL  84          2HG1      VAL  84   5.135  -7.081   0.751
  625   HG13  VAL  84          3HG1      VAL  84   3.547  -7.843   0.659
  626   HG21  VAL  84          3HG2      VAL  84   4.368  -9.633   2.237
  627   HG22  VAL  84          1HG2      VAL  84   5.960  -8.875   2.281
  628   HG23  VAL  84          2HG2      VAL  84   5.804 -10.568   1.816
  629    H    THR  85           HN       THR  85   2.324  -9.456  -1.737
  630    HA   THR  85           HA       THR  85   3.870  -8.839  -4.159
  631    HB   THR  85           HB       THR  85   0.966  -9.589  -4.126
  632    HG1  THR  85           1HG      THR  85   1.763 -11.554  -3.817
  633   HG21  THR  85          3HG2      THR  85   1.645  -8.218  -6.014
  634   HG22  THR  85          1HG2      THR  85   1.295  -9.864  -6.544
  635   HG23  THR  85          2HG2      THR  85   2.966  -9.334  -6.360
  636    H    VAL  86           HN       VAL  86   3.909  -6.867  -4.635
  637    HA   VAL  86           HA       VAL  86   1.699  -5.028  -3.951
  638    HB   VAL  86           HB       VAL  86   4.144  -3.620  -4.520
  639   HG11  VAL  86          1HG1      VAL  86   2.261  -2.702  -3.268
  640   HG12  VAL  86          2HG1      VAL  86   3.745  -2.602  -2.317
  641   HG13  VAL  86          3HG1      VAL  86   2.549  -3.847  -1.957
  642   HG21  VAL  86          3HG2      VAL  86   5.478  -4.275  -2.521
  643   HG22  VAL  86          1HG2      VAL  86   5.416  -5.501  -3.788
  644   HG23  VAL  86          2HG2      VAL  86   4.430  -5.682  -2.334
  645    H    GLU  87           HN       GLU  87   1.174  -3.551  -5.869
  646    HA   GLU  87           HA       GLU  87   3.512  -3.576  -7.605
  647    HB2  GLU  87           2HB      GLU  87   1.961  -5.214  -8.590
  648    HB3  GLU  87           1HB      GLU  87   0.781  -3.926  -8.814
  649    HG2  GLU  87           2HG      GLU  87   2.321  -2.751 -10.285
  650    HG3  GLU  87           1HG      GLU  87   3.533  -4.003 -10.039
  651    HA   PRO  88           HA       PRO  88   3.872  -0.654  -9.417
  652    HB2  PRO  88           2HB      PRO  88   5.331   1.173  -7.967
  653    HB3  PRO  88           1HB      PRO  88   3.684   1.458  -8.512
  654    HG2  PRO  88           2HG      PRO  88   4.588   1.203  -5.814
  655    HG3  PRO  88           1HG      PRO  88   2.909   1.356  -6.366
  656    HD2  PRO  88           2HD      PRO  88   4.474  -1.114  -5.707
  657    HD3  PRO  88           1HD      PRO  88   2.737  -0.780  -5.487
  658    H    ARG  89           HN       ARG  89   5.772  -1.656 -10.114
  659    HA   ARG  89           HA       ARG  89   7.182  -3.100  -7.988
  660    HB2  ARG  89           2HB      ARG  89   7.417  -3.287 -11.009
  661    HB3  ARG  89           1HB      ARG  89   8.426  -4.207  -9.896
  662    HG2  ARG  89           2HG      ARG  89   6.033  -4.821  -8.899
  663    HG3  ARG  89           1HG      ARG  89   5.567  -4.523 -10.571
  664    HD2  ARG  89           2HD      ARG  89   7.796  -6.372  -9.748
  665    HD3  ARG  89           1HD      ARG  89   6.144  -6.899 -10.049
  666    HE   ARG  89           HE       ARG  89   6.512  -5.933 -12.357
  667   HH11  ARG  89          1HH1      ARG  89   9.144  -7.144 -10.411
  668   HH12  ARG  89          2HH1      ARG  89  10.097  -7.665 -11.769
  669   HH21  ARG  89          1HH2      ARG  89   7.749  -6.636 -14.164
  670   HH22  ARG  89          2HH2      ARG  89   9.280  -7.405 -13.899
  671    H    MET  90           HN       MET  90   7.573  -0.576 -10.261
  672    HA   MET  90           HA       MET  90   9.548   0.577  -8.460
  673    HB2  MET  90           2HB      MET  90  10.522  -0.389 -10.741
  674    HB3  MET  90           1HB      MET  90   9.841   1.090 -11.402
  675    HG2  MET  90           2HG      MET  90  11.203   2.425  -9.927
  676    HG3  MET  90           1HG      MET  90  11.813   0.977  -9.131
  677    HE1  MET  90           3HE      MET  90  13.741   3.216 -10.248
  678    HE2  MET  90           1HE      MET  90  14.973   2.233 -11.044
  679    HE3  MET  90           2HE      MET  90  14.309   1.727  -9.491
  680    H    ALA  91           HN       ALA  91   9.081   2.795  -8.136
  681    HA   ALA  91           HA       ALA  91   6.478   3.538  -9.315
  682    HB1  ALA  91           1HB      ALA  91   7.449   4.021  -6.503
  683    HB2  ALA  91           2HB      ALA  91   6.239   2.838  -7.001
  684    HB3  ALA  91           3HB      ALA  91   5.908   4.562  -7.165
  685    H    ARG  92           HN       ARG  92   6.273   5.454 -10.174
  686    HA   ARG  92           HA       ARG  92   8.578   7.266 -10.042
  687    HB2  ARG  92           2HB      ARG  92   7.928   6.233 -12.243
  688    HB3  ARG  92           1HB      ARG  92   6.432   7.148 -12.155
  689    HG2  ARG  92           2HG      ARG  92   7.750   9.230 -12.090
  690    HG3  ARG  92           1HG      ARG  92   9.218   8.270 -12.291
  691    HD2  ARG  92           2HD      ARG  92   6.909   8.457 -14.218
  692    HD3  ARG  92           1HD      ARG  92   8.514   9.156 -14.426
  693    HE   ARG  92           HE       ARG  92   9.360   6.830 -14.467
  694   HH11  ARG  92          1HH1      ARG  92   5.973   7.432 -15.138
  695   HH12  ARG  92          2HH1      ARG  92   5.782   6.004 -16.110
  696   HH21  ARG  92          1HH2      ARG  92   9.131   4.965 -15.757
  697   HH22  ARG  92          2HH2      ARG  92   7.587   4.603 -16.482
  698    H    VAL  93           HN       VAL  93   8.345   9.238  -9.273
  699    HA   VAL  93           HA       VAL  93   5.645  10.370  -8.981
  700    HB   VAL  93           HB       VAL  93   7.801  10.467  -6.855
  701   HG11  VAL  93          1HG1      VAL  93   6.518  12.541  -6.950
  702   HG12  VAL  93          2HG1      VAL  93   6.149  11.631  -5.484
  703   HG13  VAL  93          3HG1      VAL  93   5.016  11.623  -6.836
  704   HG21  VAL  93          3HG2      VAL  93   5.129   9.065  -6.860
  705   HG22  VAL  93          1HG2      VAL  93   6.221   9.183  -5.479
  706   HG23  VAL  93          2HG2      VAL  93   6.713   8.292  -6.920
  707    H    GLN  94           HN       GLN  94   5.474  12.451  -9.553
  708    HA   GLN  94           HA       GLN  94   7.915  13.806 -10.451
  709    HB2  GLN  94           2HB      GLN  94   6.366  13.625 -12.222
  710    HB3  GLN  94           1HB      GLN  94   5.014  14.077 -11.199
  711    HG2  GLN  94           2HG      GLN  94   5.557  15.847 -12.754
  712    HG3  GLN  94           1HG      GLN  94   5.846  16.369 -11.102
  713   HE21  GLN  94          1HE2      GLN  94   6.899  17.394 -13.601
  714   HE22  GLN  94          2HE2      GLN  94   8.614  17.309 -13.450
  715    H    LEU  95           HN       LEU  95   8.727  15.347  -9.252
  716    HA   LEU  95           HA       LEU  95   6.935  16.919  -7.529
  717    HB2  LEU  95           2HB      LEU  95   9.920  16.497  -7.274
  718    HB3  LEU  95           1HB      LEU  95   8.932  17.463  -6.197
  719    HG   LEU  95           HG       LEU  95   8.719  14.472  -6.555
  720   HD11  LEU  95          1HD1      LEU  95  10.756  15.151  -5.391
  721   HD12  LEU  95          2HD1      LEU  95   9.627  14.349  -4.301
  722   HD13  LEU  95          3HD1      LEU  95   9.797  16.105  -4.261
  723   HD21  LEU  95          3HD2      LEU  95   7.194  14.579  -4.643
  724   HD22  LEU  95          1HD2      LEU  95   6.569  15.479  -6.026
  725   HD23  LEU  95          2HD2      LEU  95   7.291  16.340  -4.667
  726    H    GLU  96           HN       GLU  96   6.656  18.991  -8.083
  727    HA   GLU  96           HA       GLU  96   8.546  20.171 -10.000
  728    HB2  GLU  96           2HB      GLU  96   6.535  19.282 -11.163
  729    HB3  GLU  96           1HB      GLU  96   5.539  20.359 -10.198
  730    HG2  GLU  96           2HG      GLU  96   5.940  21.235 -12.439
  731    HG3  GLU  96           1HG      GLU  96   6.601  22.290 -11.190
  732    H    GLU  97           HN       GLU  97   8.796  22.368  -9.935
  733    HA   GLU  97           HA       GLU  97   8.623  23.611  -7.429
  734    HB2  GLU  97           2HB      GLU  97  10.162  24.119  -9.434
  735    HB3  GLU  97           1HB      GLU  97   8.832  25.084 -10.052
  736    HG2  GLU  97           2HG      GLU  97  10.036  25.541  -7.339
  737    HG3  GLU  97           1HG      GLU  97  10.649  26.309  -8.801
  738    H    ARG  98           HN       ARG  98   6.806  24.090  -6.455
  739    HA   ARG  98           HA       ARG  98   4.843  25.036  -5.904
  740    HB2  ARG  98           2HB      ARG  98   5.747  27.014  -7.016
  741    HB3  ARG  98           1HB      ARG  98   5.142  26.427  -8.551
  742    HG2  ARG  98           2HG      ARG  98   2.848  26.636  -7.728
  743    HG3  ARG  98           1HG      ARG  98   3.465  27.215  -6.179
  744    HD2  ARG  98           2HD      ARG  98   2.781  29.101  -7.489
  745    HD3  ARG  98           1HD      ARG  98   4.539  29.100  -7.368
  746    HE   ARG  98           HE       ARG  98   3.014  28.272  -9.755
  747   HH11  ARG  98          1HH1      ARG  98   5.923  29.469  -8.224
  748   HH12  ARG  98          2HH1      ARG  98   6.705  29.863  -9.726
  749   HH21  ARG  98          1HH2      ARG  98   4.038  28.799 -11.739
  750   HH22  ARG  98          2HH2      ARG  98   5.631  29.498 -11.719
  751    H    GLN  99           HN       GLN  99   2.496  25.108  -6.529
  752    HA   GLN  99           HA       GLN  99   1.624  22.622  -7.311
  753    HB2  GLN  99           2HB      GLN  99   0.226  25.287  -7.169
  754    HB3  GLN  99           1HB      GLN  99  -0.599  23.766  -7.405
  755    HG2  GLN  99           2HG      GLN  99   1.073  24.499  -5.027
  756    HG3  GLN  99           1HG      GLN  99  -0.689  24.452  -5.083
  757   HE21  GLN  99          1HE2      GLN  99   1.232  22.958  -3.429
  758   HE22  GLN  99          2HE2      GLN  99   0.903  21.279  -3.714
  759    H    THR 100           HN       THR 100   1.143  21.700  -9.174
  760    HA   THR 100           HA       THR 100   0.943  23.359 -11.597
  761    HB   THR 100           HB       THR 100   2.212  20.616 -11.369
  762    HG1  THR 100           1HG      THR 100   3.503  22.344 -10.498
  763   HG21  THR 100          3HG2      THR 100   2.034  22.499 -13.727
  764   HG22  THR 100          1HG2      THR 100   1.127  20.997 -13.537
  765   HG23  THR 100          2HG2      THR 100   2.883  20.953 -13.694
  766    H    VAL 101           HN       VAL 101  -0.681  22.758 -13.041
  767    HA   VAL 101           HA       VAL 101  -2.883  21.403 -11.845
  768    HB   VAL 101           HB       VAL 101  -2.649  22.283 -14.724
  769   HG11  VAL 101          1HG1      VAL 101  -5.038  21.740 -12.966
  770   HG12  VAL 101          2HG1      VAL 101  -4.502  20.779 -14.344
  771   HG13  VAL 101          3HG1      VAL 101  -5.108  22.415 -14.593
  772   HG21  VAL 101          3HG2      VAL 101  -2.175  24.160 -13.252
  773   HG22  VAL 101          1HG2      VAL 101  -3.648  23.832 -12.335
  774   HG23  VAL 101          2HG2      VAL 101  -3.753  24.348 -14.018
  775    H    SER 102           HN       SER 102  -2.194  19.321 -11.482
  776    HA   SER 102           HA       SER 102  -2.780  17.560 -13.715
  777    HB2  SER 102           2HB      SER 102  -0.259  17.249 -12.060
  778    HB3  SER 102           1HB      SER 102  -0.834  16.112 -13.279
  779    HG   SER 102           HG       SER 102  -0.732  18.545 -14.368
  780    H    VAL 103           HN       VAL 103  -3.891  18.532 -11.126
  781    HA   VAL 103           HA       VAL 103  -3.794  16.349  -9.275
  782    HB   VAL 103           HB       VAL 103  -5.744  18.662  -9.362
  783   HG11  VAL 103          1HG1      VAL 103  -6.505  16.841  -7.956
  784   HG12  VAL 103          2HG1      VAL 103  -6.011  18.211  -6.962
  785   HG13  VAL 103          3HG1      VAL 103  -4.953  16.808  -7.119
  786   HG21  VAL 103          3HG2      VAL 103  -3.084  18.413  -7.966
  787   HG22  VAL 103          1HG2      VAL 103  -4.252  19.709  -7.697
  788   HG23  VAL 103          2HG2      VAL 103  -3.496  19.520  -9.279
  789    HA   PRO 104           HA       PRO 104  -6.989  14.187 -11.547
  790    HB2  PRO 104           2HB      PRO 104  -6.631  11.792 -10.428
  791    HB3  PRO 104           1HB      PRO 104  -5.441  12.461 -11.552
  792    HG2  PRO 104           2HG      PRO 104  -5.360  12.315  -8.570
  793    HG3  PRO 104           1HG      PRO 104  -4.050  12.085  -9.742
  794    HD2  PRO 104           2HD      PRO 104  -4.537  14.422  -8.318
  795    HD3  PRO 104           1HD      PRO 104  -3.577  14.309  -9.805
  796    H    VAL 105           HN       VAL 105  -9.108  13.773 -11.133
  797    HA   VAL 105           HA       VAL 105 -10.113  14.215  -8.475
  798    HB   VAL 105           HB       VAL 105 -12.353  13.706  -9.467
  799   HG11  VAL 105          1HG1      VAL 105 -12.435  15.717 -10.879
  800   HG12  VAL 105          2HG1      VAL 105 -10.672  15.747 -10.913
  801   HG13  VAL 105          3HG1      VAL 105 -11.529  15.979  -9.390
  802   HG21  VAL 105          3HG2      VAL 105 -10.810  13.462 -12.050
  803   HG22  VAL 105          1HG2      VAL 105 -12.566  13.491 -11.892
  804   HG23  VAL 105          2HG2      VAL 105 -11.643  12.150 -11.220
  805    H    THR 106           HN       THR 106 -10.257  12.724  -6.950
  806    HA   THR 106           HA       THR 106  -9.366  10.092  -7.433
  807    HB   THR 106           HB       THR 106  -8.914  11.066  -5.302
  808    HG1  THR 106           1HG      THR 106  -9.073   9.144  -4.473
  809   HG21  THR 106          3HG2      THR 106 -11.893  11.156  -4.836
  810   HG22  THR 106          1HG2      THR 106 -10.843  12.549  -5.100
  811   HG23  THR 106          2HG2      THR 106 -10.651  11.560  -3.652
  812    H    VAL 107           HN       VAL 107 -10.439   8.627  -8.466
  813    HA   VAL 107           HA       VAL 107 -13.158   7.971  -7.633
  814    HB   VAL 107           HB       VAL 107 -13.833   7.545  -9.998
  815   HG11  VAL 107          1HG1      VAL 107 -13.101  10.408  -9.404
  816   HG12  VAL 107          2HG1      VAL 107 -14.563   9.580  -8.866
  817   HG13  VAL 107          3HG1      VAL 107 -14.295   9.869 -10.586
  818   HG21  VAL 107          3HG2      VAL 107 -11.350   9.110 -10.697
  819   HG22  VAL 107          1HG2      VAL 107 -12.587   8.553 -11.824
  820   HG23  VAL 107          2HG2      VAL 107 -11.581   7.383 -10.968
  821    H    GLU 108           HN       GLU 108 -13.727   5.763  -8.087
  822    HA   GLU 108           HA       GLU 108 -11.427   4.023  -8.021
  823    HB2  GLU 108           2HB      GLU 108 -13.128   2.224  -7.670
  824    HB3  GLU 108           1HB      GLU 108 -13.180   3.510  -6.474
  825    HG2  GLU 108           2HG      GLU 108 -15.057   4.522  -7.815
  826    HG3  GLU 108           1HG      GLU 108 -15.079   3.027  -8.749
  827    H    MET 109           HN       MET 109 -11.020   2.329  -9.500
  828    HA   MET 109           HA       MET 109 -11.588   3.132 -12.204
  829    HB2  MET 109           2HB      MET 109  -9.354   2.205 -11.220
  830    HB3  MET 109           1HB      MET 109 -10.091   0.631 -11.476
  831    HG2  MET 109           2HG      MET 109  -9.767   2.686 -13.645
  832    HG3  MET 109           1HG      MET 109  -8.577   1.437 -13.302
  833    HE1  MET 109           3HE      MET 109  -8.936  -1.134 -13.753
  834    HE2  MET 109           1HE      MET 109 -10.497  -1.836 -14.179
  835    HE3  MET 109           2HE      MET 109 -10.273  -1.078 -12.603
  836    H    ILE 110           HN       ILE 110 -13.776   2.756 -12.421
  837    HA   ILE 110           HA       ILE 110 -14.383   0.001 -13.116
  838    HB   ILE 110           HB       ILE 110 -15.253   0.212 -10.849
  839   HG12  ILE 110          2HG1      ILE 110 -16.524  -1.040 -12.699
  840   HG13  ILE 110          1HG1      ILE 110 -17.373  -0.713 -11.198
  841   HG21  ILE 110          1HG2      ILE 110 -15.563   2.580 -10.667
  842   HG22  ILE 110          2HG2      ILE 110 -17.088   1.768 -10.310
  843   HG23  ILE 110          3HG2      ILE 110 -16.847   2.547 -11.872
  844   HD11  ILE 110          3HD1      ILE 110 -18.826  -0.349 -13.083
  845   HD12  ILE 110          1HD1      ILE 110 -17.675   0.790 -13.785
  846   HD13  ILE 110          2HD1      ILE 110 -18.498   1.186 -12.275
  847    H    ASN 111           HN       ASN 111 -14.842   0.109 -15.177
  848    HA   ASN 111           HA       ASN 111 -17.011   1.507 -16.256
  849    HB2  ASN 111           2HB      ASN 111 -15.261   3.407 -15.850
  850    HB3  ASN 111           1HB      ASN 111 -14.430   2.717 -17.240
  851   HD21  ASN 111          1HD2      ASN 111 -15.479   5.323 -17.093
  852   HD22  ASN 111          2HD2      ASN 111 -16.737   5.451 -18.281
  853    H    LEU 112           HN       LEU 112 -17.537   0.529 -18.148
  854    HA   LEU 112           HA       LEU 112 -15.616  -1.324 -19.314
  855    HB2  LEU 112           2HB      LEU 112 -18.540  -0.815 -19.873
  856    HB3  LEU 112           1HB      LEU 112 -17.569  -1.932 -20.806
  857    HG   LEU 112           HG       LEU 112 -18.810  -3.231 -19.276
  858   HD11  LEU 112          1HD1      LEU 112 -17.098  -4.289 -17.908
  859   HD12  LEU 112          2HD1      LEU 112 -16.034  -2.904 -18.158
  860   HD13  LEU 112          3HD1      LEU 112 -16.494  -3.921 -19.524
  861   HD21  LEU 112          3HD2      LEU 112 -19.491  -1.502 -17.724
  862   HD22  LEU 112          1HD2      LEU 112 -17.846  -1.391 -17.093
  863   HD23  LEU 112          2HD2      LEU 112 -18.787  -2.862 -16.850
  864    H    GLU 113           HN       GLU 113 -16.293   1.825 -19.536
  865    HA   GLU 113           HA       GLU 113 -15.611   3.487 -20.879
  866    HB2  GLU 113           2HB      GLU 113 -14.424   1.271 -22.542
  867    HB3  GLU 113           1HB      GLU 113 -14.255   2.977 -22.937
  868    HG2  GLU 113           2HG      GLU 113 -13.259   3.282 -20.640
  869    HG3  GLU 113           1HG      GLU 113 -13.199   1.523 -20.531
  870    H    HIS 114           HN       HIS 114 -17.363   4.438 -21.496
  871    HA   HIS 114           HA       HIS 114 -18.450   3.779 -24.116
  872    HB2  HIS 114           2HB      HIS 114 -20.789   4.034 -23.318
  873    HB3  HIS 114           1HB      HIS 114 -19.993   2.629 -22.625
  874    HD1  HIS 114           1HD      HIS 114 -19.755   2.533 -20.105
  875    HD2  HIS 114           2HD      HIS 114 -21.312   6.144 -21.461
  876    HE1  HIS 114           1HE      HIS 114 -20.544   3.749 -18.050
  877    HE2  HIS 114           2HE      HIS 114 -21.235   6.024 -18.880
  878    H    HIS 115           HN       HIS 115 -18.626   5.575 -25.306
  879    HA   HIS 115           HA       HIS 115 -18.472   8.126 -23.849
  880    HB2  HIS 115           2HB      HIS 115 -17.418   7.377 -26.578
  881    HB3  HIS 115           1HB      HIS 115 -17.480   9.034 -25.985
  882    HD1  HIS 115           1HD      HIS 115 -15.508   9.812 -24.682
  883    HD2  HIS 115           2HD      HIS 115 -15.717   5.660 -24.883
  884    HE1  HIS 115           1HE      HIS 115 -13.418   8.971 -23.571
  885    HE2  HIS 115           2HE      HIS 115 -13.679   6.466 -23.500
  886    H    HIS 116           HN       HIS 116 -20.570   8.561 -23.587
  887    HA   HIS 116           HA       HIS 116 -22.308   8.680 -25.966
  888    HB2  HIS 116           2HB      HIS 116 -22.974   7.363 -23.870
  889    HB3  HIS 116           1HB      HIS 116 -23.132   8.917 -23.063
  890    HD1  HIS 116           1HD      HIS 116 -25.437   6.776 -23.641
  891    HD2  HIS 116           2HD      HIS 116 -24.780  10.340 -25.681
  892    HE1  HIS 116           1HE      HIS 116 -27.650   7.396 -24.655
  893    HE2  HIS 116           2HE      HIS 116 -27.277   9.651 -25.716
  894    H    HIS 117           HN       HIS 117 -22.935  10.648 -26.728
  895    HA   HIS 117           HA       HIS 117 -22.585  12.966 -24.959
  896    HB2  HIS 117           2HB      HIS 117 -20.590  12.739 -26.453
  897    HB3  HIS 117           1HB      HIS 117 -21.662  12.911 -27.839
  898    HD1  HIS 117           1HD      HIS 117 -22.217  15.246 -28.574
  899    HD2  HIS 117           2HD      HIS 117 -20.442  15.120 -24.808
  900    HE1  HIS 117           1HE      HIS 117 -21.752  17.642 -27.957
  901    HE2  HIS 117           2HE      HIS 117 -20.834  17.551 -25.610
  902    H    HIS 118           HN       HIS 118 -24.540  13.805 -24.754
  903    HA   HIS 118           HA       HIS 118 -26.179  14.135 -27.189
  904    HB2  HIS 118           2HB      HIS 118 -27.264  12.619 -25.585
  905    HB3  HIS 118           1HB      HIS 118 -27.119  13.836 -24.323
  906    HD1  HIS 118           1HD      HIS 118 -29.089  12.987 -27.401
  907    HD2  HIS 118           2HD      HIS 118 -29.038  15.872 -24.405
  908    HE1  HIS 118           1HE      HIS 118 -31.231  14.270 -27.661
  909    HE2  HIS 118           2HE      HIS 118 -31.220  15.961 -25.797
  910    H    HIS 119           HN       HIS 119 -26.866  16.157 -27.668
  911    HA   HIS 119           HA       HIS 119 -25.633  18.385 -26.461
  912    HB2  HIS 119           2HB      HIS 119 -26.383  18.426 -28.790
  913    HB3  HIS 119           1HB      HIS 119 -28.055  18.258 -28.272
  914    HD1  HIS 119           1HD      HIS 119 -29.027  20.441 -28.991
  915    HD2  HIS 119           2HD      HIS 119 -25.486  20.914 -26.867
  916    HE1  HIS 119           1HE      HIS 119 -28.794  22.915 -28.610
  917    HE2  HIS 119           2HE      HIS 119 -26.751  23.155 -27.151
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1  -7.746 -26.116  -6.429
    2    H2   MET   1           H2       MET   1  -8.577 -25.500  -5.088
    3    H3   MET   1           H3       MET   1  -9.312 -26.659  -6.075
    4    HA   MET   1           HA       MET   1  -7.700 -28.306  -5.431
    5    HB2  MET   1           2HB      MET   1  -6.622 -26.063  -3.711
    6    HB3  MET   1           1HB      MET   1  -6.200 -27.752  -3.481
    7    HG2  MET   1           2HG      MET   1  -4.446 -26.710  -4.695
    8    HG3  MET   1           1HG      MET   1  -5.305 -27.785  -5.794
    9    HE1  MET   1           2HE      MET   1  -3.270 -25.507  -6.730
   10    HE2  MET   1           3HE      MET   1  -4.139 -24.827  -8.107
   11    HE3  MET   1           1HE      MET   1  -4.108 -26.573  -7.859
   12    HA   PRO   2           HA       PRO   2 -10.804 -29.331  -2.402
   13    HB2  PRO   2           2HB      PRO   2  -9.358 -31.353  -1.155
   14    HB3  PRO   2           1HB      PRO   2 -10.386 -31.560  -2.577
   15    HG2  PRO   2           2HG      PRO   2  -7.424 -31.254  -2.397
   16    HG3  PRO   2           1HG      PRO   2  -8.388 -32.258  -3.496
   17    HD2  PRO   2           2HD      PRO   2  -7.255 -29.954  -4.294
   18    HD3  PRO   2           1HD      PRO   2  -8.830 -30.485  -4.919
   19    H    THR   3           HN       THR   3  -7.460 -29.509  -1.163
   20    HA   THR   3           HA       THR   3  -8.323 -28.120   1.266
   21    HB   THR   3           HB       THR   3  -5.949 -28.675   2.025
   22    HG1  THR   3           1HG      THR   3  -5.686 -30.799   0.374
   23   HG21  THR   3          3HG2      THR   3  -6.510 -30.994   2.575
   24   HG22  THR   3          1HG2      THR   3  -7.788 -30.976   1.360
   25   HG23  THR   3          2HG2      THR   3  -7.909 -29.939   2.780
   26    H    PHE   4           HN       PHE   4  -5.928 -26.890   1.972
   27    HA   PHE   4           HA       PHE   4  -5.837 -24.777  -0.017
   28    HB2  PHE   4           2HB      PHE   4  -4.770 -23.476   1.842
   29    HB3  PHE   4           1HB      PHE   4  -6.426 -23.963   2.128
   30    HD1  PHE   4           2HD      PHE   4  -6.902 -25.794   3.743
   31    HD2  PHE   4           1HD      PHE   4  -2.984 -24.214   3.220
   32    HE1  PHE   4           2HE      PHE   4  -6.212 -26.802   5.878
   33    HE2  PHE   4           1HE      PHE   4  -2.291 -25.219   5.355
   34    HZ   PHE   4           HZ       PHE   4  -3.907 -26.514   6.686
   35    H    ASP   5           HN       ASP   5  -4.146 -24.461  -1.240
   36    HA   ASP   5           HA       ASP   5  -1.592 -25.729  -0.563
   37    HB2  ASP   5           2HB      ASP   5  -2.534 -26.149  -2.863
   38    HB3  ASP   5           1HB      ASP   5  -2.395 -24.423  -3.181
   39    H    HIS   6           HN       HIS   6  -1.341 -24.203   1.094
   40    HA   HIS   6           HA       HIS   6  -0.625 -22.284   2.100
   41    HB2  HIS   6           2HB      HIS   6  -0.102 -21.334  -0.731
   42    HB3  HIS   6           1HB      HIS   6   0.273 -20.392   0.704
   43    HD1  HIS   6           1HD      HIS   6   2.702 -20.618  -0.637
   44    HD2  HIS   6           2HD      HIS   6   1.282 -23.935   1.440
   45    HE1  HIS   6           1HE      HIS   6   4.704 -22.101  -0.265
   46    HE2  HIS   6           2HE      HIS   6   3.812 -24.132   0.938
   47    H    GLY   7           HN       GLY   7  -1.236 -19.768   2.007
   48    HA2  GLY   7           2HA      GLY   7  -4.044 -19.626   1.105
   49    HA3  GLY   7           1HA      GLY   7  -3.525 -18.997   2.665
   50    H    ASN   8           HN       ASN   8  -4.840 -17.479   0.697
   51    HA   ASN   8           HA       ASN   8  -2.690 -15.547   0.102
   52    HB2  ASN   8           2HB      ASN   8  -5.303 -15.643  -1.382
   53    HB3  ASN   8           1HB      ASN   8  -3.856 -14.753  -1.804
   54   HD21  ASN   8          1HD2      ASN   8  -2.123 -15.829  -2.760
   55   HD22  ASN   8          2HD2      ASN   8  -2.307 -17.388  -3.481
   56    H    LEU   9           HN       LEU   9  -3.000 -13.502   0.747
   57    HA   LEU   9           HA       LEU   9  -5.604 -12.628   1.690
   58    HB2  LEU   9           2HB      LEU   9  -4.266 -13.632   3.603
   59    HB3  LEU   9           1HB      LEU   9  -3.126 -12.323   3.382
   60    HG   LEU   9           HG       LEU   9  -4.803 -12.059   5.232
   61   HD11  LEU   9          1HD1      LEU   9  -4.721  -9.911   3.137
   62   HD12  LEU   9          2HD1      LEU   9  -3.537 -10.166   4.418
   63   HD13  LEU   9          3HD1      LEU   9  -5.183  -9.682   4.823
   64   HD21  LEU   9          3HD2      LEU   9  -7.037 -11.261   4.633
   65   HD22  LEU   9          1HD2      LEU   9  -6.763 -12.917   4.098
   66   HD23  LEU   9          2HD2      LEU   9  -6.688 -11.594   2.938
   67    H    SER  10           HN       SER  10  -5.969 -10.657   0.909
   68    HA   SER  10           HA       SER  10  -3.665  -9.145  -0.084
   69    HB2  SER  10           2HB      SER  10  -5.580  -7.957  -1.419
   70    HB3  SER  10           1HB      SER  10  -5.002  -9.539  -1.943
   71    HG   SER  10           HG       SER  10  -6.924 -10.280  -1.607
   72    H    LEU  11           HN       LEU  11  -3.338  -7.059   0.516
   73    HA   LEU  11           HA       LEU  11  -4.790  -6.163   2.860
   74    HB2  LEU  11           2HB      LEU  11  -2.474  -4.920   1.372
   75    HB3  LEU  11           1HB      LEU  11  -3.144  -4.307   2.871
   76    HG   LEU  11           HG       LEU  11  -1.770  -6.975   2.512
   77   HD11  LEU  11          1HD1      LEU  11  -0.252  -5.052   2.443
   78   HD12  LEU  11          2HD1      LEU  11  -0.027  -6.013   3.903
   79   HD13  LEU  11          3HD1      LEU  11  -0.909  -4.487   3.979
   80   HD21  LEU  11          3HD2      LEU  11  -2.891  -5.672   4.990
   81   HD22  LEU  11          1HD2      LEU  11  -1.945  -7.160   4.945
   82   HD23  LEU  11          2HD2      LEU  11  -3.538  -7.105   4.187
   83    H    GLY  12           HN       GLY  12  -5.117  -5.882  -0.433
   84    HA2  GLY  12           2HA      GLY  12  -6.803  -4.763  -1.582
   85    HA3  GLY  12           1HA      GLY  12  -7.113  -3.801  -0.140
   86    H    GLU  13           HN       GLU  13  -7.239  -2.169  -1.992
   87    HA   GLU  13           HA       GLU  13  -4.754  -1.183  -3.004
   88    HB2  GLU  13           2HB      GLU  13  -7.503   0.072  -2.876
   89    HB3  GLU  13           1HB      GLU  13  -6.133   0.751  -3.744
   90    HG2  GLU  13           2HG      GLU  13  -7.332  -1.947  -4.308
   91    HG3  GLU  13           1HG      GLU  13  -7.739  -0.468  -5.176
   92    H    LEU  14           HN       LEU  14  -3.309  -0.376  -1.632
   93    HA   LEU  14           HA       LEU  14  -4.233   1.058   0.741
   94    HB2  LEU  14           2HB      LEU  14  -1.476   0.111  -0.045
   95    HB3  LEU  14           1HB      LEU  14  -1.861   0.935   1.454
   96    HG   LEU  14           HG       LEU  14  -2.874  -1.779   0.609
   97   HD11  LEU  14          1HD1      LEU  14  -0.929  -0.936   2.746
   98   HD12  LEU  14          2HD1      LEU  14  -0.536  -1.797   1.257
   99   HD13  LEU  14          3HD1      LEU  14  -1.526  -2.576   2.493
  100   HD21  LEU  14          3HD2      LEU  14  -3.345  -0.242   3.156
  101   HD22  LEU  14          1HD2      LEU  14  -3.872  -1.893   2.824
  102   HD23  LEU  14          2HD2      LEU  14  -4.545  -0.548   1.900
  103    H    GLU  15           HN       GLU  15  -3.523   3.121   1.270
  104    HA   GLU  15           HA       GLU  15  -3.244   4.897  -0.941
  105    HB2  GLU  15           2HB      GLU  15  -3.012   5.416   2.032
  106    HB3  GLU  15           1HB      GLU  15  -3.109   6.660   0.793
  107    HG2  GLU  15           2HG      GLU  15  -5.333   5.846   0.162
  108    HG3  GLU  15           1HG      GLU  15  -5.236   4.630   1.435
  109    H    LEU  16           HN       LEU  16  -1.440   5.663  -1.844
  110    HA   LEU  16           HA       LEU  16   1.133   4.814  -0.832
  111    HB2  LEU  16           2HB      LEU  16   0.345   4.910  -3.282
  112    HB3  LEU  16           1HB      LEU  16   0.628   6.633  -3.176
  113    HG   LEU  16           HG       LEU  16   2.474   5.363  -4.258
  114   HD11  LEU  16          1HD1      LEU  16   4.302   6.442  -3.075
  115   HD12  LEU  16          2HD1      LEU  16   3.256   6.717  -1.682
  116   HD13  LEU  16          3HD1      LEU  16   2.919   7.530  -3.211
  117   HD21  LEU  16          3HD2      LEU  16   2.363   3.322  -2.964
  118   HD22  LEU  16          1HD2      LEU  16   2.830   4.194  -1.505
  119   HD23  LEU  16          2HD2      LEU  16   3.973   4.031  -2.839
  120    H    THR  17           HN       THR  17   2.173   5.926   0.660
  121    HA   THR  17           HA       THR  17   1.594   8.753   1.086
  122    HB   THR  17           HB       THR  17   3.401   6.911   2.672
  123    HG1  THR  17           1HG      THR  17   0.945   6.544   2.493
  124   HG21  THR  17          3HG2      THR  17   3.162   8.587   4.445
  125   HG22  THR  17          1HG2      THR  17   2.179   9.584   3.374
  126   HG23  THR  17          2HG2      THR  17   3.876   9.298   2.996
  127    H    VAL  18           HN       VAL  18   2.982  10.390   0.610
  128    HA   VAL  18           HA       VAL  18   5.526   9.599  -0.650
  129    HB   VAL  18           HB       VAL  18   3.921  12.119  -1.123
  130   HG11  VAL  18          1HG1      VAL  18   6.307  12.499  -1.411
  131   HG12  VAL  18          2HG1      VAL  18   5.489  12.514  -2.972
  132   HG13  VAL  18          3HG1      VAL  18   6.419  11.100  -2.479
  133   HG21  VAL  18          3HG2      VAL  18   4.305   9.693  -2.876
  134   HG22  VAL  18          1HG2      VAL  18   3.459  11.174  -3.334
  135   HG23  VAL  18          2HG2      VAL  18   2.817  10.154  -2.046
  136    H    LEU  19           HN       LEU  19   7.342  10.161   0.348
  137    HA   LEU  19           HA       LEU  19   7.288  12.251   2.399
  138    HB2  LEU  19           2HB      LEU  19   9.494  10.345   1.597
  139    HB3  LEU  19           1HB      LEU  19   9.565  11.479   2.933
  140    HG   LEU  19           HG       LEU  19   7.697   9.115   2.716
  141   HD11  LEU  19          1HD1      LEU  19   9.013   8.206   4.566
  142   HD12  LEU  19          2HD1      LEU  19  10.090   9.602   4.487
  143   HD13  LEU  19          3HD1      LEU  19  10.012   8.472   3.135
  144   HD21  LEU  19          3HD2      LEU  19   6.654  10.965   3.909
  145   HD22  LEU  19          1HD2      LEU  19   8.076  11.120   4.941
  146   HD23  LEU  19          2HD2      LEU  19   7.080   9.666   5.024
  147    H    TYR  20           HN       TYR  20   7.838  14.244   1.871
  148    HA   TYR  20           HA       TYR  20   9.851  14.830  -0.101
  149    HB2  TYR  20           2HB      TYR  20   8.400  16.058  -1.629
  150    HB3  TYR  20           1HB      TYR  20   7.842  14.393  -1.514
  151    HD1  TYR  20           1HD      TYR  20   5.880  13.934   0.110
  152    HD2  TYR  20           2HD      TYR  20   6.907  17.822  -1.277
  153    HE1  TYR  20           1HE      TYR  20   3.632  14.732   0.697
  154    HE2  TYR  20           2HE      TYR  20   4.659  18.631  -0.691
  155    HH   TYR  20           HH       TYR  20   2.476  16.776   1.211
  156    H    ASP  21           HN       ASP  21   9.814  17.339  -0.469
  157    HA   ASP  21           HA       ASP  21   9.254  18.601   2.125
  158    HB2  ASP  21           2HB      ASP  21  11.633  18.608   1.545
  159    HB3  ASP  21           1HB      ASP  21  11.266  19.391   0.008
  160    H    GLU  22           HN       GLU  22   7.402  19.681   2.055
  161    HA   GLU  22           HA       GLU  22   6.254  20.545  -0.423
  162    HB2  GLU  22           2HB      GLU  22   4.419  21.419   1.069
  163    HB3  GLU  22           1HB      GLU  22   4.743  19.696   1.192
  164    HG2  GLU  22           2HG      GLU  22   5.909  19.991   3.253
  165    HG3  GLU  22           1HG      GLU  22   5.843  21.747   3.094
  166    H    GLU  23           HN       GLU  23   8.472  21.967   1.650
  167    HA   GLU  23           HA       GLU  23   7.663  24.686   1.358
  168    HB2  GLU  23           2HB      GLU  23  10.381  23.511   1.983
  169    HB3  GLU  23           1HB      GLU  23   9.925  25.196   2.174
  170    HG2  GLU  23           2HG      GLU  23   8.692  22.888   3.652
  171    HG3  GLU  23           1HG      GLU  23   9.922  23.971   4.292
  172    H    ARG  24           HN       ARG  24   9.704  22.453  -0.406
  173    HA   ARG  24           HA       ARG  24  10.345  24.554  -2.346
  174    HB2  ARG  24           2HB      ARG  24  11.636  21.893  -1.765
  175    HB3  ARG  24           1HB      ARG  24  12.063  22.890  -3.145
  176    HG2  ARG  24           2HG      ARG  24  12.256  23.771  -0.278
  177    HG3  ARG  24           1HG      ARG  24  13.599  23.153  -1.241
  178    HD2  ARG  24           2HD      ARG  24  11.948  25.584  -1.914
  179    HD3  ARG  24           1HD      ARG  24  13.539  25.616  -1.155
  180    HE   ARG  24           HE       ARG  24  14.173  24.298  -3.323
  181   HH11  ARG  24          1HH1      ARG  24  11.912  26.963  -3.077
  182   HH12  ARG  24          2HH1      ARG  24  12.257  27.569  -4.664
  183   HH21  ARG  24          1HH2      ARG  24  14.617  25.089  -5.430
  184   HH22  ARG  24          2HH2      ARG  24  13.782  26.506  -6.011
  185    H    TYR  25           HN       TYR  25   9.070  21.213  -2.169
  186    HA   TYR  25           HA       TYR  25   8.489  21.458  -5.046
  187    HB2  TYR  25           2HB      TYR  25   9.243  18.969  -3.511
  188    HB3  TYR  25           1HB      TYR  25   8.821  19.020  -5.223
  189    HD1  TYR  25           2HD      TYR  25  10.250  20.670  -6.676
  190    HD2  TYR  25           1HD      TYR  25  11.478  19.145  -2.898
  191    HE1  TYR  25           2HE      TYR  25  12.584  21.198  -7.230
  192    HE2  TYR  25           1HE      TYR  25  13.819  19.675  -3.440
  193    HH   TYR  25           HH       TYR  25  15.221  20.020  -5.461
  194    H    ASP  26           HN       ASP  26   6.678  20.420  -5.885
  195    HA   ASP  26           HA       ASP  26   4.529  19.863  -3.948
  196    HB2  ASP  26           2HB      ASP  26   4.270  22.090  -4.949
  197    HB3  ASP  26           1HB      ASP  26   4.347  21.396  -6.557
  198    H    ILE  27           HN       ILE  27   2.893  18.404  -4.751
  199    HA   ILE  27           HA       ILE  27   4.145  16.304  -6.335
  200    HB   ILE  27           HB       ILE  27   1.528  16.259  -4.820
  201   HG12  ILE  27          2HG1      ILE  27   4.243  15.149  -4.071
  202   HG13  ILE  27          1HG1      ILE  27   3.490  16.567  -3.352
  203   HG21  ILE  27          1HG2      ILE  27   3.133  14.023  -6.052
  204   HG22  ILE  27          2HG2      ILE  27   1.576  14.627  -6.622
  205   HG23  ILE  27          3HG2      ILE  27   1.691  13.821  -5.057
  206   HD11  ILE  27          3HD1      ILE  27   1.672  15.157  -2.502
  207   HD12  ILE  27          1HD1      ILE  27   3.252  14.648  -1.903
  208   HD13  ILE  27          2HD1      ILE  27   2.465  13.742  -3.196
  209    H    VAL  28           HN       VAL  28   3.893  16.404  -8.473
  210    HA   VAL  28           HA       VAL  28   1.555  17.628  -9.657
  211    HB   VAL  28           HB       VAL  28   3.667  16.068 -11.138
  212   HG11  VAL  28          1HG1      VAL  28   1.912  18.384 -11.939
  213   HG12  VAL  28          2HG1      VAL  28   1.683  16.697 -12.400
  214   HG13  VAL  28          3HG1      VAL  28   3.098  17.581 -12.968
  215   HG21  VAL  28          3HG2      VAL  28   4.911  18.166 -11.401
  216   HG22  VAL  28          1HG2      VAL  28   4.837  17.651  -9.716
  217   HG23  VAL  28          2HG2      VAL  28   3.797  18.956 -10.287
  218    H    GLU  29           HN       GLU  29   3.049  14.397  -9.643
  219    HA   GLU  29           HA       GLU  29   0.417  13.203  -9.595
  220    HB2  GLU  29           2HB      GLU  29   0.674  11.777 -11.486
  221    HB3  GLU  29           1HB      GLU  29   1.027  13.404 -12.040
  222    HG2  GLU  29           2HG      GLU  29   3.349  12.976 -12.127
  223    HG3  GLU  29           1HG      GLU  29   3.175  11.461 -11.245
  224    H    GLN  30           HN       GLN  30   0.466  10.964  -8.996
  225    HA   GLN  30           HA       GLN  30   2.965   9.761  -8.220
  226    HB2  GLN  30           2HB      GLN  30   2.407   9.549  -5.843
  227    HB3  GLN  30           1HB      GLN  30   2.537  11.242  -6.295
  228    HG2  GLN  30           2HG      GLN  30   0.207  11.550  -6.232
  229    HG3  GLN  30           1HG      GLN  30  -0.100   9.814  -6.194
  230   HE21  GLN  30          1HE2      GLN  30   0.142   8.693  -4.274
  231   HE22  GLN  30          2HE2      GLN  30   0.283   9.489  -2.744
  232    H    THR  31           HN       THR  31   2.382   7.653  -6.941
  233    HA   THR  31           HA       THR  31   0.377   6.206  -8.371
  234    HB   THR  31           HB       THR  31   1.742   5.364  -5.803
  235    HG1  THR  31           1HG      THR  31   2.777   5.767  -8.323
  236   HG21  THR  31          3HG2      THR  31  -0.106   3.934  -6.518
  237   HG22  THR  31          1HG2      THR  31   1.436   3.101  -6.716
  238   HG23  THR  31          2HG2      THR  31   0.612   3.781  -8.119
  239    H    GLU  32           HN       GLU  32  -1.739   6.017  -7.854
  240    HA   GLU  32           HA       GLU  32  -2.772   7.505  -5.637
  241    HB2  GLU  32           2HB      GLU  32  -4.998   6.495  -6.484
  242    HB3  GLU  32           1HB      GLU  32  -4.156   7.663  -7.492
  243    HG2  GLU  32           2HG      GLU  32  -3.229   5.831  -8.825
  244    HG3  GLU  32           1HG      GLU  32  -4.093   4.676  -7.816
  245    H    THR  33           HN       THR  33  -3.029   4.057  -6.530
  246    HA   THR  33           HA       THR  33  -3.003   3.415  -3.673
  247    HB   THR  33           HB       THR  33  -4.709   1.622  -4.113
  248    HG1  THR  33           1HG      THR  33  -5.327   1.329  -6.105
  249   HG21  THR  33          3HG2      THR  33  -5.343   3.710  -3.003
  250   HG22  THR  33          1HG2      THR  33  -6.648   3.106  -4.024
  251   HG23  THR  33          2HG2      THR  33  -5.651   4.453  -4.573
  252    H    VAL  34           HN       VAL  34  -2.259   1.257  -3.219
  253    HA   VAL  34           HA       VAL  34  -0.930  -0.030  -5.515
  254    HB   VAL  34           HB       VAL  34   0.701  -0.934  -3.728
  255   HG11  VAL  34          1HG1      VAL  34   2.141   1.046  -3.992
  256   HG12  VAL  34          2HG1      VAL  34   0.753   1.941  -4.619
  257   HG13  VAL  34          3HG1      VAL  34   1.376   0.542  -5.502
  258   HG21  VAL  34          3HG2      VAL  34  -0.494  -0.161  -1.761
  259   HG22  VAL  34          1HG2      VAL  34  -0.359   1.509  -2.310
  260   HG23  VAL  34          2HG2      VAL  34   1.088   0.611  -1.852
  261    H    GLN  35           HN       GLN  35  -0.869  -2.220  -5.603
  262    HA   GLN  35           HA       GLN  35  -2.895  -3.606  -4.034
  263    HB2  GLN  35           2HB      GLN  35  -3.075  -3.835  -6.440
  264    HB3  GLN  35           1HB      GLN  35  -1.401  -4.360  -6.553
  265    HG2  GLN  35           2HG      GLN  35  -1.977  -6.370  -5.251
  266    HG3  GLN  35           1HG      GLN  35  -3.661  -5.850  -5.241
  267   HE21  GLN  35          1HE2      GLN  35  -2.433  -8.264  -6.343
  268   HE22  GLN  35          2HE2      GLN  35  -2.857  -8.272  -8.027
  269    H    VAL  36           HN       VAL  36  -2.205  -4.599  -2.253
  270    HA   VAL  36           HA       VAL  36   0.470  -5.835  -2.316
  271    HB   VAL  36           HB       VAL  36  -1.043  -5.019   0.169
  272   HG11  VAL  36          1HG1      VAL  36   1.825  -5.844  -0.285
  273   HG12  VAL  36          2HG1      VAL  36   0.576  -6.783   0.537
  274   HG13  VAL  36          3HG1      VAL  36   1.158  -5.277   1.247
  275   HG21  VAL  36          3HG2      VAL  36   0.474  -3.107   0.319
  276   HG22  VAL  36          1HG2      VAL  36  -0.516  -3.028  -1.137
  277   HG23  VAL  36          2HG2      VAL  36   1.171  -3.532  -1.245
  278    H    ASP  37           HN       ASP  37   0.455  -7.940  -2.412
  279    HA   ASP  37           HA       ASP  37  -1.815  -9.434  -1.265
  280    HB2  ASP  37           2HB      ASP  37  -0.035 -10.145  -3.614
  281    HB3  ASP  37           1HB      ASP  37  -1.163 -11.268  -2.868
  282    H    LEU  38           HN       LEU  38  -1.337 -10.813   0.328
  283    HA   LEU  38           HA       LEU  38   1.504 -11.462   0.771
  284    HB2  LEU  38           2HB      LEU  38  -0.739 -11.257   2.788
  285    HB3  LEU  38           1HB      LEU  38   0.904 -11.746   3.156
  286    HG   LEU  38           HG       LEU  38   0.071  -9.029   2.134
  287   HD11  LEU  38          1HD1      LEU  38   0.987  -9.909   4.867
  288   HD12  LEU  38          2HD1      LEU  38  -0.651  -9.427   4.423
  289   HD13  LEU  38          3HD1      LEU  38   0.660  -8.248   4.368
  290   HD21  LEU  38          3HD2      LEU  38   2.294  -9.611   1.371
  291   HD22  LEU  38          1HD2      LEU  38   2.759 -10.079   3.005
  292   HD23  LEU  38          2HD2      LEU  38   2.392  -8.394   2.642
  293    H    GLU  39           HN       GLU  39   2.028 -13.531   0.546
  294    HA   GLU  39           HA       GLU  39  -0.139 -15.519   0.693
  295    HB2  GLU  39           2HB      GLU  39   2.278 -15.524  -1.116
  296    HB3  GLU  39           1HB      GLU  39   1.114 -16.837  -0.990
  297    HG2  GLU  39           2HG      GLU  39  -0.642 -15.401  -1.797
  298    HG3  GLU  39           1HG      GLU  39   0.466 -14.037  -1.830
  299    H    GLY  40           HN       GLY  40   0.580 -17.695   1.187
  300    HA2  GLY  40           2HA      GLY  40   2.633 -18.918   2.117
  301    HA3  GLY  40           1HA      GLY  40   2.678 -17.583   3.261
  302    HA   PRO  41           HA       PRO  41   0.362 -20.971   5.399
  303    HB2  PRO  41           2HB      PRO  41   1.270 -19.321   7.691
  304    HB3  PRO  41           1HB      PRO  41   1.361 -21.069   7.458
  305    HG2  PRO  41           2HG      PRO  41   3.537 -19.538   7.268
  306    HG3  PRO  41           1HG      PRO  41   3.296 -20.935   6.201
  307    HD2  PRO  41           2HD      PRO  41   2.957 -18.023   5.623
  308    HD3  PRO  41           1HD      PRO  41   3.599 -19.313   4.586
  309    H    ARG  42           HN       ARG  42  -1.759 -20.721   5.474
  310    HA   ARG  42           HA       ARG  42  -3.083 -18.255   5.482
  311    HB2  ARG  42           2HB      ARG  42  -5.157 -19.621   5.874
  312    HB3  ARG  42           1HB      ARG  42  -4.190 -20.105   4.493
  313    HG2  ARG  42           2HG      ARG  42  -4.718 -22.133   5.402
  314    HG3  ARG  42           1HG      ARG  42  -3.169 -21.820   6.181
  315    HD2  ARG  42           2HD      ARG  42  -4.340 -20.988   8.163
  316    HD3  ARG  42           1HD      ARG  42  -5.888 -21.304   7.380
  317    HE   ARG  42           HE       ARG  42  -3.987 -23.497   7.858
  318   HH11  ARG  42          1HH1      ARG  42  -7.085 -21.987   8.463
  319   HH12  ARG  42          2HH1      ARG  42  -7.792 -23.427   9.140
  320   HH21  ARG  42          1HH2      ARG  42  -4.892 -25.375   8.784
  321   HH22  ARG  42          2HH2      ARG  42  -6.532 -25.344   9.367
  322    H    GLY  43           HN       GLY  43  -2.104 -20.324   8.102
  323    HA2  GLY  43           2HA      GLY  43  -3.719 -19.277  10.148
  324    HA3  GLY  43           1HA      GLY  43  -2.134 -20.006  10.376
  325    H    VAL  44           HN       VAL  44  -0.473 -18.291   9.074
  326    HA   VAL  44           HA       VAL  44  -0.152 -16.215  10.950
  327    HB   VAL  44           HB       VAL  44   1.081 -16.392   8.192
  328   HG11  VAL  44          1HG1      VAL  44   1.991 -14.917  10.662
  329   HG12  VAL  44          2HG1      VAL  44   1.312 -14.187   9.209
  330   HG13  VAL  44          3HG1      VAL  44   2.866 -15.013   9.134
  331   HG21  VAL  44          3HG2      VAL  44   2.985 -17.467   9.310
  332   HG22  VAL  44          1HG2      VAL  44   1.512 -18.428   9.449
  333   HG23  VAL  44          2HG2      VAL  44   2.080 -17.481  10.823
  334    H    LEU  45           HN       LEU  45  -1.481 -16.275   7.688
  335    HA   LEU  45           HA       LEU  45  -1.868 -13.538   7.292
  336    HB2  LEU  45           2HB      LEU  45  -3.582 -15.835   6.330
  337    HB3  LEU  45           1HB      LEU  45  -3.603 -14.207   5.678
  338    HG   LEU  45           HG       LEU  45  -1.213 -16.051   5.593
  339   HD11  LEU  45          1HD1      LEU  45  -1.734 -16.270   3.210
  340   HD12  LEU  45          2HD1      LEU  45  -3.208 -15.333   3.450
  341   HD13  LEU  45          3HD1      LEU  45  -3.029 -16.910   4.222
  342   HD21  LEU  45          3HD2      LEU  45  -0.649 -13.666   5.582
  343   HD22  LEU  45          1HD2      LEU  45  -1.751 -13.411   4.228
  344   HD23  LEU  45          2HD2      LEU  45  -0.314 -14.417   4.021
  345    H    THR  46           HN       THR  46  -3.876 -15.951   8.890
  346    HA   THR  46           HA       THR  46  -6.112 -14.260   9.332
  347    HB   THR  46           HB       THR  46  -5.324 -16.742  10.878
  348    HG1  THR  46           1HG      THR  46  -5.480 -17.297   8.708
  349   HG21  THR  46          3HG2      THR  46  -7.996 -15.397  10.452
  350   HG22  THR  46          1HG2      THR  46  -7.090 -15.466  11.962
  351   HG23  THR  46          2HG2      THR  46  -7.751 -16.944  11.263
  352    H    VAL  47           HN       VAL  47  -3.389 -15.269  11.398
  353    HA   VAL  47           HA       VAL  47  -4.168 -13.864  13.707
  354    HB   VAL  47           HB       VAL  47  -1.361 -14.545  12.806
  355   HG11  VAL  47          1HG1      VAL  47  -1.346 -12.870  14.564
  356   HG12  VAL  47          2HG1      VAL  47  -0.805 -14.423  15.203
  357   HG13  VAL  47          3HG1      VAL  47  -2.439 -13.851  15.539
  358   HG21  VAL  47          3HG2      VAL  47  -2.766 -16.517  12.918
  359   HG22  VAL  47          1HG2      VAL  47  -3.303 -16.070  14.535
  360   HG23  VAL  47          2HG2      VAL  47  -1.619 -16.515  14.259
  361    H    PHE  48           HN       PHE  48  -2.261 -12.904  10.904
  362    HA   PHE  48           HA       PHE  48  -1.407 -10.395  11.838
  363    HB2  PHE  48           2HB      PHE  48  -0.456 -11.480   9.853
  364    HB3  PHE  48           1HB      PHE  48  -1.988 -11.309   9.009
  365    HD1  PHE  48           1HD      PHE  48   0.786  -9.379  10.529
  366    HD2  PHE  48           2HD      PHE  48  -2.470  -9.382   7.788
  367    HE1  PHE  48           1HE      PHE  48   1.522  -7.201   9.657
  368    HE2  PHE  48           2HE      PHE  48  -1.739  -7.202   6.912
  369    HZ   PHE  48           HZ       PHE  48   0.258  -6.110   7.847
  370    H    ARG  49           HN       ARG  49  -4.395 -11.444  10.293
  371    HA   ARG  49           HA       ARG  49  -5.404  -8.836   9.828
  372    HB2  ARG  49           2HB      ARG  49  -5.984 -10.736   8.456
  373    HB3  ARG  49           1HB      ARG  49  -6.632 -11.588   9.846
  374    HG2  ARG  49           2HG      ARG  49  -8.342 -10.696   8.402
  375    HG3  ARG  49           1HG      ARG  49  -8.424 -10.025  10.025
  376    HD2  ARG  49           2HD      ARG  49  -8.790  -8.325   8.258
  377    HD3  ARG  49           1HD      ARG  49  -7.399  -7.974   9.278
  378    HE   ARG  49           HE       ARG  49  -6.293  -9.283   7.193
  379   HH11  ARG  49          1HH1      ARG  49  -8.547  -6.623   7.343
  380   HH12  ARG  49          2HH1      ARG  49  -7.912  -5.830   5.939
  381   HH21  ARG  49          1HH2      ARG  49  -5.455  -8.233   5.314
  382   HH22  ARG  49          2HH2      ARG  49  -6.160  -6.735   4.793
  383    H    PHE  50           HN       PHE  50  -5.334 -10.947  12.557
  384    HA   PHE  50           HA       PHE  50  -7.584  -9.889  13.931
  385    HB2  PHE  50           2HB      PHE  50  -5.153 -11.432  14.805
  386    HB3  PHE  50           1HB      PHE  50  -6.351 -10.869  15.953
  387    HD1  PHE  50           2HD      PHE  50  -8.851 -11.333  14.483
  388    HD2  PHE  50           1HD      PHE  50  -5.350 -13.731  14.795
  389    HE1  PHE  50           2HE      PHE  50 -10.195 -13.345  14.059
  390    HE2  PHE  50           1HE      PHE  50  -6.691 -15.749  14.373
  391    HZ   PHE  50           HZ       PHE  50  -9.116 -15.558  14.002
  392    H    ALA  51           HN       ALA  51  -4.304  -8.898  13.525
  393    HA   ALA  51           HA       ALA  51  -4.374  -7.043  15.742
  394    HB1  ALA  51           1HB      ALA  51  -2.068  -6.529  15.087
  395    HB2  ALA  51           2HB      ALA  51  -2.239  -7.579  13.678
  396    HB3  ALA  51           3HB      ALA  51  -2.313  -8.260  15.302
  397    H    ARG  52           HN       ARG  52  -3.987  -4.775  15.443
  398    HA   ARG  52           HA       ARG  52  -5.645  -3.602  13.490
  399    HB2  ARG  52           2HB      ARG  52  -3.721  -2.599  15.538
  400    HB3  ARG  52           1HB      ARG  52  -4.372  -1.491  14.351
  401    HG2  ARG  52           2HG      ARG  52  -6.039  -3.183  16.191
  402    HG3  ARG  52           1HG      ARG  52  -5.608  -1.495  16.489
  403    HD2  ARG  52           2HD      ARG  52  -6.738  -0.829  14.440
  404    HD3  ARG  52           1HD      ARG  52  -7.129  -2.511  14.091
  405    HE   ARG  52           HE       ARG  52  -8.139  -1.836  16.627
  406   HH11  ARG  52          1HH1      ARG  52  -8.664  -1.062  13.252
  407   HH12  ARG  52          2HH1      ARG  52 -10.373  -0.817  13.440
  408   HH21  ARG  52          1HH2      ARG  52 -10.403  -1.484  16.882
  409   HH22  ARG  52          2HH2      ARG  52 -11.351  -1.032  15.497
  410    HA   PRO  53           HA       PRO  53  -2.908  -3.193  10.079
  411    HB2  PRO  53           2HB      PRO  53  -3.960  -0.546   9.465
  412    HB3  PRO  53           1HB      PRO  53  -4.132  -2.047   8.558
  413    HG2  PRO  53           2HG      PRO  53  -6.200  -0.895   9.870
  414    HG3  PRO  53           1HG      PRO  53  -6.057  -2.651   9.652
  415    HD2  PRO  53           2HD      PRO  53  -5.470  -0.982  12.064
  416    HD3  PRO  53           1HD      PRO  53  -6.207  -2.595  11.955
  417    H    SER  54           HN       SER  54  -0.842  -2.769  10.307
  418    HA   SER  54           HA       SER  54  -0.013  -0.077  11.040
  419    HB2  SER  54           2HB      SER  54   1.265  -2.733  11.639
  420    HB3  SER  54           1HB      SER  54   1.982  -1.182  11.994
  421    HG   SER  54           HG       SER  54  -0.586  -1.486  12.922
  422    H    TYR  55           HN       TYR  55  -0.427  -2.028   8.578
  423    HA   TYR  55           HA       TYR  55   2.141  -1.859   7.298
  424    HB2  TYR  55           2HB      TYR  55   0.792  -2.749   5.293
  425    HB3  TYR  55           1HB      TYR  55   1.007  -3.798   6.683
  426    HD1  TYR  55           1HD      TYR  55  -1.414  -1.792   4.773
  427    HD2  TYR  55           2HD      TYR  55  -0.867  -4.442   8.051
  428    HE1  TYR  55           1HE      TYR  55  -3.844  -2.150   4.881
  429    HE2  TYR  55           2HE      TYR  55  -3.292  -4.806   8.173
  430    HH   TYR  55           HH       TYR  55  -5.418  -3.897   5.720
  431    H    GLU  56           HN       GLU  56   2.873  -0.235   6.142
  432    HA   GLU  56           HA       GLU  56   0.966   1.609   4.899
  433    HB2  GLU  56           2HB      GLU  56   1.734   2.426   7.178
  434    HB3  GLU  56           1HB      GLU  56   3.349   2.544   6.501
  435    HG2  GLU  56           2HG      GLU  56   2.653   4.222   4.955
  436    HG3  GLU  56           1HG      GLU  56   0.962   4.004   5.405
  437    H    VAL  57           HN       VAL  57   1.718   2.545   3.016
  438    HA   VAL  57           HA       VAL  57   4.318   1.548   2.048
  439    HB   VAL  57           HB       VAL  57   1.942   2.224   0.302
  440   HG11  VAL  57          1HG1      VAL  57   4.492   0.703  -0.228
  441   HG12  VAL  57          2HG1      VAL  57   4.083   2.314  -0.820
  442   HG13  VAL  57          3HG1      VAL  57   3.170   0.912  -1.376
  443   HG21  VAL  57          3HG2      VAL  57   2.789  -0.506   1.283
  444   HG22  VAL  57          1HG2      VAL  57   1.525  -0.175   0.096
  445   HG23  VAL  57          2HG2      VAL  57   1.332   0.362   1.767
  446    H    PHE  58           HN       PHE  58   5.751   3.070   1.528
  447    HA   PHE  58           HA       PHE  58   4.819   5.751   0.868
  448    HB2  PHE  58           2HB      PHE  58   6.299   6.794   2.532
  449    HB3  PHE  58           1HB      PHE  58   5.080   5.787   3.302
  450    HD1  PHE  58           1HD      PHE  58   5.717   3.620   4.295
  451    HD2  PHE  58           2HD      PHE  58   8.616   6.307   2.724
  452    HE1  PHE  58           1HE      PHE  58   7.484   2.423   5.518
  453    HE2  PHE  58           2HE      PHE  58  10.389   5.114   3.941
  454    HZ   PHE  58           HZ       PHE  58   9.824   3.167   5.337
  455    H    VAL  59           HN       VAL  59   6.366   7.056  -0.152
  456    HA   VAL  59           HA       VAL  59   8.848   5.688  -0.969
  457    HB   VAL  59           HB       VAL  59   7.374   7.692  -2.672
  458   HG11  VAL  59          1HG1      VAL  59   8.826   6.870  -4.454
  459   HG12  VAL  59          2HG1      VAL  59   9.607   5.779  -3.308
  460   HG13  VAL  59          3HG1      VAL  59   9.752   7.525  -3.105
  461   HG21  VAL  59          3HG2      VAL  59   7.306   4.687  -2.886
  462   HG22  VAL  59          1HG2      VAL  59   6.661   5.808  -4.084
  463   HG23  VAL  59          2HG2      VAL  59   5.953   5.740  -2.470
  464    H    ASP  60           HN       ASP  60  10.669   6.852  -0.708
  465    HA   ASP  60           HA       ASP  60  10.362   9.515   0.485
  466    HB2  ASP  60           2HB      ASP  60  11.515   8.006   1.968
  467    HB3  ASP  60           1HB      ASP  60  12.614   7.507   0.685
  468    H    LEU  61           HN       LEU  61  10.568  11.059  -0.948
  469    HA   LEU  61           HA       LEU  61  12.863  10.967  -2.777
  470    HB2  LEU  61           2HB      LEU  61  10.030  11.747  -3.483
  471    HB3  LEU  61           1HB      LEU  61  11.418  12.068  -4.505
  472    HG   LEU  61           HG       LEU  61  10.503   9.309  -3.681
  473   HD11  LEU  61          1HD1      LEU  61  10.143  10.757  -6.298
  474   HD12  LEU  61          2HD1      LEU  61   8.872  10.399  -5.128
  475   HD13  LEU  61          3HD1      LEU  61   9.697   9.084  -5.963
  476   HD21  LEU  61          3HD2      LEU  61  12.556  10.215  -5.697
  477   HD22  LEU  61          1HD2      LEU  61  12.039   8.549  -5.433
  478   HD23  LEU  61          2HD2      LEU  61  12.887   9.423  -4.157
  479    H    THR  62           HN       THR  62  12.382  12.190  -0.208
  480    HA   THR  62           HA       THR  62  11.825  14.936  -0.372
  481    HB   THR  62           HB       THR  62  13.765  13.681   1.574
  482    HG1  THR  62           1HG      THR  62  12.091  12.353   1.896
  483   HG21  THR  62          3HG2      THR  62  11.750  15.915   1.866
  484   HG22  THR  62          1HG2      THR  62  13.492  16.122   1.683
  485   HG23  THR  62          2HG2      THR  62  12.845  15.334   3.121
  486    H    GLU  63           HN       GLU  63  14.601  13.061  -1.208
  487    HA   GLU  63           HA       GLU  63  16.362  15.383  -1.393
  488    HB2  GLU  63           2HB      GLU  63  16.875  12.464  -1.958
  489    HB3  GLU  63           1HB      GLU  63  18.089  13.721  -1.946
  490    HG2  GLU  63           2HG      GLU  63  17.839  14.036   0.364
  491    HG3  GLU  63           1HG      GLU  63  16.414  13.015   0.407
  492    H    ALA  64           HN       ALA  64  13.989  14.255  -3.266
  493    HA   ALA  64           HA       ALA  64  15.483  14.365  -5.790
  494    HB1  ALA  64           1HB      ALA  64  14.038  12.409  -5.452
  495    HB2  ALA  64           2HB      ALA  64  13.519  13.379  -6.830
  496    HB3  ALA  64           3HB      ALA  64  12.641  13.474  -5.304
  497    H    GLY  65           HN       GLY  65  15.056  15.858  -7.355
  498    HA2  GLY  65           2HA      GLY  65  13.619  18.227  -6.418
  499    HA3  GLY  65           1HA      GLY  65  14.787  18.176  -7.728
  500    H    GLU  66           HN       GLU  66  13.852  18.734  -9.556
  501    HA   GLU  66           HA       GLU  66  10.993  18.448  -9.875
  502    HB2  GLU  66           2HB      GLU  66  13.104  19.678 -11.639
  503    HB3  GLU  66           1HB      GLU  66  11.377  19.740 -11.955
  504    HG2  GLU  66           2HG      GLU  66  10.984  21.077 -10.043
  505    HG3  GLU  66           1HG      GLU  66  12.627  20.826  -9.450
  506    H    GLY  67           HN       GLY  67   9.989  17.515 -11.690
  507    HA2  GLY  67           2HA      GLY  67   9.966  16.170 -13.650
  508    HA3  GLY  67           1HA      GLY  67  11.574  15.593 -13.236
  509    H    SER  68           HN       SER  68   9.653  13.782 -13.936
  510    HA   SER  68           HA       SER  68   8.510  12.673 -11.525
  511    HB2  SER  68           2HB      SER  68   7.336  12.423 -13.659
  512    HB3  SER  68           1HB      SER  68   8.698  11.521 -14.318
  513    HG   SER  68           HG       SER  68   7.184  10.063 -13.606
  514    H    HIS  69           HN       HIS  69   9.204  10.870 -10.467
  515    HA   HIS  69           HA       HIS  69  11.840   9.820 -11.249
  516    HB2  HIS  69           2HB      HIS  69  10.956  10.448  -8.418
  517    HB3  HIS  69           1HB      HIS  69  12.491   9.721  -8.880
  518    HD1  HIS  69           1HD      HIS  69  10.762  12.975  -8.545
  519    HD2  HIS  69           2HD      HIS  69  14.317  11.534 -10.152
  520    HE1  HIS  69           1HE      HIS  69  12.193  15.001  -8.942
  521    HE2  HIS  69           2HE      HIS  69  14.330  14.119  -9.946
  522    H    THR  70           HN       THR  70  11.779   7.699 -11.530
  523    HA   THR  70           HA       THR  70   9.560   6.211 -10.306
  524    HB   THR  70           HB       THR  70  11.083   5.403 -12.788
  525    HG1  THR  70           1HG      THR  70   9.060   6.265 -13.817
  526   HG21  THR  70          3HG2      THR  70   9.812   3.631 -11.678
  527   HG22  THR  70          1HG2      THR  70   9.076   4.058 -13.221
  528   HG23  THR  70          2HG2      THR  70   8.363   4.634 -11.713
  529    H    VAL  71           HN       VAL  71  10.159   4.927  -8.712
  530    HA   VAL  71           HA       VAL  71  12.658   3.405  -8.918
  531    HB   VAL  71           HB       VAL  71  13.123   3.814  -6.491
  532   HG11  VAL  71          1HG1      VAL  71  13.167   6.267  -8.245
  533   HG12  VAL  71          2HG1      VAL  71  14.396   5.005  -8.186
  534   HG13  VAL  71          3HG1      VAL  71  14.123   6.035  -6.782
  535   HG21  VAL  71          3HG2      VAL  71  12.104   5.790  -5.417
  536   HG22  VAL  71          1HG2      VAL  71  10.918   4.534  -5.777
  537   HG23  VAL  71          2HG2      VAL  71  11.027   5.964  -6.802
  538    H    ASP  72           HN       ASP  72  12.686   1.612  -7.224
  539    HA   ASP  72           HA       ASP  72  10.052   0.428  -7.111
  540    HB2  ASP  72           2HB      ASP  72  11.128  -1.569  -6.306
  541    HB3  ASP  72           1HB      ASP  72  12.058  -0.937  -7.657
  542    H    VAL  73           HN       VAL  73   8.845   0.061  -5.304
  543    HA   VAL  73           HA       VAL  73   9.322   2.060  -3.260
  544    HB   VAL  73           HB       VAL  73   6.900   0.303  -3.659
  545   HG11  VAL  73          1HG1      VAL  73   7.265   2.845  -2.081
  546   HG12  VAL  73          2HG1      VAL  73   7.035   1.227  -1.412
  547   HG13  VAL  73          3HG1      VAL  73   5.738   1.999  -2.328
  548   HG21  VAL  73          3HG2      VAL  73   5.902   2.269  -4.747
  549   HG22  VAL  73          1HG2      VAL  73   7.298   1.654  -5.631
  550   HG23  VAL  73          2HG2      VAL  73   7.454   3.103  -4.635
  551    H    GLU  74           HN       GLU  74  10.034   1.690  -1.283
  552    HA   GLU  74           HA       GLU  74  10.189  -1.019  -0.239
  553    HB2  GLU  74           2HB      GLU  74  12.124   0.443   0.058
  554    HB3  GLU  74           1HB      GLU  74  11.132   1.630   0.891
  555    HG2  GLU  74           2HG      GLU  74  10.828   0.167   2.755
  556    HG3  GLU  74           1HG      GLU  74  11.590  -1.169   1.898
  557    H    HIS  75           HN       HIS  75   9.257  -1.591   1.835
  558    HA   HIS  75           HA       HIS  75   6.898   0.024   2.512
  559    HB2  HIS  75           2HB      HIS  75   5.668  -2.270   2.681
  560    HB3  HIS  75           1HB      HIS  75   5.847  -1.496   1.111
  561    HD1  HIS  75           1HD      HIS  75   7.353  -2.643  -0.614
  562    HD2  HIS  75           2HD      HIS  75   7.201  -4.622   3.038
  563    HE1  HIS  75           1HE      HIS  75   8.390  -4.889  -1.025
  564    HE2  HIS  75           2HE      HIS  75   8.508  -5.972   1.245
  565    H    ARG  76           HN       ARG  76   6.028  -0.297   4.589
  566    HA   ARG  76           HA       ARG  76   7.672  -1.877   6.440
  567    HB2  ARG  76           2HB      ARG  76   8.420   0.535   6.386
  568    HB3  ARG  76           1HB      ARG  76   6.829   0.977   6.982
  569    HG2  ARG  76           2HG      ARG  76   8.456   0.929   8.784
  570    HG3  ARG  76           1HG      ARG  76   7.223  -0.312   9.020
  571    HD2  ARG  76           2HD      ARG  76   9.518  -1.110   9.507
  572    HD3  ARG  76           1HD      ARG  76   8.722  -2.023   8.227
  573    HE   ARG  76           HE       ARG  76  10.348   0.142   7.247
  574   HH11  ARG  76          1HH1      ARG  76  10.438  -3.176   8.377
  575   HH12  ARG  76          2HH1      ARG  76  11.799  -3.609   7.386
  576   HH21  ARG  76          1HH2      ARG  76  12.129  -0.413   5.956
  577   HH22  ARG  76          2HH2      ARG  76  12.774  -2.026   6.009
  578    H    GLY  77           HN       GLY  77   6.580  -2.366   8.458
  579    HA2  GLY  77           2HA      GLY  77   4.461  -2.037   9.737
  580    HA3  GLY  77           1HA      GLY  77   3.649  -2.216   8.188
  581    H    PHE  78           HN       PHE  78   3.904  -4.275   7.069
  582    HA   PHE  78           HA       PHE  78   3.734  -6.489   8.898
  583    HB2  PHE  78           2HB      PHE  78   3.391  -7.810   6.748
  584    HB3  PHE  78           1HB      PHE  78   2.196  -6.567   7.094
  585    HD1  PHE  78           1HD      PHE  78   2.067  -4.558   5.755
  586    HD2  PHE  78           2HD      PHE  78   4.925  -7.586   4.896
  587    HE1  PHE  78           1HE      PHE  78   2.450  -3.556   3.546
  588    HE2  PHE  78           2HE      PHE  78   5.317  -6.585   2.680
  589    HZ   PHE  78           HZ       PHE  78   4.078  -4.569   2.006
  590    HA   PRO  79           HA       PRO  79   7.979  -7.706   8.505
  591    HB2  PRO  79           2HB      PRO  79   7.827 -10.196   9.512
  592    HB3  PRO  79           1HB      PRO  79   7.612  -8.766  10.527
  593    HG2  PRO  79           2HG      PRO  79   5.552 -10.588   9.356
  594    HG3  PRO  79           1HG      PRO  79   5.617  -9.860  10.972
  595    HD2  PRO  79           2HD      PRO  79   4.086  -8.892   8.909
  596    HD3  PRO  79           1HD      PRO  79   4.681  -7.902  10.256
  597    H    GLY  80           HN       GLY  80   9.357  -8.975   7.234
  598    HA2  GLY  80           2HA      GLY  80   8.142  -9.988   4.809
  599    HA3  GLY  80           1HA      GLY  80   9.862  -9.834   5.137
  600    H    ASP  81           HN       ASP  81   7.426 -11.566   7.013
  601    HA   ASP  81           HA       ASP  81   9.038 -13.976   6.921
  602    HB2  ASP  81           2HB      ASP  81   7.967 -13.282   9.036
  603    HB3  ASP  81           1HB      ASP  81   6.391 -13.446   8.276
  604    H    LEU  82           HN       LEU  82   6.096 -12.698   5.624
  605    HA   LEU  82           HA       LEU  82   5.343 -15.244   4.414
  606    HB2  LEU  82           2HB      LEU  82   3.944 -12.567   4.416
  607    HB3  LEU  82           1HB      LEU  82   3.290 -14.059   3.771
  608    HG   LEU  82           HG       LEU  82   4.000 -13.673   6.678
  609   HD11  LEU  82          1HD1      LEU  82   1.601 -13.422   7.056
  610   HD12  LEU  82          2HD1      LEU  82   1.321 -13.460   5.315
  611   HD13  LEU  82          3HD1      LEU  82   2.227 -12.127   6.032
  612   HD21  LEU  82          3HD2      LEU  82   3.981 -15.993   5.873
  613   HD22  LEU  82          1HD2      LEU  82   2.345 -15.760   5.262
  614   HD23  LEU  82          2HD2      LEU  82   2.659 -15.676   6.995
  615    H    ALA  83           HN       ALA  83   4.352 -14.860   2.091
  616    HA   ALA  83           HA       ALA  83   6.450 -13.787   0.419
  617    HB1  ALA  83           1HB      ALA  83   3.785 -15.005  -0.298
  618    HB2  ALA  83           2HB      ALA  83   5.337 -15.842  -0.248
  619    HB3  ALA  83           3HB      ALA  83   5.055 -14.577  -1.443
  620    H    VAL  84           HN       VAL  84   6.571 -11.697   0.062
  621    HA   VAL  84           HA       VAL  84   4.183 -10.050   0.455
  622    HB   VAL  84           HB       VAL  84   7.104  -9.276   0.370
  623   HG11  VAL  84          1HG1      VAL  84   4.667  -7.595   0.933
  624   HG12  VAL  84          2HG1      VAL  84   5.718  -7.471  -0.476
  625   HG13  VAL  84          3HG1      VAL  84   6.339  -7.066   1.123
  626   HG21  VAL  84          3HG2      VAL  84   5.165  -9.388   2.680
  627   HG22  VAL  84          1HG2      VAL  84   6.844  -8.852   2.757
  628   HG23  VAL  84          2HG2      VAL  84   6.471 -10.532   2.374
  629    H    THR  85           HN       THR  85   3.100  -9.500  -1.331
  630    HA   THR  85           HA       THR  85   4.710  -8.769  -3.682
  631    HB   THR  85           HB       THR  85   1.812  -9.536  -3.797
  632    HG1  THR  85           1HG      THR  85   3.172 -11.306  -3.028
  633   HG21  THR  85          3HG2      THR  85   2.355  -9.923  -6.180
  634   HG22  THR  85          1HG2      THR  85   3.997  -9.350  -5.869
  635   HG23  THR  85          2HG2      THR  85   2.628  -8.254  -5.679
  636    H    VAL  86           HN       VAL  86   4.640  -6.792  -4.270
  637    HA   VAL  86           HA       VAL  86   2.352  -5.053  -3.632
  638    HB   VAL  86           HB       VAL  86   4.681  -3.489  -4.061
  639   HG11  VAL  86          1HG1      VAL  86   2.765  -2.746  -2.782
  640   HG12  VAL  86          2HG1      VAL  86   4.216  -2.632  -1.787
  641   HG13  VAL  86          3HG1      VAL  86   3.079  -3.958  -1.541
  642   HG21  VAL  86          3HG2      VAL  86   5.139  -5.638  -2.003
  643   HG22  VAL  86          1HG2      VAL  86   6.057  -4.130  -2.078
  644   HG23  VAL  86          2HG2      VAL  86   6.109  -5.263  -3.431
  645    H    GLU  87           HN       GLU  87   1.474  -4.594  -5.780
  646    HA   GLU  87           HA       GLU  87   3.736  -4.140  -7.594
  647    HB2  GLU  87           2HB      GLU  87   1.156  -5.489  -8.292
  648    HB3  GLU  87           1HB      GLU  87   2.379  -5.013  -9.461
  649    HG2  GLU  87           2HG      GLU  87   4.000  -6.442  -8.149
  650    HG3  GLU  87           1HG      GLU  87   2.601  -7.074  -7.287
  651    HA   PRO  88           HA       PRO  88   3.401  -1.647  -9.889
  652    HB2  PRO  88           2HB      PRO  88   4.411   0.701  -8.854
  653    HB3  PRO  88           1HB      PRO  88   2.758   0.521  -9.432
  654    HG2  PRO  88           2HG      PRO  88   3.612   1.005  -6.749
  655    HG3  PRO  88           1HG      PRO  88   1.956   0.710  -7.308
  656    HD2  PRO  88           2HD      PRO  88   3.934  -1.208  -6.140
  657    HD3  PRO  88           1HD      PRO  88   2.156  -1.201  -6.021
  658    H    ARG  89           HN       ARG  89   5.518  -2.292 -10.400
  659    HA   ARG  89           HA       ARG  89   7.025  -3.177  -8.045
  660    HB2  ARG  89           2HB      ARG  89   7.482  -3.740 -10.988
  661    HB3  ARG  89           1HB      ARG  89   8.441  -4.413  -9.672
  662    HG2  ARG  89           2HG      ARG  89   6.123  -5.179  -8.771
  663    HG3  ARG  89           1HG      ARG  89   5.632  -4.986 -10.452
  664    HD2  ARG  89           2HD      ARG  89   7.385  -6.490 -11.160
  665    HD3  ARG  89           1HD      ARG  89   7.945  -6.659  -9.502
  666    HE   ARG  89           HE       ARG  89   5.208  -7.467 -10.231
  667   HH11  ARG  89          1HH1      ARG  89   8.400  -8.262  -9.015
  668   HH12  ARG  89          2HH1      ARG  89   7.926  -9.835  -8.443
  669   HH21  ARG  89          1HH2      ARG  89   4.589  -9.524  -9.472
  670   HH22  ARG  89          2HH2      ARG  89   5.769 -10.553  -8.712
  671    H    MET  90           HN       MET  90   7.082  -0.909 -10.575
  672    HA   MET  90           HA       MET  90   9.127   0.563  -9.097
  673    HB2  MET  90           2HB      MET  90   9.884  -0.609 -11.372
  674    HB3  MET  90           1HB      MET  90   9.074   0.779 -12.083
  675    HG2  MET  90           2HG      MET  90  10.531   2.276 -10.831
  676    HG3  MET  90           1HG      MET  90  11.332   0.890 -10.100
  677    HE1  MET  90           3HE      MET  90  12.938   3.196 -11.610
  678    HE2  MET  90           1HE      MET  90  14.088   2.227 -12.533
  679    HE3  MET  90           2HE      MET  90  13.699   1.786 -10.868
  680    H    ALA  91           HN       ALA  91   8.296   2.533  -8.606
  681    HA   ALA  91           HA       ALA  91   5.843   3.308 -10.048
  682    HB1  ALA  91           1HB      ALA  91   5.348   2.384  -7.832
  683    HB2  ALA  91           2HB      ALA  91   4.915   4.090  -7.942
  684    HB3  ALA  91           3HB      ALA  91   6.386   3.604  -7.097
  685    H    ARG  92           HN       ARG  92   5.430   5.486 -10.300
  686    HA   ARG  92           HA       ARG  92   7.833   7.153 -10.076
  687    HB2  ARG  92           2HB      ARG  92   6.983   8.422 -11.959
  688    HB3  ARG  92           1HB      ARG  92   7.047   6.717 -12.375
  689    HG2  ARG  92           2HG      ARG  92   4.637   6.535 -11.973
  690    HG3  ARG  92           1HG      ARG  92   4.583   8.252 -11.578
  691    HD2  ARG  92           2HD      ARG  92   3.858   7.941 -13.851
  692    HD3  ARG  92           1HD      ARG  92   5.421   8.758 -13.845
  693    HE   ARG  92           HE       ARG  92   6.440   6.658 -14.492
  694   HH11  ARG  92          1HH1      ARG  92   2.950   6.842 -14.744
  695   HH12  ARG  92          2HH1      ARG  92   2.843   5.569 -15.921
  696   HH21  ARG  92          1HH2      ARG  92   6.307   4.978 -16.017
  697   HH22  ARG  92          2HH2      ARG  92   4.754   4.497 -16.640
  698    H    VAL  93           HN       VAL  93   7.798   8.927  -8.907
  699    HA   VAL  93           HA       VAL  93   5.202  10.190  -8.325
  700    HB   VAL  93           HB       VAL  93   7.624  10.171  -6.502
  701   HG11  VAL  93          1HG1      VAL  93   6.202  11.354  -4.911
  702   HG12  VAL  93          2HG1      VAL  93   4.887  11.366  -6.085
  703   HG13  VAL  93          3HG1      VAL  93   6.366  12.271  -6.409
  704   HG21  VAL  93          3HG2      VAL  93   6.228   8.874  -4.961
  705   HG22  VAL  93          1HG2      VAL  93   6.480   8.019  -6.484
  706   HG23  VAL  93          2HG2      VAL  93   4.944   8.828  -6.170
  707    H    GLN  94           HN       GLN  94   5.066  12.160  -9.207
  708    HA   GLN  94           HA       GLN  94   7.533  13.297 -10.299
  709    HB2  GLN  94           2HB      GLN  94   5.707  12.886 -11.880
  710    HB3  GLN  94           1HB      GLN  94   4.645  13.918 -10.933
  711    HG2  GLN  94           2HG      GLN  94   6.087  15.831 -11.405
  712    HG3  GLN  94           1HG      GLN  94   7.143  14.797 -12.362
  713   HE21  GLN  94          1HE2      GLN  94   6.809  16.011 -14.208
  714   HE22  GLN  94          2HE2      GLN  94   5.313  15.983 -15.070
  715    H    LEU  95           HN       LEU  95   8.458  14.914  -9.315
  716    HA   LEU  95           HA       LEU  95   6.821  16.684  -7.628
  717    HB2  LEU  95           2HB      LEU  95   9.738  15.943  -7.339
  718    HB3  LEU  95           1HB      LEU  95   8.906  17.131  -6.356
  719    HG   LEU  95           HG       LEU  95   8.257  14.181  -6.447
  720   HD11  LEU  95          1HD1      LEU  95  10.396  14.606  -5.379
  721   HD12  LEU  95          2HD1      LEU  95   9.186  14.148  -4.178
  722   HD13  LEU  95          3HD1      LEU  95   9.659  15.838  -4.354
  723   HD21  LEU  95          3HD2      LEU  95   6.293  15.559  -5.971
  724   HD22  LEU  95          1HD2      LEU  95   7.180  16.384  -4.687
  725   HD23  LEU  95          2HD2      LEU  95   6.807  14.667  -4.539
  726    H    GLU  96           HN       GLU  96   6.849  18.774  -8.083
  727    HA   GLU  96           HA       GLU  96   8.978  19.861  -9.770
  728    HB2  GLU  96           2HB      GLU  96   6.987  19.222 -11.202
  729    HB3  GLU  96           1HB      GLU  96   6.047  20.404 -10.304
  730    HG2  GLU  96           2HG      GLU  96   7.488  22.187 -11.092
  731    HG3  GLU  96           1HG      GLU  96   8.504  21.016 -11.932
  732    H    GLU  97           HN       GLU  97   9.375  22.067  -9.352
  733    HA   GLU  97           HA       GLU  97   8.888  22.856  -6.703
  734    HB2  GLU  97           2HB      GLU  97  10.788  23.540  -8.305
  735    HB3  GLU  97           1HB      GLU  97   9.675  24.767  -8.889
  736    HG2  GLU  97           2HG      GLU  97  10.369  24.510  -5.983
  737    HG3  GLU  97           1HG      GLU  97  11.363  25.436  -7.104
  738    H    ARG  98           HN       ARG  98   6.818  22.940  -6.210
  739    HA   ARG  98           HA       ARG  98   4.668  23.460  -6.044
  740    HB2  ARG  98           2HB      ARG  98   5.570  25.600  -5.407
  741    HB3  ARG  98           1HB      ARG  98   5.589  26.101  -7.085
  742    HG2  ARG  98           2HG      ARG  98   3.689  27.066  -5.932
  743    HG3  ARG  98           1HG      ARG  98   3.151  25.927  -7.164
  744    HD2  ARG  98           2HD      ARG  98   1.835  25.544  -5.212
  745    HD3  ARG  98           1HD      ARG  98   2.963  24.197  -5.363
  746    HE   ARG  98           HE       ARG  98   3.848  26.370  -3.657
  747   HH11  ARG  98          1HH1      ARG  98   2.268  23.224  -3.814
  748   HH12  ARG  98          2HH1      ARG  98   2.457  22.921  -2.116
  749   HH21  ARG  98          1HH2      ARG  98   4.086  25.951  -1.447
  750   HH22  ARG  98          2HH2      ARG  98   3.477  24.464  -0.765
  751    H    GLN  99           HN       GLN  99   3.072  22.807  -7.092
  752    HA   GLN  99           HA       GLN  99   2.645  23.578  -9.882
  753    HB2  GLN  99           2HB      GLN  99   2.603  20.974  -8.572
  754    HB3  GLN  99           1HB      GLN  99   1.103  21.330  -9.402
  755    HG2  GLN  99           2HG      GLN  99   3.807  21.524 -10.685
  756    HG3  GLN  99           1HG      GLN  99   2.796  20.084 -10.743
  757   HE21  GLN  99          1HE2      GLN  99   3.783  21.759 -12.901
  758   HE22  GLN  99          2HE2      GLN  99   2.368  22.309 -13.756
  759    H    THR 100           HN       THR 100   0.533  21.907  -7.624
  760    HA   THR 100           HA       THR 100  -0.538  23.979  -6.221
  761    HB   THR 100           HB       THR 100  -1.329  25.040  -8.230
  762    HG1  THR 100           1HG      THR 100  -3.296  25.484  -7.460
  763   HG21  THR 100          3HG2      THR 100  -2.990  24.043  -9.715
  764   HG22  THR 100          1HG2      THR 100  -2.921  22.538  -8.795
  765   HG23  THR 100          2HG2      THR 100  -1.511  23.087  -9.698
  766    H    VAL 101           HN       VAL 101  -0.201  21.940  -4.981
  767    HA   VAL 101           HA       VAL 101  -2.484  20.161  -5.033
  768    HB   VAL 101           HB       VAL 101  -0.315  20.410  -2.931
  769   HG11  VAL 101          1HG1      VAL 101  -2.414  18.269  -3.310
  770   HG12  VAL 101          2HG1      VAL 101  -2.388  19.471  -2.019
  771   HG13  VAL 101          3HG1      VAL 101  -1.117  18.252  -2.112
  772   HG21  VAL 101          3HG2      VAL 101  -0.685  18.419  -5.169
  773   HG22  VAL 101          1HG2      VAL 101   0.547  18.326  -3.908
  774   HG23  VAL 101          2HG2      VAL 101   0.568  19.657  -5.065
  775    H    SER 102           HN       SER 102  -3.963  21.959  -5.001
  776    HA   SER 102           HA       SER 102  -4.427  23.039  -2.302
  777    HB2  SER 102           2HB      SER 102  -5.816  24.758  -3.569
  778    HB3  SER 102           1HB      SER 102  -4.076  24.834  -3.840
  779    HG   SER 102           HG       SER 102  -4.372  24.325  -5.867
  780    H    VAL 103           HN       VAL 103  -5.269  20.536  -4.011
  781    HA   VAL 103           HA       VAL 103  -8.151  20.731  -3.482
  782    HB   VAL 103           HB       VAL 103  -7.709  20.420  -5.846
  783   HG11  VAL 103          1HG1      VAL 103  -6.568  18.424  -6.705
  784   HG12  VAL 103          2HG1      VAL 103  -6.169  17.954  -5.054
  785   HG13  VAL 103          3HG1      VAL 103  -5.496  19.434  -5.736
  786   HG21  VAL 103          3HG2      VAL 103  -8.708  17.860  -4.607
  787   HG22  VAL 103          1HG2      VAL 103  -8.977  18.373  -6.272
  788   HG23  VAL 103          2HG2      VAL 103  -9.674  19.299  -4.940
  789    HA   PRO 104           HA       PRO 104  -7.514  17.542  -0.408
  790    HB2  PRO 104           2HB      PRO 104 -10.155  16.885  -0.116
  791    HB3  PRO 104           1HB      PRO 104  -9.397  18.274   0.671
  792    HG2  PRO 104           2HG      PRO 104 -11.071  18.175  -1.801
  793    HG3  PRO 104           1HG      PRO 104 -11.072  19.370  -0.492
  794    HD2  PRO 104           2HD      PRO 104  -9.860  19.814  -2.871
  795    HD3  PRO 104           1HD      PRO 104  -9.252  20.494  -1.349
  796    H    VAL 105           HN       VAL 105  -7.020  15.462  -0.716
  797    HA   VAL 105           HA       VAL 105  -7.448  14.176  -3.181
  798    HB   VAL 105           HB       VAL 105  -6.554  12.134  -2.076
  799   HG11  VAL 105          1HG1      VAL 105  -5.028  14.687  -1.546
  800   HG12  VAL 105          2HG1      VAL 105  -5.042  13.769  -3.054
  801   HG13  VAL 105          3HG1      VAL 105  -4.332  13.068  -1.602
  802   HG21  VAL 105          3HG2      VAL 105  -7.519  12.465   0.148
  803   HG22  VAL 105          1HG2      VAL 105  -6.487  13.874   0.395
  804   HG23  VAL 105          2HG2      VAL 105  -5.769  12.270   0.243
  805    H    THR 106           HN       THR 106  -8.840  12.566  -3.815
  806    HA   THR 106           HA       THR 106 -11.141  12.189  -2.027
  807    HB   THR 106           HB       THR 106 -11.680  13.384  -4.086
  808    HG1  THR 106           1HG      THR 106 -12.793  10.766  -3.903
  809   HG21  THR 106          3HG2      THR 106 -11.638  12.258  -6.269
  810   HG22  THR 106          1HG2      THR 106 -10.805  10.887  -5.535
  811   HG23  THR 106          2HG2      THR 106 -10.021  12.465  -5.599
  812    H    VAL 107           HN       VAL 107 -11.060  10.352  -1.026
  813    HA   VAL 107           HA       VAL 107  -9.650   8.105  -2.301
  814    HB   VAL 107           HB       VAL 107 -10.154   8.533   0.646
  815   HG11  VAL 107          1HG1      VAL 107  -8.488   6.747   0.935
  816   HG12  VAL 107          2HG1      VAL 107  -8.433   6.533  -0.817
  817   HG13  VAL 107          3HG1      VAL 107  -9.921   6.194   0.071
  818   HG21  VAL 107          3HG2      VAL 107  -8.644  10.236  -0.224
  819   HG22  VAL 107          1HG2      VAL 107  -7.636   8.990  -0.957
  820   HG23  VAL 107          2HG2      VAL 107  -7.772   9.097   0.798
  821    H    GLU 108           HN       GLU 108 -11.290   7.118  -3.384
  822    HA   GLU 108           HA       GLU 108 -13.547   6.117  -1.804
  823    HB2  GLU 108           2HB      GLU 108 -13.071   6.216  -4.788
  824    HB3  GLU 108           1HB      GLU 108 -14.394   5.321  -4.064
  825    HG2  GLU 108           2HG      GLU 108 -15.257   7.399  -4.804
  826    HG3  GLU 108           1HG      GLU 108 -15.189   7.448  -3.043
  827    H    MET 109           HN       MET 109 -13.781   3.968  -1.367
  828    HA   MET 109           HA       MET 109 -11.429   2.339  -1.759
  829    HB2  MET 109           2HB      MET 109 -12.570   2.292   0.402
  830    HB3  MET 109           1HB      MET 109 -14.041   1.717  -0.371
  831    HG2  MET 109           2HG      MET 109 -12.873  -0.327  -1.049
  832    HG3  MET 109           1HG      MET 109 -11.419   0.244  -0.235
  833    HE1  MET 109           3HE      MET 109 -12.679  -2.702   2.042
  834    HE2  MET 109           1HE      MET 109 -11.323  -2.064   1.112
  835    HE3  MET 109           2HE      MET 109 -12.787  -2.597   0.286
  836    H    ILE 110           HN       ILE 110 -11.288   1.790  -3.879
  837    HA   ILE 110           HA       ILE 110 -13.444   0.510  -5.268
  838    HB   ILE 110           HB       ILE 110 -11.603  -0.122  -6.917
  839   HG12  ILE 110          2HG1      ILE 110  -9.989   1.738  -5.147
  840   HG13  ILE 110          1HG1      ILE 110  -9.711   0.009  -5.338
  841   HG21  ILE 110          1HG2      ILE 110 -11.454   2.158  -7.808
  842   HG22  ILE 110          2HG2      ILE 110 -12.041   2.789  -6.270
  843   HG23  ILE 110          3HG2      ILE 110 -13.085   1.768  -7.261
  844   HD11  ILE 110          3HD1      ILE 110  -8.131   1.311  -6.641
  845   HD12  ILE 110          1HD1      ILE 110  -9.459   2.086  -7.506
  846   HD13  ILE 110          2HD1      ILE 110  -9.178   0.356  -7.689
  847    H    ASN 111           HN       ASN 111 -14.154  -1.394  -4.569
  848    HA   ASN 111           HA       ASN 111 -12.459  -3.152  -3.052
  849    HB2  ASN 111           2HB      ASN 111 -14.845  -2.818  -2.478
  850    HB3  ASN 111           1HB      ASN 111 -15.304  -3.575  -3.999
  851   HD21  ASN 111          1HD2      ASN 111 -16.431  -5.215  -2.948
  852   HD22  ASN 111          2HD2      ASN 111 -15.621  -6.495  -2.107
  853    H    LEU 112           HN       LEU 112 -10.885  -3.805  -4.504
  854    HA   LEU 112           HA       LEU 112 -11.787  -5.506  -6.723
  855    HB2  LEU 112           2HB      LEU 112  -9.095  -4.238  -6.208
  856    HB3  LEU 112           1HB      LEU 112  -9.473  -5.271  -7.573
  857    HG   LEU 112           HG       LEU 112 -10.742  -2.586  -7.014
  858   HD11  LEU 112          1HD1      LEU 112  -8.413  -2.358  -7.651
  859   HD12  LEU 112          2HD1      LEU 112  -9.466  -1.839  -8.969
  860   HD13  LEU 112          3HD1      LEU 112  -8.673  -3.410  -9.043
  861   HD21  LEU 112          3HD2      LEU 112 -12.260  -4.080  -8.177
  862   HD22  LEU 112          1HD2      LEU 112 -11.009  -4.456  -9.365
  863   HD23  LEU 112          2HD2      LEU 112 -11.675  -2.826  -9.270
  864    H    GLU 113           HN       GLU 113 -11.980  -7.537  -6.048
  865    HA   GLU 113           HA       GLU 113 -10.347  -8.652  -3.968
  866    HB2  GLU 113           2HB      GLU 113 -12.715  -9.317  -4.342
  867    HB3  GLU 113           1HB      GLU 113 -12.245 -10.032  -5.879
  868    HG2  GLU 113           2HG      GLU 113 -10.836 -11.636  -4.730
  869    HG3  GLU 113           1HG      GLU 113 -11.222 -10.885  -3.181
  870    H    HIS 114           HN       HIS 114  -8.485  -9.772  -4.181
  871    HA   HIS 114           HA       HIS 114  -7.596 -10.351  -6.925
  872    HB2  HIS 114           2HB      HIS 114  -5.966  -9.264  -4.626
  873    HB3  HIS 114           1HB      HIS 114  -5.272  -9.845  -6.133
  874    HD1  HIS 114           1HD      HIS 114  -6.442  -8.533  -8.332
  875    HD2  HIS 114           2HD      HIS 114  -6.319  -6.595  -4.653
  876    HE1  HIS 114           1HE      HIS 114  -6.714  -6.084  -8.843
  877    HE2  HIS 114           2HE      HIS 114  -6.376  -4.927  -6.631
  878    H    HIS 115           HN       HIS 115  -7.362 -12.449  -7.249
  879    HA   HIS 115           HA       HIS 115  -6.333 -14.095  -5.039
  880    HB2  HIS 115           2HB      HIS 115  -8.393 -14.972  -6.033
  881    HB3  HIS 115           1HB      HIS 115  -7.653 -14.955  -7.629
  882    HD1  HIS 115           1HD      HIS 115  -7.324 -17.331  -8.262
  883    HD2  HIS 115           2HD      HIS 115  -6.280 -16.613  -4.296
  884    HE1  HIS 115           1HE      HIS 115  -6.340 -19.492  -7.409
  885    HE2  HIS 115           2HE      HIS 115  -5.789 -19.062  -4.984
  886    H    HIS 116           HN       HIS 116  -4.196 -13.634  -5.125
  887    HA   HIS 116           HA       HIS 116  -2.695 -13.542  -7.554
  888    HB2  HIS 116           2HB      HIS 116  -2.261 -12.562  -5.083
  889    HB3  HIS 116           1HB      HIS 116  -1.323 -14.045  -4.959
  890    HD1  HIS 116           1HD      HIS 116  -1.125 -10.611  -6.105
  891    HD2  HIS 116           2HD      HIS 116   0.756 -14.209  -7.047
  892    HE1  HIS 116           1HE      HIS 116   0.928  -9.988  -7.424
  893    HE2  HIS 116           2HE      HIS 116   2.073 -12.172  -7.957
  894    H    HIS 117           HN       HIS 117  -1.068 -15.051  -8.227
  895    HA   HIS 117           HA       HIS 117   0.017 -17.035  -8.463
  896    HB2  HIS 117           2HB      HIS 117  -0.167 -17.012  -5.849
  897    HB3  HIS 117           1HB      HIS 117  -1.401 -18.235  -6.108
  898    HD1  HIS 117           1HD      HIS 117  -0.584 -20.589  -6.343
  899    HD2  HIS 117           2HD      HIS 117   2.444 -17.794  -6.879
  900    HE1  HIS 117           1HE      HIS 117   1.548 -21.913  -6.437
  901    HE2  HIS 117           2HE      HIS 117   3.376 -20.206  -6.733
  902    H    HIS 118           HN       HIS 118  -0.828 -17.796 -10.318
  903    HA   HIS 118           HA       HIS 118  -3.473 -19.086 -10.237
  904    HB2  HIS 118           2HB      HIS 118  -3.102 -17.242 -11.882
  905    HB3  HIS 118           1HB      HIS 118  -1.863 -18.225 -12.652
  906    HD1  HIS 118           1HD      HIS 118  -2.725 -19.288 -14.702
  907    HD2  HIS 118           2HD      HIS 118  -5.681 -18.923 -11.799
  908    HE1  HIS 118           1HE      HIS 118  -4.803 -20.277 -15.721
  909    HE2  HIS 118           2HE      HIS 118  -6.619 -19.877 -14.014
  910    H    HIS 119           HN       HIS 119  -0.128 -19.708 -10.536
  911    HA   HIS 119           HA       HIS 119  -0.726 -22.533 -11.124
  912    HB2  HIS 119           2HB      HIS 119   1.310 -20.745 -12.247
  913    HB3  HIS 119           1HB      HIS 119   1.973 -22.252 -11.629
  914    HD1  HIS 119           1HD      HIS 119   2.162 -21.784 -14.585
  915    HD2  HIS 119           2HD      HIS 119  -1.097 -23.652 -12.793
  916    HE1  HIS 119           1HE      HIS 119   1.096 -23.173 -16.390
  917    HE2  HIS 119           2HE      HIS 119  -0.693 -24.499 -15.209
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1 -11.962 -33.869   0.025
    2    H2   MET   1           H2       MET   1 -11.433 -32.956  -1.297
    3    H3   MET   1           H3       MET   1 -13.066 -32.929  -0.858
    4    HA   MET   1           HA       MET   1 -12.052 -30.916  -0.140
    5    HB2  MET   1           2HB      MET   1 -12.694 -32.897   2.039
    6    HB3  MET   1           1HB      MET   1 -12.298 -31.221   2.399
    7    HG2  MET   1           2HG      MET   1 -14.540 -32.105   0.602
    8    HG3  MET   1           1HG      MET   1 -14.718 -31.664   2.300
    9    HE1  MET   1           2HE      MET   1 -16.608 -29.903   1.571
   10    HE2  MET   1           3HE      MET   1 -16.370 -30.356  -0.117
   11    HE3  MET   1           1HE      MET   1 -16.348 -28.657   0.350
   12    HA   PRO   2           HA       PRO   2  -7.661 -31.713   0.707
   13    HB2  PRO   2           2HB      PRO   2  -7.145 -29.254  -0.706
   14    HB3  PRO   2           1HB      PRO   2  -6.736 -30.898  -1.193
   15    HG2  PRO   2           2HG      PRO   2  -8.586 -29.331  -2.480
   16    HG3  PRO   2           1HG      PRO   2  -8.583 -31.103  -2.512
   17    HD2  PRO   2           2HD      PRO   2 -10.231 -29.235  -0.849
   18    HD3  PRO   2           1HD      PRO   2 -10.705 -30.751  -1.649
   19    H    THR   3           HN       THR   3  -6.700 -30.955   2.525
   20    HA   THR   3           HA       THR   3  -7.761 -28.695   3.907
   21    HB   THR   3           HB       THR   3  -6.751 -30.594   5.125
   22    HG1  THR   3           1HG      THR   3  -6.019 -29.288   6.697
   23   HG21  THR   3          3HG2      THR   3  -4.143 -29.569   3.997
   24   HG22  THR   3          1HG2      THR   3  -4.907 -31.114   3.620
   25   HG23  THR   3          2HG2      THR   3  -4.299 -30.803   5.247
   26    H    PHE   4           HN       PHE   4  -5.927 -27.084   4.776
   27    HA   PHE   4           HA       PHE   4  -5.271 -25.620   2.401
   28    HB2  PHE   4           2HB      PHE   4  -4.590 -23.854   4.040
   29    HB3  PHE   4           1HB      PHE   4  -6.263 -24.360   4.160
   30    HD1  PHE   4           1HD      PHE   4  -6.979 -25.780   6.061
   31    HD2  PHE   4           2HD      PHE   4  -3.058 -24.144   5.833
   32    HE1  PHE   4           1HE      PHE   4  -6.655 -26.219   8.462
   33    HE2  PHE   4           2HE      PHE   4  -2.729 -24.586   8.228
   34    HZ   PHE   4           HZ       PHE   4  -4.526 -25.626   9.547
   35    H    ASP   5           HN       ASP   5  -3.383 -25.404   1.499
   36    HA   ASP   5           HA       ASP   5  -0.969 -26.220   2.952
   37    HB2  ASP   5           2HB      ASP   5  -1.337 -27.744   1.064
   38    HB3  ASP   5           1HB      ASP   5  -1.491 -26.370  -0.030
   39    H    HIS   6           HN       HIS   6  -0.637 -24.273   3.759
   40    HA   HIS   6           HA       HIS   6  -0.152 -22.108   4.021
   41    HB2  HIS   6           2HB      HIS   6   1.240 -20.950   2.539
   42    HB3  HIS   6           1HB      HIS   6   1.662 -22.632   2.286
   43    HD1  HIS   6           1HD      HIS   6   2.053 -23.132  -0.090
   44    HD2  HIS   6           2HD      HIS   6  -0.811 -20.147   0.376
   45    HE1  HIS   6           1HE      HIS   6   1.407 -22.434  -2.420
   46    HE2  HIS   6           2HE      HIS   6  -0.452 -20.759  -2.111
   47    H    GLY   7           HN       GLY   7  -0.905 -19.923   3.541
   48    HA2  GLY   7           2HA      GLY   7  -3.499 -20.037   2.134
   49    HA3  GLY   7           1HA      GLY   7  -3.288 -19.199   3.667
   50    H    ASN   8           HN       ASN   8  -4.297 -17.958   1.410
   51    HA   ASN   8           HA       ASN   8  -2.120 -16.050   0.866
   52    HB2  ASN   8           2HB      ASN   8  -4.509 -16.646  -0.877
   53    HB3  ASN   8           1HB      ASN   8  -3.291 -15.429  -1.205
   54   HD21  ASN   8          1HD2      ASN   8  -1.269 -16.045  -1.918
   55   HD22  ASN   8          2HD2      ASN   8  -0.923 -17.641  -2.499
   56    H    LEU   9           HN       LEU   9  -2.643 -13.878   0.948
   57    HA   LEU   9           HA       LEU   9  -5.288 -13.102   1.848
   58    HB2  LEU   9           2HB      LEU   9  -3.831 -13.731   3.841
   59    HB3  LEU   9           1HB      LEU   9  -2.841 -12.348   3.434
   60    HG   LEU   9           HG       LEU   9  -4.536 -12.050   5.272
   61   HD11  LEU   9          1HD1      LEU   9  -3.442 -10.151   4.236
   62   HD12  LEU   9          2HD1      LEU   9  -5.125  -9.778   4.613
   63   HD13  LEU   9          3HD1      LEU   9  -4.655 -10.144   2.955
   64   HD21  LEU   9          3HD2      LEU   9  -6.455 -11.987   2.959
   65   HD22  LEU   9          1HD2      LEU   9  -6.829 -11.546   4.627
   66   HD23  LEU   9          2HD2      LEU   9  -6.400 -13.210   4.229
   67    H    SER  10           HN       SER  10  -5.836 -11.312   0.853
   68    HA   SER  10           HA       SER  10  -3.761  -9.728  -0.457
   69    HB2  SER  10           2HB      SER  10  -6.766  -9.718  -0.846
   70    HB3  SER  10           1HB      SER  10  -5.602  -8.802  -1.800
   71    HG   SER  10           HG       SER  10  -4.634 -11.044  -2.137
   72    H    LEU  11           HN       LEU  11  -3.060  -7.999   0.611
   73    HA   LEU  11           HA       LEU  11  -4.511  -6.796   2.755
   74    HB2  LEU  11           2HB      LEU  11  -2.112  -5.770   1.221
   75    HB3  LEU  11           1HB      LEU  11  -2.720  -5.094   2.719
   76    HG   LEU  11           HG       LEU  11  -1.590  -7.877   2.403
   77   HD11  LEU  11          1HD1      LEU  11   0.125  -6.166   2.164
   78   HD12  LEU  11          2HD1      LEU  11   0.298  -7.016   3.699
   79   HD13  LEU  11          3HD1      LEU  11  -0.411  -5.403   3.659
   80   HD21  LEU  11          3HD2      LEU  11  -3.295  -7.710   4.152
   81   HD22  LEU  11          1HD2      LEU  11  -2.421  -6.359   4.870
   82   HD23  LEU  11          2HD2      LEU  11  -1.686  -7.963   4.832
   83    H    GLY  12           HN       GLY  12  -4.187  -6.271  -0.652
   84    HA2  GLY  12           2HA      GLY  12  -5.984  -5.316  -1.886
   85    HA3  GLY  12           1HA      GLY  12  -6.380  -4.332  -0.485
   86    H    GLU  13           HN       GLU  13  -6.333  -2.394  -1.499
   87    HA   GLU  13           HA       GLU  13  -3.829  -1.610  -2.804
   88    HB2  GLU  13           2HB      GLU  13  -5.293   0.337  -3.639
   89    HB3  GLU  13           1HB      GLU  13  -5.554  -1.256  -4.335
   90    HG2  GLU  13           2HG      GLU  13  -7.408  -1.511  -2.586
   91    HG3  GLU  13           1HG      GLU  13  -7.260   0.234  -2.374
   92    H    LEU  14           HN       LEU  14  -2.490  -0.735  -1.429
   93    HA   LEU  14           HA       LEU  14  -3.519   0.913   0.761
   94    HB2  LEU  14           2HB      LEU  14  -0.755  -0.205   0.254
   95    HB3  LEU  14           1HB      LEU  14  -1.196   0.778   1.637
   96    HG   LEU  14           HG       LEU  14  -2.330  -1.945   1.003
   97   HD11  LEU  14          1HD1      LEU  14  -0.379  -1.064   3.124
   98   HD12  LEU  14          2HD1      LEU  14   0.005  -2.031   1.702
   99   HD13  LEU  14          3HD1      LEU  14  -1.056  -2.683   2.949
  100   HD21  LEU  14          3HD2      LEU  14  -3.940  -0.524   2.159
  101   HD22  LEU  14          1HD2      LEU  14  -2.733  -0.145   3.389
  102   HD23  LEU  14          2HD2      LEU  14  -3.339  -1.794   3.226
  103    H    GLU  15           HN       GLU  15  -2.843   3.004   1.099
  104    HA   GLU  15           HA       GLU  15  -2.303   4.522  -1.257
  105    HB2  GLU  15           2HB      GLU  15  -2.372   5.353   1.648
  106    HB3  GLU  15           1HB      GLU  15  -2.314   6.459   0.282
  107    HG2  GLU  15           2HG      GLU  15  -4.478   5.872  -0.421
  108    HG3  GLU  15           1HG      GLU  15  -4.514   4.456   0.628
  109    H    LEU  16           HN       LEU  16  -0.462   5.621  -1.839
  110    HA   LEU  16           HA       LEU  16   2.024   4.678  -0.697
  111    HB2  LEU  16           2HB      LEU  16   1.774   4.876  -3.122
  112    HB3  LEU  16           1HB      LEU  16   1.480   6.596  -2.962
  113    HG   LEU  16           HG       LEU  16   3.796   6.791  -1.977
  114   HD11  LEU  16          1HD1      LEU  16   4.045   3.994  -3.065
  115   HD12  LEU  16          2HD1      LEU  16   4.080   4.447  -1.360
  116   HD13  LEU  16          3HD1      LEU  16   5.365   4.987  -2.443
  117   HD21  LEU  16          3HD2      LEU  16   4.893   6.736  -4.149
  118   HD22  LEU  16          1HD2      LEU  16   3.274   7.425  -4.280
  119   HD23  LEU  16          2HD2      LEU  16   3.572   5.767  -4.802
  120    H    THR  17           HN       THR  17   2.989   5.660   0.941
  121    HA   THR  17           HA       THR  17   2.338   8.414   1.602
  122    HB   THR  17           HB       THR  17   4.246   6.527   3.005
  123    HG1  THR  17           1HG      THR  17   2.039   6.823   4.404
  124   HG21  THR  17          3HG2      THR  17   4.587   8.891   3.559
  125   HG22  THR  17          1HG2      THR  17   3.904   8.011   4.929
  126   HG23  THR  17          2HG2      THR  17   2.874   9.050   3.944
  127    H    VAL  18           HN       VAL  18   3.467  10.048   0.764
  128    HA   VAL  18           HA       VAL  18   6.166   9.496  -0.265
  129    HB   VAL  18           HB       VAL  18   4.337  11.808  -0.951
  130   HG11  VAL  18          1HG1      VAL  18   5.907  12.200  -2.799
  131   HG12  VAL  18          2HG1      VAL  18   6.939  10.907  -2.188
  132   HG13  VAL  18          3HG1      VAL  18   6.688  12.364  -1.226
  133   HG21  VAL  18          3HG2      VAL  18   3.398   9.714  -1.750
  134   HG22  VAL  18          1HG2      VAL  18   4.935   9.284  -2.501
  135   HG23  VAL  18          2HG2      VAL  18   4.012  10.659  -3.106
  136    H    LEU  19           HN       LEU  19   7.750  10.100   1.032
  137    HA   LEU  19           HA       LEU  19   7.339  12.313   2.901
  138    HB2  LEU  19           2HB      LEU  19   8.386  10.059   3.536
  139    HB3  LEU  19           1HB      LEU  19   9.793  10.578   2.630
  140    HG   LEU  19           HG       LEU  19   8.711  12.184   4.944
  141   HD11  LEU  19          1HD1      LEU  19  10.806  10.012   5.010
  142   HD12  LEU  19          2HD1      LEU  19   9.203   9.930   5.744
  143   HD13  LEU  19          3HD1      LEU  19  10.391  11.089   6.345
  144   HD21  LEU  19          3HD2      LEU  19  10.239  13.366   3.463
  145   HD22  LEU  19          1HD2      LEU  19  11.413  12.055   3.599
  146   HD23  LEU  19          2HD2      LEU  19  11.022  13.039   5.012
  147    H    TYR  20           HN       TYR  20   7.882  14.274   2.318
  148    HA   TYR  20           HA       TYR  20  10.297  14.975   0.976
  149    HB2  TYR  20           2HB      TYR  20   9.079  14.147  -0.982
  150    HB3  TYR  20           1HB      TYR  20   7.691  15.146  -0.574
  151    HD1  TYR  20           2HD      TYR  20  11.359  15.601  -1.164
  152    HD2  TYR  20           1HD      TYR  20   7.417  17.058  -1.815
  153    HE1  TYR  20           2HE      TYR  20  12.267  17.422  -2.542
  154    HE2  TYR  20           1HE      TYR  20   8.315  18.882  -3.194
  155    HH   TYR  20           HH       TYR  20  11.526  18.935  -4.303
  156    H    ASP  21           HN       ASP  21  10.585  17.271   1.006
  157    HA   ASP  21           HA       ASP  21   8.743  18.622   2.818
  158    HB2  ASP  21           2HB      ASP  21  11.563  19.166   1.964
  159    HB3  ASP  21           1HB      ASP  21  10.590  20.461   2.658
  160    H    GLU  22           HN       GLU  22   7.415  20.183   2.265
  161    HA   GLU  22           HA       GLU  22   6.854  20.588  -0.511
  162    HB2  GLU  22           2HB      GLU  22   4.990  21.986   0.347
  163    HB3  GLU  22           1HB      GLU  22   5.045  20.385   1.078
  164    HG2  GLU  22           2HG      GLU  22   6.096  21.300   3.062
  165    HG3  GLU  22           1HG      GLU  22   6.122  22.900   2.325
  166    H    GLU  23           HN       GLU  23   9.231  21.930   1.181
  167    HA   GLU  23           HA       GLU  23   8.745  24.718   0.656
  168    HB2  GLU  23           2HB      GLU  23  11.149  23.259   1.749
  169    HB3  GLU  23           1HB      GLU  23  10.977  25.007   1.677
  170    HG2  GLU  23           2HG      GLU  23   9.102  23.186   3.158
  171    HG3  GLU  23           1HG      GLU  23  10.464  24.026   3.891
  172    H    ARG  24           HN       ARG  24   9.696  22.252  -1.313
  173    HA   ARG  24           HA       ARG  24  11.317  24.076  -2.946
  174    HB2  ARG  24           2HB      ARG  24  11.530  21.089  -2.646
  175    HB3  ARG  24           1HB      ARG  24  12.297  21.978  -3.945
  176    HG2  ARG  24           2HG      ARG  24  12.804  22.489  -1.023
  177    HG3  ARG  24           1HG      ARG  24  13.798  21.443  -2.036
  178    HD2  ARG  24           2HD      ARG  24  14.881  23.565  -1.927
  179    HD3  ARG  24           1HD      ARG  24  14.190  23.412  -3.540
  180    HE   ARG  24           HE       ARG  24  12.525  24.798  -1.618
  181   HH11  ARG  24          1HH1      ARG  24  14.995  25.120  -4.086
  182   HH12  ARG  24          2HH1      ARG  24  14.622  26.782  -4.420
  183   HH21  ARG  24          1HH2      ARG  24  12.043  26.970  -2.042
  184   HH22  ARG  24          2HH2      ARG  24  12.938  27.835  -3.252
  185    H    TYR  25           HN       TYR  25   9.806  20.951  -3.753
  186    HA   TYR  25           HA       TYR  25   8.348  22.360  -5.902
  187    HB2  TYR  25           2HB      TYR  25   9.051  19.420  -5.825
  188    HB3  TYR  25           1HB      TYR  25   8.412  20.327  -7.189
  189    HD1  TYR  25           1HD      TYR  25  10.108  22.606  -7.490
  190    HD2  TYR  25           2HD      TYR  25  11.174  18.675  -6.267
  191    HE1  TYR  25           1HE      TYR  25  12.390  22.974  -8.317
  192    HE2  TYR  25           2HE      TYR  25  13.463  19.036  -7.086
  193    HH   TYR  25           HH       TYR  25  14.618  20.461  -8.718
  194    H    ASP  26           HN       ASP  26   6.209  21.437  -6.460
  195    HA   ASP  26           HA       ASP  26   5.002  19.974  -4.210
  196    HB2  ASP  26           2HB      ASP  26   2.830  20.932  -4.778
  197    HB3  ASP  26           1HB      ASP  26   3.994  22.207  -4.453
  198    H    ILE  27           HN       ILE  27   3.117  18.571  -4.900
  199    HA   ILE  27           HA       ILE  27   4.262  16.811  -6.913
  200    HB   ILE  27           HB       ILE  27   1.884  16.175  -5.183
  201   HG12  ILE  27          2HG1      ILE  27   4.803  15.784  -4.470
  202   HG13  ILE  27          1HG1      ILE  27   3.740  16.979  -3.736
  203   HG21  ILE  27          1HG2      ILE  27   4.027  14.466  -6.443
  204   HG22  ILE  27          2HG2      ILE  27   2.379  14.663  -7.036
  205   HG23  ILE  27          3HG2      ILE  27   2.668  13.879  -5.484
  206   HD11  ILE  27          3HD1      ILE  27   3.414  13.989  -3.589
  207   HD12  ILE  27          1HD1      ILE  27   2.341  15.181  -2.855
  208   HD13  ILE  27          2HD1      ILE  27   4.011  15.039  -2.304
  209    H    VAL  28           HN       VAL  28   3.558  16.780  -8.911
  210    HA   VAL  28           HA       VAL  28   0.969  17.893  -9.616
  211    HB   VAL  28           HB       VAL  28   3.042  16.586 -11.391
  212   HG11  VAL  28          1HG1      VAL  28   1.871  17.703 -13.223
  213   HG12  VAL  28          2HG1      VAL  28   0.667  18.312 -12.087
  214   HG13  VAL  28          3HG1      VAL  28   0.808  16.576 -12.375
  215   HG21  VAL  28          3HG2      VAL  28   3.934  18.557 -10.282
  216   HG22  VAL  28          1HG2      VAL  28   2.540  19.499 -10.811
  217   HG23  VAL  28          2HG2      VAL  28   3.677  18.866 -12.001
  218    H    GLU  29           HN       GLU  29   2.636  14.753  -9.937
  219    HA   GLU  29           HA       GLU  29   0.065  13.461  -9.508
  220    HB2  GLU  29           2HB      GLU  29   0.251  11.922 -11.314
  221    HB3  GLU  29           1HB      GLU  29   0.460  13.528 -11.995
  222    HG2  GLU  29           2HG      GLU  29   2.742  13.211 -12.352
  223    HG3  GLU  29           1HG      GLU  29   2.817  11.841 -11.244
  224    H    GLN  30           HN       GLN  30   0.250  11.298  -8.781
  225    HA   GLN  30           HA       GLN  30   2.833  10.246  -8.073
  226    HB2  GLN  30           2HB      GLN  30   2.464  10.195  -5.680
  227    HB3  GLN  30           1HB      GLN  30   2.363  11.858  -6.233
  228    HG2  GLN  30           2HG      GLN  30  -0.062  10.141  -5.779
  229    HG3  GLN  30           1HG      GLN  30   0.659  11.134  -4.518
  230   HE21  GLN  30          1HE2      GLN  30  -1.996  11.239  -5.748
  231   HE22  GLN  30          2HE2      GLN  30  -2.154  12.855  -6.373
  232    H    THR  31           HN       THR  31   2.626   8.071  -7.153
  233    HA   THR  31           HA       THR  31   0.442   6.611  -8.258
  234    HB   THR  31           HB       THR  31   2.524   5.655  -6.276
  235    HG1  THR  31           1HG      THR  31   2.544   5.486  -9.132
  236   HG21  THR  31          3HG2      THR  31   0.629   4.134  -6.487
  237   HG22  THR  31          1HG2      THR  31   2.055   3.444  -7.260
  238   HG23  THR  31          2HG2      THR  31   0.779   4.163  -8.243
  239    H    GLU  32           HN       GLU  32  -1.518   6.779  -7.400
  240    HA   GLU  32           HA       GLU  32  -2.098   7.712  -4.824
  241    HB2  GLU  32           2HB      GLU  32  -3.829   6.100  -6.700
  242    HB3  GLU  32           1HB      GLU  32  -4.408   6.994  -5.301
  243    HG2  GLU  32           2HG      GLU  32  -2.944   8.296  -7.574
  244    HG3  GLU  32           1HG      GLU  32  -4.693   8.096  -7.542
  245    H    THR  33           HN       THR  33  -2.606   4.414  -6.100
  246    HA   THR  33           HA       THR  33  -1.978   3.347  -3.448
  247    HB   THR  33           HB       THR  33  -3.939   1.753  -3.674
  248    HG1  THR  33           1HG      THR  33  -5.538   2.245  -5.119
  249   HG21  THR  33          3HG2      THR  33  -5.587   3.347  -2.790
  250   HG22  THR  33          1HG2      THR  33  -4.585   4.687  -3.348
  251   HG23  THR  33          2HG2      THR  33  -3.992   3.608  -2.084
  252    H    VAL  34           HN       VAL  34  -1.121   1.301  -3.442
  253    HA   VAL  34           HA       VAL  34  -0.929  -0.086  -6.036
  254    HB   VAL  34           HB       VAL  34   1.216  -1.131  -5.082
  255   HG11  VAL  34          1HG1      VAL  34   2.597   0.734  -5.908
  256   HG12  VAL  34          2HG1      VAL  34   1.161   1.761  -5.920
  257   HG13  VAL  34          3HG1      VAL  34   1.249   0.348  -6.975
  258   HG21  VAL  34          3HG2      VAL  34   2.483   0.284  -3.542
  259   HG22  VAL  34          1HG2      VAL  34   1.006  -0.333  -2.801
  260   HG23  VAL  34          2HG2      VAL  34   1.080   1.338  -3.363
  261    H    GLN  35           HN       GLN  35  -0.737  -2.424  -5.862
  262    HA   GLN  35           HA       GLN  35  -2.399  -3.381  -3.643
  263    HB2  GLN  35           2HB      GLN  35  -3.301  -3.630  -5.934
  264    HB3  GLN  35           1HB      GLN  35  -1.909  -4.614  -6.359
  265    HG2  GLN  35           2HG      GLN  35  -2.591  -6.276  -4.691
  266    HG3  GLN  35           1HG      GLN  35  -3.999  -5.287  -4.300
  267   HE21  GLN  35          1HE2      GLN  35  -3.879  -8.010  -5.314
  268   HE22  GLN  35          2HE2      GLN  35  -4.768  -8.005  -6.804
  269    H    VAL  36           HN       VAL  36  -1.608  -4.755  -2.210
  270    HA   VAL  36           HA       VAL  36   0.863  -6.217  -2.873
  271    HB   VAL  36           HB       VAL  36   1.539  -4.464  -1.398
  272   HG11  VAL  36          1HG1      VAL  36   0.539  -4.086   0.796
  273   HG12  VAL  36          2HG1      VAL  36  -0.665  -5.333   0.466
  274   HG13  VAL  36          3HG1      VAL  36  -0.640  -3.854  -0.496
  275   HG21  VAL  36          3HG2      VAL  36   1.251  -7.028   0.165
  276   HG22  VAL  36          1HG2      VAL  36   2.362  -5.712   0.549
  277   HG23  VAL  36          2HG2      VAL  36   2.556  -6.623  -0.950
  278    H    ASP  37           HN       ASP  37   0.903  -8.308  -2.401
  279    HA   ASP  37           HA       ASP  37  -1.455  -9.456  -1.049
  280    HB2  ASP  37           2HB      ASP  37  -1.466  -9.629  -3.571
  281    HB3  ASP  37           1HB      ASP  37  -0.030 -10.638  -3.439
  282    H    LEU  38           HN       LEU  38  -1.084 -11.203   0.296
  283    HA   LEU  38           HA       LEU  38   1.756 -11.887   0.709
  284    HB2  LEU  38           2HB      LEU  38  -0.463 -11.785   2.753
  285    HB3  LEU  38           1HB      LEU  38   1.188 -12.286   3.068
  286    HG   LEU  38           HG       LEU  38   0.334  -9.516   2.206
  287   HD11  LEU  38          1HD1      LEU  38   1.274 -10.578   4.868
  288   HD12  LEU  38          2HD1      LEU  38  -0.349 -10.004   4.484
  289   HD13  LEU  38          3HD1      LEU  38   1.009  -8.877   4.485
  290   HD21  LEU  38          3HD2      LEU  38   2.662  -8.898   2.682
  291   HD22  LEU  38          1HD2      LEU  38   2.560 -10.083   1.379
  292   HD23  LEU  38          2HD2      LEU  38   3.043 -10.591   2.997
  293    H    GLU  39           HN       GLU  39   2.322 -13.992   0.896
  294    HA   GLU  39           HA       GLU  39   0.218 -16.036   0.996
  295    HB2  GLU  39           2HB      GLU  39   0.774 -15.820  -1.345
  296    HB3  GLU  39           1HB      GLU  39   2.495 -15.876  -0.988
  297    HG2  GLU  39           2HG      GLU  39   2.356 -18.180  -0.371
  298    HG3  GLU  39           1HG      GLU  39   0.593 -18.150  -0.475
  299    H    GLY  40           HN       GLY  40   0.731 -17.751   2.292
  300    HA2  GLY  40           2HA      GLY  40   3.085 -18.947   2.873
  301    HA3  GLY  40           1HA      GLY  40   3.141 -17.510   3.885
  302    HA   PRO  41           HA       PRO  41   1.293 -20.857   6.520
  303    HB2  PRO  41           2HB      PRO  41   2.076 -18.725   8.457
  304    HB3  PRO  41           1HB      PRO  41   2.260 -20.479   8.581
  305    HG2  PRO  41           2HG      PRO  41   4.349 -18.942   8.005
  306    HG3  PRO  41           1HG      PRO  41   4.130 -20.513   7.210
  307    HD2  PRO  41           2HD      PRO  41   3.689 -17.767   6.138
  308    HD3  PRO  41           1HD      PRO  41   4.266 -19.226   5.309
  309    H    ARG  42           HN       ARG  42  -0.860 -20.852   6.482
  310    HA   ARG  42           HA       ARG  42  -2.428 -18.539   6.161
  311    HB2  ARG  42           2HB      ARG  42  -3.064 -20.878   5.490
  312    HB3  ARG  42           1HB      ARG  42  -3.381 -21.221   7.183
  313    HG2  ARG  42           2HG      ARG  42  -5.101 -19.473   7.208
  314    HG3  ARG  42           1HG      ARG  42  -4.798 -19.162   5.498
  315    HD2  ARG  42           2HD      ARG  42  -5.395 -21.526   5.023
  316    HD3  ARG  42           1HD      ARG  42  -5.819 -21.723   6.721
  317    HE   ARG  42           HE       ARG  42  -7.223 -19.534   5.569
  318   HH11  ARG  42          1HH1      ARG  42  -7.187 -23.022   5.811
  319   HH12  ARG  42          2HH1      ARG  42  -8.864 -23.202   5.418
  320   HH21  ARG  42          1HH2      ARG  42  -9.444 -19.753   5.082
  321   HH22  ARG  42          2HH2      ARG  42 -10.149 -21.344   4.972
  322    H    GLY  43           HN       GLY  43  -1.467 -20.335   9.009
  323    HA2  GLY  43           2HA      GLY  43  -3.219 -19.273  10.898
  324    HA3  GLY  43           1HA      GLY  43  -1.584 -19.818  11.240
  325    H    VAL  44           HN       VAL  44  -0.060 -18.024   9.849
  326    HA   VAL  44           HA       VAL  44   0.010 -15.793  11.553
  327    HB   VAL  44           HB       VAL  44   1.238 -16.045   8.795
  328   HG11  VAL  44          1HG1      VAL  44   2.848 -14.361   9.606
  329   HG12  VAL  44          2HG1      VAL  44   1.898 -14.189  11.080
  330   HG13  VAL  44          3HG1      VAL  44   1.200 -13.738   9.525
  331   HG21  VAL  44          3HG2      VAL  44   2.388 -16.719  11.501
  332   HG22  VAL  44          1HG2      VAL  44   3.280 -16.726   9.978
  333   HG23  VAL  44          2HG2      VAL  44   1.955 -17.863  10.229
  334    H    LEU  45           HN       LEU  45  -1.154 -16.173   8.229
  335    HA   LEU  45           HA       LEU  45  -1.918 -13.493   7.828
  336    HB2  LEU  45           2HB      LEU  45  -2.866 -16.038   6.523
  337    HB3  LEU  45           1HB      LEU  45  -3.305 -14.433   5.966
  338    HG   LEU  45           HG       LEU  45  -0.486 -15.515   6.095
  339   HD11  LEU  45          1HD1      LEU  45  -1.814 -16.623   4.379
  340   HD12  LEU  45          2HD1      LEU  45  -0.615 -15.551   3.656
  341   HD13  LEU  45          3HD1      LEU  45  -2.307 -15.056   3.735
  342   HD21  LEU  45          3HD2      LEU  45   0.097 -13.497   4.839
  343   HD22  LEU  45          1HD2      LEU  45  -0.595 -13.094   6.411
  344   HD23  LEU  45          2HD2      LEU  45  -1.572 -12.941   4.951
  345    H    THR  46           HN       THR  46  -3.598 -16.216   9.264
  346    HA   THR  46           HA       THR  46  -6.193 -15.088   9.246
  347    HB   THR  46           HB       THR  46  -5.050 -17.086  11.221
  348    HG1  THR  46           1HG      THR  46  -4.973 -17.682   8.926
  349   HG21  THR  46          3HG2      THR  46  -7.136 -16.102  12.005
  350   HG22  THR  46          1HG2      THR  46  -7.395 -17.777  11.516
  351   HG23  THR  46          2HG2      THR  46  -7.903 -16.459  10.458
  352    H    VAL  47           HN       VAL  47  -3.580 -15.041  11.651
  353    HA   VAL  47           HA       VAL  47  -4.998 -13.434  13.541
  354    HB   VAL  47           HB       VAL  47  -2.013 -13.828  13.219
  355   HG11  VAL  47          1HG1      VAL  47  -1.869 -13.186  15.577
  356   HG12  VAL  47          2HG1      VAL  47  -3.598 -12.839  15.586
  357   HG13  VAL  47          3HG1      VAL  47  -2.511 -11.881  14.578
  358   HG21  VAL  47          3HG2      VAL  47  -3.994 -15.316  14.940
  359   HG22  VAL  47          1HG2      VAL  47  -2.243 -15.528  14.979
  360   HG23  VAL  47          2HG2      VAL  47  -3.152 -15.953  13.527
  361    H    PHE  48           HN       PHE  48  -2.721 -12.801  10.939
  362    HA   PHE  48           HA       PHE  48  -2.304 -10.053  11.390
  363    HB2  PHE  48           2HB      PHE  48  -0.996 -11.678   9.904
  364    HB3  PHE  48           1HB      PHE  48  -2.251 -11.420   8.700
  365    HD1  PHE  48           1HD      PHE  48   0.381  -9.745  10.667
  366    HD2  PHE  48           2HD      PHE  48  -2.224  -9.528   7.312
  367    HE1  PHE  48           1HE      PHE  48   1.611  -7.780   9.847
  368    HE2  PHE  48           2HE      PHE  48  -1.003  -7.560   6.487
  369    HZ   PHE  48           HZ       PHE  48   0.917  -6.683   7.753
  370    H    ARG  49           HN       ARG  49  -4.835 -11.832   9.809
  371    HA   ARG  49           HA       ARG  49  -6.031  -9.891   8.228
  372    HB2  ARG  49           2HB      ARG  49  -6.417 -12.451   8.519
  373    HB3  ARG  49           1HB      ARG  49  -7.575 -11.971   9.748
  374    HG2  ARG  49           2HG      ARG  49  -7.726 -10.844   6.990
  375    HG3  ARG  49           1HG      ARG  49  -8.369 -12.439   7.365
  376    HD2  ARG  49           2HD      ARG  49  -9.136  -9.883   8.763
  377    HD3  ARG  49           1HD      ARG  49 -10.077 -10.661   7.492
  378    HE   ARG  49           HE       ARG  49  -9.641 -12.540   9.520
  379   HH11  ARG  49          1HH1      ARG  49 -11.357  -9.521   9.034
  380   HH12  ARG  49          2HH1      ARG  49 -12.599  -9.896  10.198
  381   HH21  ARG  49          1HH2      ARG  49 -11.270 -13.054  11.012
  382   HH22  ARG  49          2HH2      ARG  49 -12.559 -11.929  11.311
  383    H    PHE  50           HN       PHE  50  -6.203 -10.439  11.682
  384    HA   PHE  50           HA       PHE  50  -8.509  -8.806  12.128
  385    HB2  PHE  50           2HB      PHE  50  -6.440 -10.044  13.925
  386    HB3  PHE  50           1HB      PHE  50  -7.714  -9.010  14.539
  387    HD1  PHE  50           2HD      PHE  50 -10.106  -9.712  14.240
  388    HD2  PHE  50           1HD      PHE  50  -6.825 -12.293  13.406
  389    HE1  PHE  50           2HE      PHE  50 -11.611 -11.655  14.351
  390    HE2  PHE  50           1HE      PHE  50  -8.324 -14.238  13.516
  391    HZ   PHE  50           HZ       PHE  50 -10.716 -13.923  13.992
  392    H    ALA  51           HN       ALA  51  -5.123  -8.266  11.881
  393    HA   ALA  51           HA       ALA  51  -5.080  -5.860  13.455
  394    HB1  ALA  51           1HB      ALA  51  -3.122  -7.315  13.348
  395    HB2  ALA  51           2HB      ALA  51  -2.747  -5.694  12.766
  396    HB3  ALA  51           3HB      ALA  51  -2.983  -7.011  11.617
  397    H    ARG  52           HN       ARG  52  -5.796  -3.972  12.771
  398    HA   ARG  52           HA       ARG  52  -6.352  -3.311  10.094
  399    HB2  ARG  52           2HB      ARG  52  -6.018  -1.669  12.595
  400    HB3  ARG  52           1HB      ARG  52  -6.470  -0.971  11.056
  401    HG2  ARG  52           2HG      ARG  52  -8.457  -2.426  11.007
  402    HG3  ARG  52           1HG      ARG  52  -8.005  -3.039  12.599
  403    HD2  ARG  52           2HD      ARG  52  -8.173  -0.768  13.511
  404    HD3  ARG  52           1HD      ARG  52  -8.651  -0.171  11.921
  405    HE   ARG  52           HE       ARG  52 -10.459  -2.138  12.434
  406   HH11  ARG  52          1HH1      ARG  52  -9.435   0.745  14.142
  407   HH12  ARG  52          2HH1      ARG  52 -10.946   0.956  14.969
  408   HH21  ARG  52          1HH2      ARG  52 -12.444  -1.891  13.553
  409   HH22  ARG  52          2HH2      ARG  52 -12.648  -0.557  14.654
  410    HA   PRO  53           HA       PRO  53  -2.561  -2.259   8.393
  411    HB2  PRO  53           2HB      PRO  53  -3.303   0.463   7.641
  412    HB3  PRO  53           1HB      PRO  53  -2.911  -0.913   6.616
  413    HG2  PRO  53           2HG      PRO  53  -5.433   0.034   6.844
  414    HG3  PRO  53           1HG      PRO  53  -5.078  -1.680   6.573
  415    HD2  PRO  53           2HD      PRO  53  -5.893  -0.286   9.078
  416    HD3  PRO  53           1HD      PRO  53  -6.311  -1.913   8.503
  417    H    SER  54           HN       SER  54  -0.931  -2.020   9.681
  418    HA   SER  54           HA       SER  54  -0.165   0.676  10.469
  419    HB2  SER  54           2HB      SER  54   0.396  -1.987  11.761
  420    HB3  SER  54           1HB      SER  54   1.308  -0.546  12.128
  421    HG   SER  54           HG       SER  54  -0.241   0.047  13.412
  422    H    TYR  55           HN       TYR  55   0.022  -1.539   8.270
  423    HA   TYR  55           HA       TYR  55   2.899  -1.443   7.763
  424    HB2  TYR  55           2HB      TYR  55   2.069  -3.223   5.960
  425    HB3  TYR  55           1HB      TYR  55   2.398  -3.684   7.625
  426    HD1  TYR  55           1HD      TYR  55   0.565  -4.178   9.171
  427    HD2  TYR  55           2HD      TYR  55  -0.206  -3.217   5.095
  428    HE1  TYR  55           1HE      TYR  55  -1.717  -5.061   9.403
  429    HE2  TYR  55           2HE      TYR  55  -2.494  -4.098   5.318
  430    HH   TYR  55           HH       TYR  55  -3.876  -4.896   8.380
  431    H    GLU  56           HN       GLU  56   3.508   0.069   6.380
  432    HA   GLU  56           HA       GLU  56   1.537   0.992   4.408
  433    HB2  GLU  56           2HB      GLU  56   3.401   2.737   6.024
  434    HB3  GLU  56           1HB      GLU  56   2.255   3.294   4.809
  435    HG2  GLU  56           2HG      GLU  56   0.410   2.442   6.175
  436    HG3  GLU  56           1HG      GLU  56   1.565   1.924   7.397
  437    H    VAL  57           HN       VAL  57   2.330   1.835   2.488
  438    HA   VAL  57           HA       VAL  57   5.075   1.031   1.812
  439    HB   VAL  57           HB       VAL  57   2.834   1.738  -0.097
  440   HG11  VAL  57          1HG1      VAL  57   4.170   0.477  -1.717
  441   HG12  VAL  57          2HG1      VAL  57   5.394   0.196  -0.479
  442   HG13  VAL  57          3HG1      VAL  57   5.070   1.836  -1.043
  443   HG21  VAL  57          3HG2      VAL  57   2.480  -0.687  -0.391
  444   HG22  VAL  57          1HG2      VAL  57   2.078  -0.142   1.240
  445   HG23  VAL  57          2HG2      VAL  57   3.594  -0.993   0.941
  446    H    PHE  58           HN       PHE  58   6.547   2.660   1.449
  447    HA   PHE  58           HA       PHE  58   5.514   5.354   1.007
  448    HB2  PHE  58           2HB      PHE  58   6.879   6.238   2.905
  449    HB3  PHE  58           1HB      PHE  58   5.531   5.223   3.404
  450    HD1  PHE  58           1HD      PHE  58   5.912   3.039   4.379
  451    HD2  PHE  58           2HD      PHE  58   9.162   5.528   3.223
  452    HE1  PHE  58           1HE      PHE  58   7.445   1.647   5.705
  453    HE2  PHE  58           2HE      PHE  58  10.702   4.138   4.545
  454    HZ   PHE  58           HZ       PHE  58   9.844   2.196   5.787
  455    H    VAL  59           HN       VAL  59   6.976   6.849   0.253
  456    HA   VAL  59           HA       VAL  59   9.639   5.817  -0.492
  457    HB   VAL  59           HB       VAL  59   8.101   7.860  -2.086
  458   HG11  VAL  59          1HG1      VAL  59  10.524   7.924  -2.330
  459   HG12  VAL  59          2HG1      VAL  59   9.747   7.388  -3.821
  460   HG13  VAL  59          3HG1      VAL  59  10.530   6.214  -2.764
  461   HG21  VAL  59          3HG2      VAL  59   6.863   5.765  -2.191
  462   HG22  VAL  59          1HG2      VAL  59   8.334   4.909  -2.657
  463   HG23  VAL  59          2HG2      VAL  59   7.634   6.115  -3.737
  464    H    ASP  60           HN       ASP  60  11.310   7.120   0.020
  465    HA   ASP  60           HA       ASP  60  10.645   9.715   1.220
  466    HB2  ASP  60           2HB      ASP  60  12.723   9.535   2.510
  467    HB3  ASP  60           1HB      ASP  60  11.675   8.155   2.809
  468    H    LEU  61           HN       LEU  61  11.061  11.364  -0.015
  469    HA   LEU  61           HA       LEU  61  13.390  11.262  -1.817
  470    HB2  LEU  61           2HB      LEU  61  10.690  12.482  -2.431
  471    HB3  LEU  61           1HB      LEU  61  12.088  12.505  -3.485
  472    HG   LEU  61           HG       LEU  61  10.730   9.952  -2.622
  473   HD11  LEU  61          1HD1      LEU  61  10.303  11.561  -5.135
  474   HD12  LEU  61          2HD1      LEU  61   9.133  11.329  -3.834
  475   HD13  LEU  61          3HD1      LEU  61   9.650   9.955  -4.810
  476   HD21  LEU  61          3HD2      LEU  61  11.885   9.026  -4.585
  477   HD22  LEU  61          1HD2      LEU  61  13.020   9.676  -3.398
  478   HD23  LEU  61          2HD2      LEU  61  12.653  10.592  -4.859
  479    H    THR  62           HN       THR  62  14.787  12.793  -1.197
  480    HA   THR  62           HA       THR  62  13.680  15.384  -0.342
  481    HB   THR  62           HB       THR  62  15.800  15.539   1.134
  482    HG1  THR  62           1HG      THR  62  15.556  12.697   0.941
  483   HG21  THR  62          3HG2      THR  62  13.591  13.634   1.925
  484   HG22  THR  62          1HG2      THR  62  13.500  15.395   2.004
  485   HG23  THR  62          2HG2      THR  62  14.647  14.525   3.020
  486    H    GLU  63           HN       GLU  63  16.438  13.623  -1.697
  487    HA   GLU  63           HA       GLU  63  17.589  16.055  -2.776
  488    HB2  GLU  63           2HB      GLU  63  18.447  13.187  -3.101
  489    HB3  GLU  63           1HB      GLU  63  19.390  14.613  -3.518
  490    HG2  GLU  63           2HG      GLU  63  18.432  14.003  -0.743
  491    HG3  GLU  63           1HG      GLU  63  19.996  13.519  -1.368
  492    H    ALA  64           HN       ALA  64  15.858  13.221  -3.829
  493    HA   ALA  64           HA       ALA  64  16.027  14.029  -6.631
  494    HB1  ALA  64           1HB      ALA  64  14.751  11.595  -5.383
  495    HB2  ALA  64           2HB      ALA  64  16.355  11.664  -6.112
  496    HB3  ALA  64           3HB      ALA  64  14.924  11.900  -7.112
  497    H    GLY  65           HN       GLY  65  14.425  15.110  -7.643
  498    HA2  GLY  65           2HA      GLY  65  11.688  14.864  -6.869
  499    HA3  GLY  65           1HA      GLY  65  12.374  16.369  -6.293
  500    H    GLU  66           HN       GLU  66  14.129  16.669  -8.571
  501    HA   GLU  66           HA       GLU  66  12.466  18.260 -10.165
  502    HB2  GLU  66           2HB      GLU  66  14.657  17.806 -11.770
  503    HB3  GLU  66           1HB      GLU  66  14.513  19.073 -10.564
  504    HG2  GLU  66           2HG      GLU  66  16.619  17.895 -10.347
  505    HG3  GLU  66           1HG      GLU  66  15.616  17.651  -8.920
  506    H    GLY  67           HN       GLY  67  11.608  18.028 -12.192
  507    HA2  GLY  67           2HA      GLY  67  10.622  16.970 -13.953
  508    HA3  GLY  67           1HA      GLY  67  11.902  15.768 -13.846
  509    H    SER  68           HN       SER  68  10.856  13.935 -13.954
  510    HA   SER  68           HA       SER  68   8.893  13.363 -11.844
  511    HB2  SER  68           2HB      SER  68   7.865  13.225 -14.054
  512    HB3  SER  68           1HB      SER  68   9.123  12.124 -14.595
  513    HG   SER  68           HG       SER  68   8.306  10.538 -13.351
  514    H    HIS  69           HN       HIS  69   9.180  11.500 -10.683
  515    HA   HIS  69           HA       HIS  69  11.595   9.939 -11.280
  516    HB2  HIS  69           2HB      HIS  69  10.892  11.267  -8.690
  517    HB3  HIS  69           1HB      HIS  69  11.835   9.780  -8.692
  518    HD1  HIS  69           1HD      HIS  69  14.192   9.878  -9.879
  519    HD2  HIS  69           2HD      HIS  69  12.276  13.542  -9.397
  520    HE1  HIS  69           1HE      HIS  69  15.966  11.629 -10.235
  521    HE2  HIS  69           2HE      HIS  69  14.818  13.833  -9.800
  522    H    THR  70           HN       THR  70  11.130   7.916 -11.526
  523    HA   THR  70           HA       THR  70   9.006   6.727  -9.860
  524    HB   THR  70           HB       THR  70  10.089   5.603 -12.455
  525    HG1  THR  70           1HG      THR  70   9.050   7.650 -12.801
  526   HG21  THR  70          3HG2      THR  70   8.958   4.024 -10.932
  527   HG22  THR  70          1HG2      THR  70   8.062   4.260 -12.431
  528   HG23  THR  70          2HG2      THR  70   7.529   5.055 -10.950
  529    H    VAL  71           HN       VAL  71   9.865   5.604  -8.215
  530    HA   VAL  71           HA       VAL  71  12.457   4.259  -8.642
  531    HB   VAL  71           HB       VAL  71  13.035   4.750  -6.289
  532   HG11  VAL  71          1HG1      VAL  71  12.437   7.196  -7.952
  533   HG12  VAL  71          2HG1      VAL  71  13.893   6.202  -8.034
  534   HG13  VAL  71          3HG1      VAL  71  13.542   7.136  -6.578
  535   HG21  VAL  71          3HG2      VAL  71  11.766   6.440  -5.042
  536   HG22  VAL  71          1HG2      VAL  71  10.785   5.016  -5.387
  537   HG23  VAL  71          2HG2      VAL  71  10.566   6.488  -6.334
  538    H    ASP  72           HN       ASP  72  12.877   2.518  -7.024
  539    HA   ASP  72           HA       ASP  72  10.582   0.840  -6.662
  540    HB2  ASP  72           2HB      ASP  72  12.191  -0.670  -5.471
  541    HB3  ASP  72           1HB      ASP  72  12.684  -0.251  -7.106
  542    H    VAL  73           HN       VAL  73   9.571   0.305  -4.723
  543    HA   VAL  73           HA       VAL  73   9.772   2.516  -2.806
  544    HB   VAL  73           HB       VAL  73   7.409   0.685  -3.176
  545   HG11  VAL  73          1HG1      VAL  73   7.745   3.390  -1.897
  546   HG12  VAL  73          2HG1      VAL  73   7.418   1.861  -1.078
  547   HG13  VAL  73          3HG1      VAL  73   6.199   2.575  -2.136
  548   HG21  VAL  73          3HG2      VAL  73   6.408   2.480  -4.533
  549   HG22  VAL  73          1HG2      VAL  73   7.825   1.765  -5.301
  550   HG23  VAL  73          2HG2      VAL  73   7.950   3.338  -4.508
  551    H    GLU  74           HN       GLU  74  10.168   2.194  -0.728
  552    HA   GLU  74           HA       GLU  74  10.670  -0.500   0.223
  553    HB2  GLU  74           2HB      GLU  74  11.078   2.226   1.458
  554    HB3  GLU  74           1HB      GLU  74  11.405   0.723   2.312
  555    HG2  GLU  74           2HG      GLU  74  12.706   1.531  -0.280
  556    HG3  GLU  74           1HG      GLU  74  13.414   1.777   1.316
  557    H    HIS  75           HN       HIS  75   9.617  -1.428   2.002
  558    HA   HIS  75           HA       HIS  75   7.085  -0.150   2.778
  559    HB2  HIS  75           2HB      HIS  75   6.047  -2.474   2.646
  560    HB3  HIS  75           1HB      HIS  75   6.388  -1.685   1.111
  561    HD1  HIS  75           1HD      HIS  75   8.144  -2.767  -0.415
  562    HD2  HIS  75           2HD      HIS  75   7.666  -4.730   3.219
  563    HE1  HIS  75           1HE      HIS  75   9.343  -4.961  -0.669
  564    HE2  HIS  75           2HE      HIS  75   9.233  -6.020   1.610
  565    H    ARG  76           HN       ARG  76   6.279  -0.743   4.819
  566    HA   ARG  76           HA       ARG  76   7.983  -2.420   6.492
  567    HB2  ARG  76           2HB      ARG  76   8.948  -0.204   6.734
  568    HB3  ARG  76           1HB      ARG  76   7.369   0.484   7.077
  569    HG2  ARG  76           2HG      ARG  76   7.255  -0.666   9.175
  570    HG3  ARG  76           1HG      ARG  76   8.729  -1.566   8.809
  571    HD2  ARG  76           2HD      ARG  76  10.045   0.441   8.889
  572    HD3  ARG  76           1HD      ARG  76   8.599   1.437   9.039
  573    HE   ARG  76           HE       ARG  76   8.253   0.288  11.231
  574   HH11  ARG  76          1HH1      ARG  76  11.474   0.545   9.842
  575   HH12  ARG  76          2HH1      ARG  76  12.270   0.504  11.387
  576   HH21  ARG  76          1HH2      ARG  76   9.307   0.229  13.236
  577   HH22  ARG  76          2HH2      ARG  76  11.038   0.314  13.311
  578    H    GLY  77           HN       GLY  77   6.923  -3.326   8.234
  579    HA2  GLY  77           2HA      GLY  77   4.883  -2.995   9.733
  580    HA3  GLY  77           1HA      GLY  77   4.000  -2.980   8.211
  581    H    PHE  78           HN       PHE  78   4.231  -4.910   6.829
  582    HA   PHE  78           HA       PHE  78   4.172  -7.342   8.375
  583    HB2  PHE  78           2HB      PHE  78   3.716  -8.417   6.146
  584    HB3  PHE  78           1HB      PHE  78   2.561  -7.171   6.598
  585    HD1  PHE  78           2HD      PHE  78   2.517  -5.033   5.423
  586    HD2  PHE  78           1HD      PHE  78   5.193  -8.136   4.268
  587    HE1  PHE  78           2HE      PHE  78   2.903  -3.897   3.276
  588    HE2  PHE  78           1HE      PHE  78   5.580  -7.003   2.119
  589    HZ   PHE  78           HZ       PHE  78   4.434  -4.881   1.620
  590    HA   PRO  79           HA       PRO  79   8.430  -8.271   7.711
  591    HB2  PRO  79           2HB      PRO  79   8.484 -10.826   8.498
  592    HB3  PRO  79           1HB      PRO  79   8.125  -9.523   9.637
  593    HG2  PRO  79           2HG      PRO  79   6.259 -11.420   8.277
  594    HG3  PRO  79           1HG      PRO  79   6.234 -10.826   9.947
  595    HD2  PRO  79           2HD      PRO  79   4.670  -9.833   7.891
  596    HD3  PRO  79           1HD      PRO  79   5.076  -8.945   9.374
  597    H    GLY  80           HN       GLY  80   9.908  -9.491   6.443
  598    HA2  GLY  80           2HA      GLY  80   8.851 -10.367   3.898
  599    HA3  GLY  80           1HA      GLY  80  10.546 -10.292   4.360
  600    H    ASP  81           HN       ASP  81   8.429 -11.901   6.496
  601    HA   ASP  81           HA       ASP  81   9.669 -14.439   6.164
  602    HB2  ASP  81           2HB      ASP  81   8.696 -13.639   8.312
  603    HB3  ASP  81           1HB      ASP  81   7.100 -13.741   7.586
  604    H    LEU  82           HN       LEU  82   6.646 -12.987   5.212
  605    HA   LEU  82           HA       LEU  82   5.655 -15.416   3.987
  606    HB2  LEU  82           2HB      LEU  82   4.486 -12.633   3.968
  607    HB3  LEU  82           1HB      LEU  82   3.657 -14.115   3.534
  608    HG   LEU  82           HG       LEU  82   4.690 -13.492   6.298
  609   HD11  LEU  82          1HD1      LEU  82   2.893 -11.966   5.660
  610   HD12  LEU  82          2HD1      LEU  82   2.371 -13.100   6.904
  611   HD13  LEU  82          3HD1      LEU  82   1.877 -13.341   5.230
  612   HD21  LEU  82          3HD2      LEU  82   4.554 -15.871   5.831
  613   HD22  LEU  82          1HD2      LEU  82   2.890 -15.684   5.278
  614   HD23  LEU  82          2HD2      LEU  82   3.296 -15.387   6.968
  615    H    ALA  83           HN       ALA  83   4.926 -15.404   1.738
  616    HA   ALA  83           HA       ALA  83   6.873 -14.184  -0.018
  617    HB1  ALA  83           1HB      ALA  83   6.115 -16.466  -0.458
  618    HB2  ALA  83           2HB      ALA  83   5.691 -15.400  -1.798
  619    HB3  ALA  83           3HB      ALA  83   4.458 -15.892  -0.638
  620    H    VAL  84           HN       VAL  84   6.653 -12.141  -0.612
  621    HA   VAL  84           HA       VAL  84   3.998 -10.913  -0.502
  622    HB   VAL  84           HB       VAL  84   6.698  -9.575  -0.779
  623   HG11  VAL  84          1HG1      VAL  84   3.995  -8.435  -0.075
  624   HG12  VAL  84          2HG1      VAL  84   4.858  -8.205  -1.597
  625   HG13  VAL  84          3HG1      VAL  84   5.517  -7.540  -0.101
  626   HG21  VAL  84          3HG2      VAL  84   5.021 -10.025   1.688
  627   HG22  VAL  84          1HG2      VAL  84   6.472  -9.023   1.610
  628   HG23  VAL  84          2HG2      VAL  84   6.583 -10.761   1.331
  629    H    THR  85           HN       THR  85   2.943 -10.312  -2.264
  630    HA   THR  85           HA       THR  85   4.412 -10.142  -4.816
  631    HB   THR  85           HB       THR  85   1.481 -10.802  -4.508
  632    HG1  THR  85           1HG      THR  85   2.340 -12.660  -3.822
  633   HG21  THR  85          3HG2      THR  85   2.101  -9.819  -6.657
  634   HG22  THR  85          1HG2      THR  85   1.672 -11.519  -6.848
  635   HG23  THR  85          2HG2      THR  85   3.366 -11.031  -6.855
  636    H    VAL  86           HN       VAL  86   4.005  -8.336  -6.066
  637    HA   VAL  86           HA       VAL  86   2.368  -6.251  -4.806
  638    HB   VAL  86           HB       VAL  86   5.134  -5.749  -5.902
  639   HG11  VAL  86          1HG1      VAL  86   3.679  -3.812  -5.987
  640   HG12  VAL  86          2HG1      VAL  86   4.914  -3.593  -4.744
  641   HG13  VAL  86          3HG1      VAL  86   3.267  -4.026  -4.285
  642   HG21  VAL  86          3HG2      VAL  86   5.314  -7.135  -3.909
  643   HG22  VAL  86          1HG2      VAL  86   4.291  -6.002  -3.023
  644   HG23  VAL  86          2HG2      VAL  86   5.882  -5.494  -3.592
  645    H    GLU  87           HN       GLU  87   1.377  -4.867  -6.168
  646    HA   GLU  87           HA       GLU  87   1.859  -5.162  -9.060
  647    HB2  GLU  87           2HB      GLU  87  -0.425  -3.771  -7.614
  648    HB3  GLU  87           1HB      GLU  87  -0.291  -4.008  -9.351
  649    HG2  GLU  87           2HG      GLU  87  -0.494  -6.246  -7.351
  650    HG3  GLU  87           1HG      GLU  87  -1.864  -5.556  -8.214
  651    HA   PRO  88           HA       PRO  88   4.340  -2.709 -10.396
  652    HB2  PRO  88           2HB      PRO  88   3.310   0.012  -9.871
  653    HB3  PRO  88           1HB      PRO  88   3.955  -0.685 -11.359
  654    HG2  PRO  88           2HG      PRO  88   1.187  -0.540 -10.474
  655    HG3  PRO  88           1HG      PRO  88   1.820  -1.040 -12.053
  656    HD2  PRO  88           2HD      PRO  88   0.609  -2.789 -10.374
  657    HD3  PRO  88           1HD      PRO  88   1.967  -3.283 -11.416
  658    H    ARG  89           HN       ARG  89   6.194  -2.474  -9.448
  659    HA   ARG  89           HA       ARG  89   6.207  -2.107  -6.556
  660    HB2  ARG  89           2HB      ARG  89   8.523  -2.964  -8.268
  661    HB3  ARG  89           1HB      ARG  89   8.268  -3.255  -6.550
  662    HG2  ARG  89           2HG      ARG  89   6.289  -4.650  -7.198
  663    HG3  ARG  89           1HG      ARG  89   6.836  -4.510  -8.868
  664    HD2  ARG  89           2HD      ARG  89   9.079  -5.348  -8.023
  665    HD3  ARG  89           1HD      ARG  89   8.230  -5.813  -6.552
  666    HE   ARG  89           HE       ARG  89   6.819  -6.877  -8.715
  667   HH11  ARG  89          1HH1      ARG  89   9.959  -7.249  -7.195
  668   HH12  ARG  89          2HH1      ARG  89  10.116  -8.924  -7.644
  669   HH21  ARG  89          1HH2      ARG  89   7.041  -9.043  -9.338
  670   HH22  ARG  89          2HH2      ARG  89   8.472  -9.931  -8.911
  671    H    MET  90           HN       MET  90   6.876  -0.457  -9.349
  672    HA   MET  90           HA       MET  90   8.650   1.456  -8.002
  673    HB2  MET  90           2HB      MET  90   8.061   1.018 -10.936
  674    HB3  MET  90           1HB      MET  90   9.048   2.332 -10.315
  675    HG2  MET  90           2HG      MET  90  10.665   0.781  -9.453
  676    HG3  MET  90           1HG      MET  90   9.643  -0.582  -9.902
  677    HE1  MET  90           3HE      MET  90  11.538   2.222 -13.049
  678    HE2  MET  90           1HE      MET  90  11.688   2.493 -11.312
  679    HE3  MET  90           2HE      MET  90  10.115   2.643 -12.097
  680    H    ALA  91           HN       ALA  91   7.940   3.459  -7.581
  681    HA   ALA  91           HA       ALA  91   5.197   4.097  -8.446
  682    HB1  ALA  91           1HB      ALA  91   6.532   4.804  -5.834
  683    HB2  ALA  91           2HB      ALA  91   5.285   3.578  -6.064
  684    HB3  ALA  91           3HB      ALA  91   4.906   5.280  -6.323
  685    H    ARG  92           HN       ARG  92   4.752   6.168  -9.038
  686    HA   ARG  92           HA       ARG  92   7.146   7.699  -9.773
  687    HB2  ARG  92           2HB      ARG  92   6.045   6.889 -11.720
  688    HB3  ARG  92           1HB      ARG  92   4.471   7.388 -11.118
  689    HG2  ARG  92           2HG      ARG  92   4.972   9.682 -11.449
  690    HG3  ARG  92           1HG      ARG  92   6.672   9.328 -11.768
  691    HD2  ARG  92           2HD      ARG  92   4.379   8.363 -13.467
  692    HD3  ARG  92           1HD      ARG  92   5.331   9.808 -13.809
  693    HE   ARG  92           HE       ARG  92   7.086   7.642 -13.488
  694   HH11  ARG  92          1HH1      ARG  92   4.558   8.663 -15.685
  695   HH12  ARG  92          2HH1      ARG  92   5.331   7.991 -17.095
  696   HH21  ARG  92          1HH2      ARG  92   8.090   6.733 -15.324
  697   HH22  ARG  92          2HH2      ARG  92   7.336   6.884 -16.881
  698    H    VAL  93           HN       VAL  93   7.434   9.581  -8.890
  699    HA   VAL  93           HA       VAL  93   5.088  11.145  -8.046
  700    HB   VAL  93           HB       VAL  93   7.816  11.165  -6.727
  701   HG11  VAL  93          1HG1      VAL  93   6.698  13.323  -6.636
  702   HG12  VAL  93          2HG1      VAL  93   6.751  12.577  -5.040
  703   HG13  VAL  93          3HG1      VAL  93   5.255  12.563  -5.971
  704   HG21  VAL  93          3HG2      VAL  93   5.213   9.989  -5.755
  705   HG22  VAL  93          1HG2      VAL  93   6.677  10.156  -4.787
  706   HG23  VAL  93          2HG2      VAL  93   6.669   9.098  -6.197
  707    H    GLN  94           HN       GLN  94   4.879  12.922  -9.217
  708    HA   GLN  94           HA       GLN  94   7.228  13.989 -10.610
  709    HB2  GLN  94           2HB      GLN  94   5.415  13.493 -12.101
  710    HB3  GLN  94           1HB      GLN  94   4.271  14.358 -11.083
  711    HG2  GLN  94           2HG      GLN  94   5.378  16.458 -11.603
  712    HG3  GLN  94           1HG      GLN  94   6.561  15.605 -12.586
  713   HE21  GLN  94          1HE2      GLN  94   5.967  16.865 -14.359
  714   HE22  GLN  94          2HE2      GLN  94   4.504  16.568 -15.224
  715    H    LEU  95           HN       LEU  95   8.172  15.725  -9.844
  716    HA   LEU  95           HA       LEU  95   6.603  17.572  -8.168
  717    HB2  LEU  95           2HB      LEU  95   9.495  16.768  -7.810
  718    HB3  LEU  95           1HB      LEU  95   8.645  17.960  -6.846
  719    HG   LEU  95           HG       LEU  95   7.864  15.049  -6.963
  720   HD11  LEU  95          1HD1      LEU  95   9.534  16.493  -4.909
  721   HD12  LEU  95          2HD1      LEU  95  10.106  15.260  -6.036
  722   HD13  LEU  95          3HD1      LEU  95   8.941  14.836  -4.782
  723   HD21  LEU  95          3HD2      LEU  95   7.119  17.282  -5.081
  724   HD22  LEU  95          1HD2      LEU  95   6.622  15.596  -4.931
  725   HD23  LEU  95          2HD2      LEU  95   6.075  16.558  -6.305
  726    H    GLU  96           HN       GLU  96   6.552  19.580  -8.990
  727    HA   GLU  96           HA       GLU  96   8.939  20.531 -10.383
  728    HB2  GLU  96           2HB      GLU  96   7.628  21.649 -12.109
  729    HB3  GLU  96           1HB      GLU  96   7.394  19.911 -12.156
  730    HG2  GLU  96           2HG      GLU  96   5.236  20.144 -11.085
  731    HG3  GLU  96           1HG      GLU  96   5.477  21.887 -10.943
  732    H    GLU  97           HN       GLU  97   9.356  22.700 -10.229
  733    HA   GLU  97           HA       GLU  97   8.813  23.772  -7.726
  734    HB2  GLU  97           2HB      GLU  97   9.869  25.853  -8.698
  735    HB3  GLU  97           1HB      GLU  97  10.829  24.387  -8.778
  736    HG2  GLU  97           2HG      GLU  97   9.130  25.033 -11.112
  737    HG3  GLU  97           1HG      GLU  97  10.545  26.044 -10.834
  738    H    ARG  98           HN       ARG  98   7.479  25.236  -6.946
  739    HA   ARG  98           HA       ARG  98   5.175  26.051  -8.451
  740    HB2  ARG  98           2HB      ARG  98   5.033  25.529  -6.051
  741    HB3  ARG  98           1HB      ARG  98   6.129  26.851  -5.692
  742    HG2  ARG  98           2HG      ARG  98   4.507  28.461  -6.387
  743    HG3  ARG  98           1HG      ARG  98   3.433  27.195  -6.983
  744    HD2  ARG  98           2HD      ARG  98   2.608  27.926  -4.860
  745    HD3  ARG  98           1HD      ARG  98   3.292  26.315  -4.650
  746    HE   ARG  98           HE       ARG  98   4.744  28.778  -3.902
  747   HH11  ARG  98          1HH1      ARG  98   3.685  25.508  -3.226
  748   HH12  ARG  98          2HH1      ARG  98   4.500  25.417  -1.700
  749   HH21  ARG  98          1HH2      ARG  98   5.815  28.661  -1.864
  750   HH22  ARG  98          2HH2      ARG  98   5.724  27.195  -0.931
  751    H    GLN  99           HN       GLN  99   4.752  28.091  -9.244
  752    HA   GLN  99           HA       GLN  99   7.029  29.603  -9.998
  753    HB2  GLN  99           2HB      GLN  99   4.069  30.018 -10.381
  754    HB3  GLN  99           1HB      GLN  99   5.301  31.034 -11.085
  755    HG2  GLN  99           2HG      GLN  99   4.901  28.108 -11.608
  756    HG3  GLN  99           1HG      GLN  99   4.531  29.435 -12.709
  757   HE21  GLN  99          1HE2      GLN  99   6.205  30.485 -13.762
  758   HE22  GLN  99          2HE2      GLN  99   7.801  29.835 -13.841
  759    H    THR 100           HN       THR 100   4.208  30.197  -7.979
  760    HA   THR 100           HA       THR 100   5.445  32.566  -6.841
  761    HB   THR 100           HB       THR 100   3.305  32.513  -5.396
  762    HG1  THR 100           1HG      THR 100   1.948  30.924  -5.755
  763   HG21  THR 100          3HG2      THR 100   1.966  33.486  -7.218
  764   HG22  THR 100          1HG2      THR 100   3.112  32.840  -8.394
  765   HG23  THR 100          2HG2      THR 100   3.629  34.071  -7.241
  766    H    VAL 101           HN       VAL 101   7.279  31.428  -5.944
  767    HA   VAL 101           HA       VAL 101   7.035  29.297  -4.113
  768    HB   VAL 101           HB       VAL 101   9.273  31.315  -4.256
  769   HG11  VAL 101          1HG1      VAL 101  10.635  29.497  -3.314
  770   HG12  VAL 101          2HG1      VAL 101   9.187  28.497  -3.189
  771   HG13  VAL 101          3HG1      VAL 101   9.324  29.972  -2.232
  772   HG21  VAL 101          3HG2      VAL 101   8.937  28.709  -5.738
  773   HG22  VAL 101          1HG2      VAL 101  10.390  29.709  -5.739
  774   HG23  VAL 101          2HG2      VAL 101   8.897  30.327  -6.446
  775    H    SER 102           HN       SER 102   8.098  32.538  -3.424
  776    HA   SER 102           HA       SER 102   6.247  33.397  -1.592
  777    HB2  SER 102           2HB      SER 102   7.067  31.349  -0.280
  778    HB3  SER 102           1HB      SER 102   8.601  32.198  -0.112
  779    HG   SER 102           HG       SER 102   6.589  32.406   1.482
  780    H    VAL 103           HN       VAL 103   7.383  35.112  -0.045
  781    HA   VAL 103           HA       VAL 103   9.576  36.355  -1.571
  782    HB   VAL 103           HB       VAL 103   7.806  37.648   0.516
  783   HG11  VAL 103          1HG1      VAL 103   9.988  38.704   0.308
  784   HG12  VAL 103          2HG1      VAL 103   8.726  39.748  -0.340
  785   HG13  VAL 103          3HG1      VAL 103   9.769  38.845  -1.437
  786   HG21  VAL 103          3HG2      VAL 103   6.720  38.802  -1.370
  787   HG22  VAL 103          1HG2      VAL 103   6.471  37.057  -1.415
  788   HG23  VAL 103          2HG2      VAL 103   7.650  37.807  -2.491
  789    HA   PRO 104           HA       PRO 104  11.632  34.579   2.038
  790    HB2  PRO 104           2HB      PRO 104  14.014  34.148   0.896
  791    HB3  PRO 104           1HB      PRO 104  12.605  33.164   0.487
  792    HG2  PRO 104           2HG      PRO 104  13.826  35.440  -1.021
  793    HG3  PRO 104           1HG      PRO 104  13.195  33.899  -1.630
  794    HD2  PRO 104           2HD      PRO 104  11.796  36.274  -1.671
  795    HD3  PRO 104           1HD      PRO 104  11.050  34.665  -1.696
  796    H    VAL 105           HN       VAL 105  14.205  34.923   2.621
  797    HA   VAL 105           HA       VAL 105  15.747  36.267   3.577
  798    HB   VAL 105           HB       VAL 105  14.646  38.569   1.959
  799   HG11  VAL 105          1HG1      VAL 105  16.106  39.251   3.775
  800   HG12  VAL 105          2HG1      VAL 105  16.919  39.481   2.228
  801   HG13  VAL 105          3HG1      VAL 105  17.338  38.103   3.246
  802   HG21  VAL 105          3HG2      VAL 105  16.800  36.592   1.209
  803   HG22  VAL 105          1HG2      VAL 105  16.407  38.060   0.315
  804   HG23  VAL 105          2HG2      VAL 105  15.220  36.760   0.441
  805    H    THR 106           HN       THR 106  14.462  35.861   5.475
  806    HA   THR 106           HA       THR 106  12.544  37.664   6.459
  807    HB   THR 106           HB       THR 106  14.404  36.014   8.160
  808    HG1  THR 106           1HG      THR 106  12.684  34.374   7.901
  809   HG21  THR 106          3HG2      THR 106  11.533  36.875   8.543
  810   HG22  THR 106          1HG2      THR 106  12.937  37.558   9.367
  811   HG23  THR 106          2HG2      THR 106  12.471  35.885   9.662
  812    H    VAL 107           HN       VAL 107  15.939  37.287   7.226
  813    HA   VAL 107           HA       VAL 107  16.463  40.069   7.266
  814    HB   VAL 107           HB       VAL 107  15.352  39.987   9.432
  815   HG11  VAL 107          1HG1      VAL 107  16.274  38.682  11.301
  816   HG12  VAL 107          2HG1      VAL 107  17.393  37.900  10.181
  817   HG13  VAL 107          3HG1      VAL 107  15.654  37.657  10.003
  818   HG21  VAL 107          3HG2      VAL 107  18.339  40.290   9.686
  819   HG22  VAL 107          1HG2      VAL 107  17.150  40.899  10.840
  820   HG23  VAL 107          2HG2      VAL 107  17.193  41.536   9.195
  821    H    GLU 108           HN       GLU 108  18.510  40.310   6.679
  822    HA   GLU 108           HA       GLU 108  20.255  37.995   6.739
  823    HB2  GLU 108           2HB      GLU 108  21.800  39.507   5.406
  824    HB3  GLU 108           1HB      GLU 108  20.269  39.096   4.648
  825    HG2  GLU 108           2HG      GLU 108  19.404  41.306   5.515
  826    HG3  GLU 108           1HG      GLU 108  21.077  41.693   5.913
  827    H    MET 109           HN       MET 109  21.321  37.617   8.502
  828    HA   MET 109           HA       MET 109  23.122  39.438   9.710
  829    HB2  MET 109           2HB      MET 109  20.960  40.346  10.585
  830    HB3  MET 109           1HB      MET 109  20.649  38.786  11.330
  831    HG2  MET 109           2HG      MET 109  22.788  39.085  12.607
  832    HG3  MET 109           1HG      MET 109  22.831  40.740  11.999
  833    HE1  MET 109           3HE      MET 109  19.443  42.142  13.498
  834    HE2  MET 109           1HE      MET 109  19.560  41.257  11.976
  835    HE3  MET 109           2HE      MET 109  20.782  42.460  12.394
  836    H    ILE 110           HN       ILE 110  21.018  36.995  11.189
  837    HA   ILE 110           HA       ILE 110  23.307  35.310  11.762
  838    HB   ILE 110           HB       ILE 110  21.845  33.912  13.037
  839   HG12  ILE 110          2HG1      ILE 110  19.890  34.000  11.437
  840   HG13  ILE 110          1HG1      ILE 110  19.468  34.073  13.141
  841   HG21  ILE 110          1HG2      ILE 110  22.575  35.956  14.116
  842   HG22  ILE 110          2HG2      ILE 110  20.972  35.488  14.682
  843   HG23  ILE 110          3HG2      ILE 110  21.145  36.801  13.518
  844   HD11  ILE 110          3HD1      ILE 110  19.310  36.583  12.849
  845   HD12  ILE 110          1HD1      ILE 110  18.079  35.609  12.043
  846   HD13  ILE 110          2HD1      ILE 110  19.412  36.283  11.111
  847    H    ASN 111           HN       ASN 111  20.806  35.632   9.477
  848    HA   ASN 111           HA       ASN 111  21.613  33.125   8.174
  849    HB2  ASN 111           2HB      ASN 111  19.034  34.693   8.012
  850    HB3  ASN 111           1HB      ASN 111  19.463  33.461   6.834
  851   HD21  ASN 111          1HD2      ASN 111  17.702  32.198   7.357
  852   HD22  ASN 111          2HD2      ASN 111  17.610  31.304   8.833
  853    H    LEU 112           HN       LEU 112  22.769  33.344   6.359
  854    HA   LEU 112           HA       LEU 112  22.873  35.990   5.091
  855    HB2  LEU 112           2HB      LEU 112  24.956  34.585   5.765
  856    HB3  LEU 112           1HB      LEU 112  24.583  33.630   4.348
  857    HG   LEU 112           HG       LEU 112  25.108  36.602   4.254
  858   HD11  LEU 112          1HD1      LEU 112  26.998  34.310   3.747
  859   HD12  LEU 112          2HD1      LEU 112  27.093  35.479   5.064
  860   HD13  LEU 112          3HD1      LEU 112  27.330  36.007   3.399
  861   HD21  LEU 112          3HD2      LEU 112  25.472  36.200   1.865
  862   HD22  LEU 112          1HD2      LEU 112  23.836  35.759   2.355
  863   HD23  LEU 112          2HD2      LEU 112  25.045  34.502   2.087
  864    H    GLU 113           HN       GLU 113  21.125  36.140   3.780
  865    HA   GLU 113           HA       GLU 113  20.342  33.773   2.254
  866    HB2  GLU 113           2HB      GLU 113  18.711  35.064   3.746
  867    HB3  GLU 113           1HB      GLU 113  18.755  36.319   2.514
  868    HG2  GLU 113           2HG      GLU 113  16.834  34.788   2.292
  869    HG3  GLU 113           1HG      GLU 113  17.879  34.809   0.869
  870    H    HIS 114           HN       HIS 114  19.672  34.047   0.011
  871    HA   HIS 114           HA       HIS 114  21.475  35.939  -1.342
  872    HB2  HIS 114           2HB      HIS 114  20.242  33.380  -2.382
  873    HB3  HIS 114           1HB      HIS 114  21.338  34.426  -3.279
  874    HD1  HIS 114           1HD      HIS 114  21.465  31.336  -1.771
  875    HD2  HIS 114           2HD      HIS 114  23.823  34.740  -1.359
  876    HE1  HIS 114           1HE      HIS 114  23.671  30.531  -0.860
  877    HE2  HIS 114           2HE      HIS 114  25.115  32.591  -0.705
  878    H    HIS 115           HN       HIS 115  20.485  37.707  -2.089
  879    HA   HIS 115           HA       HIS 115  17.753  37.700  -2.994
  880    HB2  HIS 115           2HB      HIS 115  19.971  39.727  -3.406
  881    HB3  HIS 115           1HB      HIS 115  18.300  39.970  -3.901
  882    HD1  HIS 115           1HD      HIS 115  20.386  41.175  -1.464
  883    HD2  HIS 115           2HD      HIS 115  16.645  39.370  -1.267
  884    HE1  HIS 115           1HE      HIS 115  19.404  41.893   0.733
  885    HE2  HIS 115           2HE      HIS 115  17.065  40.966   0.733
  886    H    HIS 116           HN       HIS 116  17.392  36.306  -4.672
  887    HA   HIS 116           HA       HIS 116  19.354  36.147  -6.802
  888    HB2  HIS 116           2HB      HIS 116  18.059  34.326  -7.721
  889    HB3  HIS 116           1HB      HIS 116  18.289  34.065  -6.000
  890    HD1  HIS 116           1HD      HIS 116  15.631  34.982  -8.516
  891    HD2  HIS 116           2HD      HIS 116  15.956  33.808  -4.538
  892    HE1  HIS 116           1HE      HIS 116  13.290  34.451  -7.770
  893    HE2  HIS 116           2HE      HIS 116  13.562  33.481  -5.467
  894    H    HIS 117           HN       HIS 117  19.321  37.246  -8.587
  895    HA   HIS 117           HA       HIS 117  16.942  38.097  -9.928
  896    HB2  HIS 117           2HB      HIS 117  16.910  39.793  -8.196
  897    HB3  HIS 117           1HB      HIS 117  18.609  40.159  -8.466
  898    HD1  HIS 117           1HD      HIS 117  18.840  42.318  -9.597
  899    HD2  HIS 117           2HD      HIS 117  15.485  40.252 -10.932
  900    HE1  HIS 117           1HE      HIS 117  17.792  43.785 -11.358
  901    HE2  HIS 117           2HE      HIS 117  15.672  42.592 -12.026
  902    H    HIS 118           HN       HIS 118  17.602  37.575 -11.926
  903    HA   HIS 118           HA       HIS 118  20.315  38.414 -12.719
  904    HB2  HIS 118           2HB      HIS 118  20.469  36.531 -14.208
  905    HB3  HIS 118           1HB      HIS 118  19.972  35.919 -12.636
  906    HD1  HIS 118           1HD      HIS 118  17.771  34.653 -12.529
  907    HD2  HIS 118           2HD      HIS 118  18.429  36.477 -16.207
  908    HE1  HIS 118           1HE      HIS 118  15.937  33.823 -14.039
  909    HE2  HIS 118           2HE      HIS 118  16.256  35.082 -16.201
  910    H    HIS 119           HN       HIS 119  20.487  39.794 -14.360
  911    HA   HIS 119           HA       HIS 119  19.089  39.650 -16.753
  912    HB2  HIS 119           2HB      HIS 119  17.211  40.537 -15.209
  913    HB3  HIS 119           1HB      HIS 119  18.116  42.048 -15.204
  914    HD1  HIS 119           1HD      HIS 119  17.469  43.638 -16.985
  915    HD2  HIS 119           2HD      HIS 119  16.608  39.703 -18.014
  916    HE1  HIS 119           1HE      HIS 119  16.341  43.750 -19.233
  917    HE2  HIS 119           2HE      HIS 119  16.062  41.344 -19.936
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1   5.874 -34.736   3.628
    2    H2   MET   1           H2       MET   1   4.498 -35.706   3.412
    3    H3   MET   1           H3       MET   1   4.398 -34.272   4.320
    4    HA   MET   1           HA       MET   1   4.990 -34.467   1.431
    5    HB2  MET   1           2HB      MET   1   2.773 -33.329   1.183
    6    HB3  MET   1           1HB      MET   1   2.677 -34.974   1.794
    7    HG2  MET   1           2HG      MET   1   2.440 -34.064   4.085
    8    HG3  MET   1           1HG      MET   1   2.419 -32.441   3.398
    9    HE1  MET   1           2HE      MET   1   0.154 -33.774   5.311
   10    HE2  MET   1           3HE      MET   1  -1.304 -33.147   4.540
   11    HE3  MET   1           1HE      MET   1   0.098 -32.100   4.759
   12    HA   PRO   2           HA       PRO   2   6.993 -30.613   2.200
   13    HB2  PRO   2           2HB      PRO   2   7.411 -29.904  -0.384
   14    HB3  PRO   2           1HB      PRO   2   8.371 -31.129   0.455
   15    HG2  PRO   2           2HG      PRO   2   6.095 -31.481  -1.457
   16    HG3  PRO   2           1HG      PRO   2   7.613 -32.391  -1.339
   17    HD2  PRO   2           2HD      PRO   2   5.262 -33.311  -0.343
   18    HD3  PRO   2           1HD      PRO   2   6.836 -33.717   0.365
   19    H    THR   3           HN       THR   3   6.384 -28.592   2.456
   20    HA   THR   3           HA       THR   3   5.122 -26.751   2.605
   21    HB   THR   3           HB       THR   3   4.239 -25.753   0.540
   22    HG1  THR   3           1HG      THR   3   4.277 -28.260  -0.346
   23   HG21  THR   3          3HG2      THR   3   6.412 -25.473  -0.562
   24   HG22  THR   3          1HG2      THR   3   7.037 -26.866   0.324
   25   HG23  THR   3          2HG2      THR   3   6.564 -25.407   1.193
   26    H    PHE   4           HN       PHE   4   3.511 -27.056   3.941
   27    HA   PHE   4           HA       PHE   4   0.887 -27.603   2.788
   28    HB2  PHE   4           2HB      PHE   4   1.684 -29.672   3.923
   29    HB3  PHE   4           1HB      PHE   4   1.796 -28.747   5.410
   30    HD1  PHE   4           2HD      PHE   4  -0.624 -29.737   2.774
   31    HD2  PHE   4           1HD      PHE   4  -0.032 -28.602   6.835
   32    HE1  PHE   4           2HE      PHE   4  -2.993 -30.206   3.245
   33    HE2  PHE   4           1HE      PHE   4  -2.399 -29.068   7.313
   34    HZ   PHE   4           HZ       PHE   4  -3.883 -29.871   5.518
   35    H    ASP   5           HN       ASP   5  -0.854 -26.608   3.939
   36    HA   ASP   5           HA       ASP   5  -1.866 -24.825   4.905
   37    HB2  ASP   5           2HB      ASP   5  -1.096 -25.637   7.042
   38    HB3  ASP   5           1HB      ASP   5   0.514 -24.981   6.769
   39    H    HIS   6           HN       HIS   6  -1.760 -23.488   3.173
   40    HA   HIS   6           HA       HIS   6   0.049 -21.264   3.276
   41    HB2  HIS   6           2HB      HIS   6   1.353 -23.186   2.211
   42    HB3  HIS   6           1HB      HIS   6   0.230 -23.079   0.864
   43    HD1  HIS   6           1HD      HIS   6   3.154 -21.396   2.420
   44    HD2  HIS   6           2HD      HIS   6   0.580 -20.823  -0.796
   45    HE1  HIS   6           1HE      HIS   6   4.251 -19.650   0.972
   46    HE2  HIS   6           2HE      HIS   6   2.741 -19.418  -1.036
   47    H    GLY   7           HN       GLY   7  -1.376 -19.697   2.927
   48    HA2  GLY   7           2HA      GLY   7  -3.154 -19.905   0.582
   49    HA3  GLY   7           1HA      GLY   7  -3.796 -19.404   2.140
   50    H    ASN   8           HN       ASN   8  -4.418 -17.473   0.812
   51    HA   ASN   8           HA       ASN   8  -2.190 -15.543   0.767
   52    HB2  ASN   8           2HB      ASN   8  -4.451 -15.801  -1.213
   53    HB3  ASN   8           1HB      ASN   8  -3.393 -14.405  -1.121
   54   HD21  ASN   8          1HD2      ASN   8  -1.445 -14.461  -2.044
   55   HD22  ASN   8          2HD2      ASN   8  -0.815 -15.830  -2.904
   56    H    LEU   9           HN       LEU   9  -2.753 -13.377   1.101
   57    HA   LEU   9           HA       LEU   9  -5.430 -12.756   2.083
   58    HB2  LEU   9           2HB      LEU   9  -3.777 -13.390   3.968
   59    HB3  LEU   9           1HB      LEU   9  -2.970 -11.884   3.589
   60    HG   LEU   9           HG       LEU   9  -4.529 -11.801   5.529
   61   HD11  LEU   9          1HD1      LEU   9  -5.184  -9.963   3.243
   62   HD12  LEU   9          2HD1      LEU   9  -3.877  -9.755   4.407
   63   HD13  LEU   9          3HD1      LEU   9  -5.555  -9.666   4.941
   64   HD21  LEU   9          3HD2      LEU   9  -6.933 -11.657   5.078
   65   HD22  LEU   9          1HD2      LEU   9  -6.273 -13.249   4.702
   66   HD23  LEU   9          2HD2      LEU   9  -6.629 -12.111   3.401
   67    H    SER  10           HN       SER  10  -6.079 -10.859   1.231
   68    HA   SER  10           HA       SER  10  -4.068  -9.386  -0.327
   69    HB2  SER  10           2HB      SER  10  -7.063  -9.399  -0.733
   70    HB3  SER  10           1HB      SER  10  -5.832  -8.813  -1.852
   71    HG   SER  10           HG       SER  10  -5.034 -11.114  -1.735
   72    H    LEU  11           HN       LEU  11  -3.684  -7.292   0.051
   73    HA   LEU  11           HA       LEU  11  -5.180  -5.928   2.144
   74    HB2  LEU  11           2HB      LEU  11  -2.743  -5.118   0.551
   75    HB3  LEU  11           1HB      LEU  11  -3.464  -4.138   1.811
   76    HG   LEU  11           HG       LEU  11  -2.269  -6.880   2.222
   77   HD11  LEU  11          1HD1      LEU  11  -0.480  -5.685   3.388
   78   HD12  LEU  11          2HD1      LEU  11  -1.203  -4.146   2.918
   79   HD13  LEU  11          3HD1      LEU  11  -0.560  -5.233   1.685
   80   HD21  LEU  11          3HD2      LEU  11  -2.504  -6.360   4.601
   81   HD22  LEU  11          1HD2      LEU  11  -4.070  -6.382   3.790
   82   HD23  LEU  11          2HD2      LEU  11  -3.307  -4.844   4.192
   83    H    GLY  12           HN       GLY  12  -4.981  -6.051  -1.280
   84    HA2  GLY  12           2HA      GLY  12  -6.437  -5.100  -2.830
   85    HA3  GLY  12           1HA      GLY  12  -7.123  -4.117  -1.541
   86    H    GLU  13           HN       GLU  13  -7.041  -2.243  -2.848
   87    HA   GLU  13           HA       GLU  13  -4.519  -1.291  -3.846
   88    HB2  GLU  13           2HB      GLU  13  -7.196   0.074  -3.548
   89    HB3  GLU  13           1HB      GLU  13  -5.780   0.842  -4.249
   90    HG2  GLU  13           2HG      GLU  13  -5.752  -0.963  -5.967
   91    HG3  GLU  13           1HG      GLU  13  -7.292  -1.526  -5.313
   92    H    LEU  14           HN       LEU  14  -3.001  -0.517  -2.570
   93    HA   LEU  14           HA       LEU  14  -3.780   0.847  -0.100
   94    HB2  LEU  14           2HB      LEU  14  -1.105  -0.167  -1.053
   95    HB3  LEU  14           1HB      LEU  14  -1.344   0.725   0.439
   96    HG   LEU  14           HG       LEU  14  -2.546  -1.962  -0.215
   97   HD11  LEU  14          1HD1      LEU  14  -1.057  -2.789   1.551
   98   HD12  LEU  14          2HD1      LEU  14  -0.337  -1.185   1.683
   99   HD13  LEU  14          3HD1      LEU  14  -0.160  -2.112   0.191
  100   HD21  LEU  14          3HD2      LEU  14  -4.021  -0.653   1.197
  101   HD22  LEU  14          1HD2      LEU  14  -2.687  -0.312   2.303
  102   HD23  LEU  14          2HD2      LEU  14  -3.281  -1.962   2.120
  103    H    GLU  15           HN       GLU  15  -3.546   2.955   0.148
  104    HA   GLU  15           HA       GLU  15  -2.756   4.581  -2.098
  105    HB2  GLU  15           2HB      GLU  15  -3.634   5.319   0.707
  106    HB3  GLU  15           1HB      GLU  15  -3.306   6.485  -0.566
  107    HG2  GLU  15           2HG      GLU  15  -5.110   5.563  -1.904
  108    HG3  GLU  15           1HG      GLU  15  -5.421   4.346  -0.668
  109    H    LEU  16           HN       LEU  16  -0.757   5.270  -2.471
  110    HA   LEU  16           HA       LEU  16   1.304   4.680  -0.532
  111    HB2  LEU  16           2HB      LEU  16   1.536   4.192  -2.967
  112    HB3  LEU  16           1HB      LEU  16   1.544   5.914  -3.282
  113    HG   LEU  16           HG       LEU  16   3.593   4.807  -1.411
  114   HD11  LEU  16          1HD1      LEU  16   3.607   3.273  -3.319
  115   HD12  LEU  16          2HD1      LEU  16   5.058   4.274  -3.275
  116   HD13  LEU  16          3HD1      LEU  16   3.764   4.644  -4.417
  117   HD21  LEU  16          3HD2      LEU  16   4.952   6.576  -2.415
  118   HD22  LEU  16          1HD2      LEU  16   3.441   7.219  -1.768
  119   HD23  LEU  16          2HD2      LEU  16   3.626   6.978  -3.506
  120    H    THR  17           HN       THR  17   2.277   6.063   0.769
  121    HA   THR  17           HA       THR  17   1.474   8.871   0.700
  122    HB   THR  17           HB       THR  17   3.121   7.437   2.798
  123    HG1  THR  17           1HG      THR  17   1.274   6.474   3.221
  124   HG21  THR  17          3HG2      THR  17   1.535  10.006   2.918
  125   HG22  THR  17          1HG2      THR  17   3.292   9.894   2.820
  126   HG23  THR  17          2HG2      THR  17   2.447   9.285   4.244
  127    H    VAL  18           HN       VAL  18   2.851  10.483   0.127
  128    HA   VAL  18           HA       VAL  18   5.548   9.656  -0.692
  129    HB   VAL  18           HB       VAL  18   3.995  12.095  -1.584
  130   HG11  VAL  18          1HG1      VAL  18   6.396  12.429  -1.707
  131   HG12  VAL  18          2HG1      VAL  18   5.721  12.265  -3.328
  132   HG13  VAL  18          3HG1      VAL  18   6.584  10.913  -2.591
  133   HG21  VAL  18          3HG2      VAL  18   4.481   9.499  -3.044
  134   HG22  VAL  18          1HG2      VAL  18   3.684  10.925  -3.707
  135   HG23  VAL  18          2HG2      VAL  18   2.940  10.037  -2.377
  136    H    LEU  19           HN       LEU  19   7.156  10.252   0.601
  137    HA   LEU  19           HA       LEU  19   6.787  12.561   2.363
  138    HB2  LEU  19           2HB      LEU  19   8.928  10.428   2.321
  139    HB3  LEU  19           1HB      LEU  19   8.835  11.736   3.483
  140    HG   LEU  19           HG       LEU  19   6.824   9.507   3.159
  141   HD11  LEU  19          1HD1      LEU  19   8.926   8.798   4.184
  142   HD12  LEU  19          2HD1      LEU  19   7.604   8.792   5.352
  143   HD13  LEU  19          3HD1      LEU  19   8.788  10.099   5.369
  144   HD21  LEU  19          3HD2      LEU  19   5.752  11.598   3.815
  145   HD22  LEU  19          1HD2      LEU  19   6.904  11.781   5.139
  146   HD23  LEU  19          2HD2      LEU  19   5.757  10.441   5.145
  147    H    TYR  20           HN       TYR  20   7.583  14.445   1.778
  148    HA   TYR  20           HA       TYR  20   9.995  14.632   0.178
  149    HB2  TYR  20           2HB      TYR  20   8.925  15.958  -1.588
  150    HB3  TYR  20           1HB      TYR  20   8.219  14.350  -1.507
  151    HD1  TYR  20           2HD      TYR  20   5.972  14.084  -0.324
  152    HD2  TYR  20           1HD      TYR  20   7.571  17.879  -1.395
  153    HE1  TYR  20           2HE      TYR  20   3.730  15.077  -0.127
  154    HE2  TYR  20           1HE      TYR  20   5.337  18.882  -1.202
  155    HH   TYR  20           HH       TYR  20   3.006  18.231  -1.263
  156    H    ASP  21           HN       ASP  21  10.687  16.889  -0.088
  157    HA   ASP  21           HA       ASP  21  10.164  18.452   2.281
  158    HB2  ASP  21           2HB      ASP  21  12.442  18.298   1.288
  159    HB3  ASP  21           1HB      ASP  21  11.849  19.126  -0.149
  160    H    GLU  22           HN       GLU  22   8.190  19.403   2.292
  161    HA   GLU  22           HA       GLU  22   6.918  20.136  -0.167
  162    HB2  GLU  22           2HB      GLU  22   4.981  20.657   1.156
  163    HB3  GLU  22           1HB      GLU  22   5.678  19.155   1.740
  164    HG2  GLU  22           2HG      GLU  22   5.247  20.164   3.719
  165    HG3  GLU  22           1HG      GLU  22   6.876  20.777   3.439
  166    H    GLU  23           HN       GLU  23   9.011  21.742   1.944
  167    HA   GLU  23           HA       GLU  23   8.056  24.381   1.654
  168    HB2  GLU  23           2HB      GLU  23  10.846  23.341   2.169
  169    HB3  GLU  23           1HB      GLU  23  10.389  25.035   2.258
  170    HG2  GLU  23           2HG      GLU  23   8.769  24.463   4.034
  171    HG3  GLU  23           1HG      GLU  23   9.362  22.801   3.989
  172    H    ARG  24           HN       ARG  24  10.480  22.485  -0.125
  173    HA   ARG  24           HA       ARG  24  10.596  24.594  -2.143
  174    HB2  ARG  24           2HB      ARG  24  12.697  23.498  -1.262
  175    HB3  ARG  24           1HB      ARG  24  12.186  22.028  -2.082
  176    HG2  ARG  24           2HG      ARG  24  12.220  23.205  -4.219
  177    HG3  ARG  24           1HG      ARG  24  12.741  24.676  -3.398
  178    HD2  ARG  24           2HD      ARG  24  14.736  23.358  -2.577
  179    HD3  ARG  24           1HD      ARG  24  14.244  22.084  -3.697
  180    HE   ARG  24           HE       ARG  24  14.769  24.820  -4.651
  181   HH11  ARG  24          1HH1      ARG  24  15.519  21.383  -4.715
  182   HH12  ARG  24          2HH1      ARG  24  16.467  21.498  -6.168
  183   HH21  ARG  24          1HH2      ARG  24  16.019  24.947  -6.545
  184   HH22  ARG  24          2HH2      ARG  24  16.752  23.518  -7.197
  185    H    TYR  25           HN       TYR  25   9.786  21.146  -1.855
  186    HA   TYR  25           HA       TYR  25   9.044  21.146  -4.699
  187    HB2  TYR  25           2HB      TYR  25   9.398  18.761  -2.883
  188    HB3  TYR  25           1HB      TYR  25   9.258  18.751  -4.637
  189    HD1  TYR  25           2HD      TYR  25  11.137  19.859  -5.978
  190    HD2  TYR  25           1HD      TYR  25  11.478  18.896  -1.848
  191    HE1  TYR  25           2HE      TYR  25  13.588  19.956  -6.158
  192    HE2  TYR  25           1HE      TYR  25  13.926  18.994  -2.020
  193    HH   TYR  25           HH       TYR  25  15.652  18.733  -3.814
  194    H    ASP  26           HN       ASP  26   7.020  20.590  -5.380
  195    HA   ASP  26           HA       ASP  26   5.150  19.505  -3.389
  196    HB2  ASP  26           2HB      ASP  26   4.662  21.923  -3.838
  197    HB3  ASP  26           1HB      ASP  26   4.370  21.510  -5.521
  198    H    ILE  27           HN       ILE  27   3.370  18.287  -4.428
  199    HA   ILE  27           HA       ILE  27   4.582  16.518  -6.359
  200    HB   ILE  27           HB       ILE  27   1.860  16.354  -5.061
  201   HG12  ILE  27          2HG1      ILE  27   4.435  14.924  -4.360
  202   HG13  ILE  27          1HG1      ILE  27   3.731  16.253  -3.444
  203   HG21  ILE  27          1HG2      ILE  27   1.951  15.104  -7.138
  204   HG22  ILE  27          2HG2      ILE  27   1.904  14.005  -5.760
  205   HG23  ILE  27          3HG2      ILE  27   3.424  14.291  -6.604
  206   HD11  ILE  27          3HD1      ILE  27   3.236  14.153  -2.373
  207   HD12  ILE  27          1HD1      ILE  27   2.522  13.526  -3.860
  208   HD13  ILE  27          2HD1      ILE  27   1.751  14.863  -3.005
  209    H    VAL  28           HN       VAL  28   4.448  16.864  -8.462
  210    HA   VAL  28           HA       VAL  28   2.116  18.259  -9.557
  211    HB   VAL  28           HB       VAL  28   4.668  17.421 -10.954
  212   HG11  VAL  28          1HG1      VAL  28   2.778  17.635 -12.478
  213   HG12  VAL  28          2HG1      VAL  28   3.949  18.927 -12.735
  214   HG13  VAL  28          3HG1      VAL  28   2.452  19.254 -11.862
  215   HG21  VAL  28          3HG2      VAL  28   5.116  19.079  -9.238
  216   HG22  VAL  28          1HG2      VAL  28   3.835  20.110  -9.873
  217   HG23  VAL  28          2HG2      VAL  28   5.276  19.799 -10.841
  218    H    GLU  29           HN       GLU  29   3.961  15.269  -9.965
  219    HA   GLU  29           HA       GLU  29   1.543  13.934 -10.933
  220    HB2  GLU  29           2HB      GLU  29   3.276  14.760 -12.768
  221    HB3  GLU  29           1HB      GLU  29   4.174  13.343 -12.255
  222    HG2  GLU  29           2HG      GLU  29   1.310  13.175 -13.126
  223    HG3  GLU  29           1HG      GLU  29   2.646  13.122 -14.274
  224    H    GLN  30           HN       GLN  30   1.704  11.543 -10.583
  225    HA   GLN  30           HA       GLN  30   3.771  10.539  -8.892
  226    HB2  GLN  30           2HB      GLN  30   2.411  10.385  -6.820
  227    HB3  GLN  30           1HB      GLN  30   2.803  12.043  -7.257
  228    HG2  GLN  30           2HG      GLN  30   0.585  12.359  -8.173
  229    HG3  GLN  30           1HG      GLN  30   0.185  10.675  -7.844
  230   HE21  GLN  30          1HE2      GLN  30   1.524  10.629  -5.281
  231   HE22  GLN  30          2HE2      GLN  30   0.531  11.530  -4.194
  232    H    THR  31           HN       THR  31   3.122   8.465  -7.841
  233    HA   THR  31           HA       THR  31   1.221   6.975  -9.486
  234    HB   THR  31           HB       THR  31   3.055   5.903  -7.331
  235    HG1  THR  31           1HG      THR  31   3.780   7.059  -9.560
  236   HG21  THR  31          3HG2      THR  31   1.711   4.584  -9.701
  237   HG22  THR  31          1HG2      THR  31   1.250   4.390  -8.009
  238   HG23  THR  31          2HG2      THR  31   2.809   3.789  -8.574
  239    H    GLU  32           HN       GLU  32  -0.644   6.069  -8.623
  240    HA   GLU  32           HA       GLU  32  -1.554   7.484  -6.252
  241    HB2  GLU  32           2HB      GLU  32  -3.108   5.915  -8.310
  242    HB3  GLU  32           1HB      GLU  32  -3.803   6.903  -7.030
  243    HG2  GLU  32           2HG      GLU  32  -2.972   8.897  -7.994
  244    HG3  GLU  32           1HG      GLU  32  -1.953   8.005  -9.122
  245    H    THR  33           HN       THR  33  -2.599   4.284  -7.424
  246    HA   THR  33           HA       THR  33  -2.158   3.272  -4.699
  247    HB   THR  33           HB       THR  33  -4.288   1.906  -5.079
  248    HG1  THR  33           1HG      THR  33  -5.449   2.311  -6.817
  249   HG21  THR  33          3HG2      THR  33  -4.511   4.900  -4.777
  250   HG22  THR  33          1HG2      THR  33  -4.184   3.745  -3.485
  251   HG23  THR  33          2HG2      THR  33  -5.744   3.728  -4.310
  252    H    VAL  34           HN       VAL  34  -1.586   1.146  -4.485
  253    HA   VAL  34           HA       VAL  34  -1.330  -0.460  -6.936
  254    HB   VAL  34           HB       VAL  34   0.782  -1.429  -6.047
  255   HG11  VAL  34          1HG1      VAL  34   0.890   0.272  -7.759
  256   HG12  VAL  34          2HG1      VAL  34   2.222   0.478  -6.623
  257   HG13  VAL  34          3HG1      VAL  34   0.819   1.543  -6.539
  258   HG21  VAL  34          3HG2      VAL  34   0.626   0.835  -4.060
  259   HG22  VAL  34          1HG2      VAL  34   2.012  -0.228  -4.303
  260   HG23  VAL  34          2HG2      VAL  34   0.495  -0.885  -3.694
  261    H    GLN  35           HN       GLN  35  -1.154  -2.814  -6.458
  262    HA   GLN  35           HA       GLN  35  -2.883  -3.440  -4.166
  263    HB2  GLN  35           2HB      GLN  35  -3.861  -4.039  -6.300
  264    HB3  GLN  35           1HB      GLN  35  -2.420  -4.939  -6.749
  265    HG2  GLN  35           2HG      GLN  35  -2.848  -6.528  -4.938
  266    HG3  GLN  35           1HG      GLN  35  -4.297  -5.629  -4.497
  267   HE21  GLN  35          1HE2      GLN  35  -2.822  -7.713  -6.850
  268   HE22  GLN  35          2HE2      GLN  35  -4.280  -8.162  -7.670
  269    H    VAL  36           HN       VAL  36  -2.180  -4.694  -2.564
  270    HA   VAL  36           HA       VAL  36   0.314  -6.233  -2.968
  271    HB   VAL  36           HB       VAL  36  -0.580  -4.882  -0.408
  272   HG11  VAL  36          1HG1      VAL  36   1.634  -5.548   0.440
  273   HG12  VAL  36          2HG1      VAL  36   1.930  -6.432  -1.057
  274   HG13  VAL  36          3HG1      VAL  36   0.635  -6.942   0.028
  275   HG21  VAL  36          3HG2      VAL  36   1.679  -4.186  -2.287
  276   HG22  VAL  36          1HG2      VAL  36   1.364  -3.420  -0.730
  277   HG23  VAL  36          2HG2      VAL  36   0.199  -3.256  -2.045
  278    H    ASP  37           HN       ASP  37   0.221  -8.317  -2.537
  279    HA   ASP  37           HA       ASP  37  -1.976  -9.371  -0.878
  280    HB2  ASP  37           2HB      ASP  37  -2.511  -9.754  -3.254
  281    HB3  ASP  37           1HB      ASP  37  -0.949 -10.532  -3.483
  282    H    LEU  38           HN       LEU  38  -1.386 -11.017   0.504
  283    HA   LEU  38           HA       LEU  38   1.492 -11.653   0.523
  284    HB2  LEU  38           2HB      LEU  38  -0.438 -11.406   2.834
  285    HB3  LEU  38           1HB      LEU  38   1.182 -12.053   2.985
  286    HG   LEU  38           HG       LEU  38   1.975  -9.778   2.065
  287   HD11  LEU  38          1HD1      LEU  38   0.491  -7.899   2.532
  288   HD12  LEU  38          2HD1      LEU  38  -0.803  -9.020   2.955
  289   HD13  LEU  38          3HD1      LEU  38  -0.190  -8.964   1.301
  290   HD21  LEU  38          3HD2      LEU  38   1.878  -8.789   4.318
  291   HD22  LEU  38          1HD2      LEU  38   2.358 -10.486   4.338
  292   HD23  LEU  38          2HD2      LEU  38   0.716 -10.028   4.792
  293    H    GLU  39           HN       GLU  39   2.075 -13.731   0.431
  294    HA   GLU  39           HA       GLU  39  -0.055 -15.757   0.684
  295    HB2  GLU  39           2HB      GLU  39   0.945 -15.370  -1.617
  296    HB3  GLU  39           1HB      GLU  39   2.467 -15.964  -0.970
  297    HG2  GLU  39           2HG      GLU  39   1.281 -18.086  -0.378
  298    HG3  GLU  39           1HG      GLU  39  -0.113 -17.473  -1.266
  299    H    GLY  40           HN       GLY  40   0.292 -17.433   2.078
  300    HA2  GLY  40           2HA      GLY  40   2.674 -18.587   2.835
  301    HA3  GLY  40           1HA      GLY  40   2.481 -17.218   3.917
  302    HA   PRO  41           HA       PRO  41   0.397 -21.001   5.750
  303    HB2  PRO  41           2HB      PRO  41   1.648 -19.893   8.192
  304    HB3  PRO  41           1HB      PRO  41   1.647 -21.550   7.579
  305    HG2  PRO  41           2HG      PRO  41   3.845 -20.033   7.465
  306    HG3  PRO  41           1HG      PRO  41   3.436 -21.174   6.171
  307    HD2  PRO  41           2HD      PRO  41   3.099 -18.199   6.251
  308    HD3  PRO  41           1HD      PRO  41   3.633 -19.239   4.913
  309    H    ARG  42           HN       ARG  42  -1.511 -21.007   6.856
  310    HA   ARG  42           HA       ARG  42  -2.998 -18.634   6.910
  311    HB2  ARG  42           2HB      ARG  42  -4.767 -19.896   7.920
  312    HB3  ARG  42           1HB      ARG  42  -3.961 -20.925   6.745
  313    HG2  ARG  42           2HG      ARG  42  -2.703 -21.984   8.585
  314    HG3  ARG  42           1HG      ARG  42  -3.619 -21.006   9.734
  315    HD2  ARG  42           2HD      ARG  42  -4.555 -23.256   9.511
  316    HD3  ARG  42           1HD      ARG  42  -5.690 -22.019   8.974
  317    HE   ARG  42           HE       ARG  42  -4.043 -23.593   7.096
  318   HH11  ARG  42          1HH1      ARG  42  -7.128 -22.249   8.102
  319   HH12  ARG  42          2HH1      ARG  42  -7.960 -22.759   6.655
  320   HH21  ARG  42          1HH2      ARG  42  -5.139 -24.262   5.215
  321   HH22  ARG  42          2HH2      ARG  42  -6.821 -23.892   5.006
  322    H    GLY  43           HN       GLY  43  -1.078 -20.154   9.406
  323    HA2  GLY  43           2HA      GLY  43  -2.129 -18.935  11.677
  324    HA3  GLY  43           1HA      GLY  43  -0.453 -19.432  11.495
  325    H    VAL  44           HN       VAL  44   0.488 -17.773   9.569
  326    HA   VAL  44           HA       VAL  44   0.909 -15.377  11.036
  327    HB   VAL  44           HB       VAL  44   1.575 -15.878   8.125
  328   HG11  VAL  44          1HG1      VAL  44   2.723 -13.960  10.145
  329   HG12  VAL  44          2HG1      VAL  44   1.760 -13.552   8.724
  330   HG13  VAL  44          3HG1      VAL  44   3.373 -14.240   8.530
  331   HG21  VAL  44          3HG2      VAL  44   3.789 -16.604   8.923
  332   HG22  VAL  44          1HG2      VAL  44   2.497 -17.670   9.476
  333   HG23  VAL  44          2HG2      VAL  44   3.209 -16.499  10.586
  334    H    LEU  45           HN       LEU  45  -1.052 -16.236   8.253
  335    HA   LEU  45           HA       LEU  45  -1.856 -13.636   7.526
  336    HB2  LEU  45           2HB      LEU  45  -3.285 -16.260   7.100
  337    HB3  LEU  45           1HB      LEU  45  -3.654 -14.756   6.281
  338    HG   LEU  45           HG       LEU  45  -1.065 -16.291   6.037
  339   HD11  LEU  45          1HD1      LEU  45  -3.349 -15.935   4.101
  340   HD12  LEU  45          2HD1      LEU  45  -2.933 -17.421   4.954
  341   HD13  LEU  45          3HD1      LEU  45  -1.825 -16.750   3.757
  342   HD21  LEU  45          3HD2      LEU  45  -2.029 -13.826   4.587
  343   HD22  LEU  45          1HD2      LEU  45  -0.530 -14.697   4.266
  344   HD23  LEU  45          2HD2      LEU  45  -0.756 -13.868   5.808
  345    H    THR  46           HN       THR  46  -3.309 -16.048   9.675
  346    HA   THR  46           HA       THR  46  -5.691 -14.582  10.164
  347    HB   THR  46           HB       THR  46  -4.409 -16.694  11.919
  348    HG1  THR  46           1HG      THR  46  -4.747 -17.651   9.961
  349   HG21  THR  46          3HG2      THR  46  -6.190 -15.425  13.033
  350   HG22  THR  46          1HG2      THR  46  -6.688 -17.086  12.717
  351   HG23  THR  46          2HG2      THR  46  -7.281 -15.778  11.694
  352    H    VAL  47           HN       VAL  47  -2.607 -14.813  11.948
  353    HA   VAL  47           HA       VAL  47  -3.358 -13.113  14.068
  354    HB   VAL  47           HB       VAL  47  -0.604 -13.528  12.877
  355   HG11  VAL  47          1HG1      VAL  47  -0.728 -11.482  14.214
  356   HG12  VAL  47          2HG1      VAL  47   0.250 -12.714  15.012
  357   HG13  VAL  47          3HG1      VAL  47  -1.397 -12.405  15.563
  358   HG21  VAL  47          3HG2      VAL  47  -1.950 -14.853  15.230
  359   HG22  VAL  47          1HG2      VAL  47  -0.284 -15.111  14.713
  360   HG23  VAL  47          2HG2      VAL  47  -1.617 -15.601  13.667
  361    H    PHE  48           HN       PHE  48  -1.988 -12.480  10.875
  362    HA   PHE  48           HA       PHE  48  -1.721  -9.681  11.169
  363    HB2  PHE  48           2HB      PHE  48  -0.583 -10.954   9.402
  364    HB3  PHE  48           1HB      PHE  48  -2.134 -11.331   8.664
  365    HD1  PHE  48           2HD      PHE  48   0.013  -8.452   9.630
  366    HD2  PHE  48           1HD      PHE  48  -2.985  -9.959   7.017
  367    HE1  PHE  48           2HE      PHE  48   0.164  -6.401   8.281
  368    HE2  PHE  48           1HE      PHE  48  -2.840  -7.912   5.663
  369    HZ   PHE  48           HZ       PHE  48  -1.264  -6.131   6.295
  370    H    ARG  49           HN       ARG  49  -4.428 -11.752  10.370
  371    HA   ARG  49           HA       ARG  49  -6.142  -9.710   9.421
  372    HB2  ARG  49           2HB      ARG  49  -6.464 -12.538  10.321
  373    HB3  ARG  49           1HB      ARG  49  -7.880 -11.547  10.100
  374    HG2  ARG  49           2HG      ARG  49  -6.552 -11.081   7.781
  375    HG3  ARG  49           1HG      ARG  49  -6.094 -12.747   8.128
  376    HD2  ARG  49           2HD      ARG  49  -8.094 -12.698   6.759
  377    HD3  ARG  49           1HD      ARG  49  -8.466 -13.339   8.360
  378    HE   ARG  49           HE       ARG  49  -9.483 -11.214   8.903
  379   HH11  ARG  49          1HH1      ARG  49  -8.808 -11.781   5.518
  380   HH12  ARG  49          2HH1      ARG  49  -9.890 -10.551   4.954
  381   HH21  ARG  49          1HH2      ARG  49 -10.916  -9.619   8.194
  382   HH22  ARG  49          2HH2      ARG  49 -11.101  -9.300   6.490
  383    H    PHE  50           HN       PHE  50  -5.281 -10.891  12.587
  384    HA   PHE  50           HA       PHE  50  -7.408  -9.515  13.940
  385    HB2  PHE  50           2HB      PHE  50  -4.898 -10.912  14.813
  386    HB3  PHE  50           1HB      PHE  50  -5.816  -9.934  15.943
  387    HD1  PHE  50           2HD      PHE  50  -8.340 -10.496  16.147
  388    HD2  PHE  50           1HD      PHE  50  -5.424 -13.138  14.535
  389    HE1  PHE  50           2HE      PHE  50  -9.827 -12.404  16.595
  390    HE2  PHE  50           1HE      PHE  50  -6.903 -15.054  14.979
  391    HZ   PHE  50           HZ       PHE  50  -9.109 -14.687  16.011
  392    H    ALA  51           HN       ALA  51  -4.283  -8.783  12.744
  393    HA   ALA  51           HA       ALA  51  -3.796  -6.514  14.412
  394    HB1  ALA  51           1HB      ALA  51  -2.474  -7.350  11.836
  395    HB2  ALA  51           2HB      ALA  51  -1.951  -7.796  13.461
  396    HB3  ALA  51           3HB      ALA  51  -1.886  -6.110  12.944
  397    H    ARG  52           HN       ARG  52  -4.903  -4.705  14.249
  398    HA   ARG  52           HA       ARG  52  -6.385  -3.871  12.014
  399    HB2  ARG  52           2HB      ARG  52  -5.341  -2.374  14.413
  400    HB3  ARG  52           1HB      ARG  52  -6.506  -1.732  13.277
  401    HG2  ARG  52           2HG      ARG  52  -8.079  -3.485  13.849
  402    HG3  ARG  52           1HG      ARG  52  -6.901  -4.188  14.955
  403    HD2  ARG  52           2HD      ARG  52  -6.943  -2.136  16.294
  404    HD3  ARG  52           1HD      ARG  52  -8.142  -1.453  15.192
  405    HE   ARG  52           HE       ARG  52  -9.070  -3.930  16.150
  406   HH11  ARG  52          1HH1      ARG  52  -8.414  -0.693  17.312
  407   HH12  ARG  52          2HH1      ARG  52  -9.661  -0.739  18.522
  408   HH21  ARG  52          1HH2      ARG  52 -10.722  -4.001  17.719
  409   HH22  ARG  52          2HH2      ARG  52 -10.987  -2.624  18.755
  410    HA   PRO  53           HA       PRO  53  -3.604  -2.094   9.218
  411    HB2  PRO  53           2HB      PRO  53  -4.671   0.627   9.607
  412    HB3  PRO  53           1HB      PRO  53  -4.519  -0.316   8.125
  413    HG2  PRO  53           2HG      PRO  53  -6.900   0.061   9.317
  414    HG3  PRO  53           1HG      PRO  53  -6.495  -1.447   8.475
  415    HD2  PRO  53           2HD      PRO  53  -6.662  -0.884  11.388
  416    HD3  PRO  53           1HD      PRO  53  -6.985  -2.392  10.509
  417    H    SER  54           HN       SER  54  -1.593  -1.902   9.724
  418    HA   SER  54           HA       SER  54  -0.590   0.440  11.084
  419    HB2  SER  54           2HB      SER  54  -0.033  -2.433  11.756
  420    HB3  SER  54           1HB      SER  54   0.980  -1.112  12.272
  421    HG   SER  54           HG       SER  54  -1.611  -0.606  12.823
  422    H    TYR  55           HN       TYR  55  -0.802  -0.981   8.380
  423    HA   TYR  55           HA       TYR  55   2.030  -1.179   7.702
  424    HB2  TYR  55           2HB      TYR  55   1.073  -2.195   5.531
  425    HB3  TYR  55           1HB      TYR  55   0.986  -3.166   6.997
  426    HD1  TYR  55           1HD      TYR  55  -0.955  -1.232   4.547
  427    HD2  TYR  55           2HD      TYR  55  -1.137  -3.653   8.043
  428    HE1  TYR  55           1HE      TYR  55  -3.384  -1.470   4.252
  429    HE2  TYR  55           2HE      TYR  55  -3.565  -3.897   7.755
  430    HH   TYR  55           HH       TYR  55  -5.174  -3.029   4.905
  431    H    GLU  56           HN       GLU  56   2.937   0.107   6.178
  432    HA   GLU  56           HA       GLU  56   1.256   2.170   4.972
  433    HB2  GLU  56           2HB      GLU  56   2.589   2.654   7.305
  434    HB3  GLU  56           1HB      GLU  56   3.783   3.160   6.122
  435    HG2  GLU  56           2HG      GLU  56   0.951   4.144   6.082
  436    HG3  GLU  56           1HG      GLU  56   2.215   4.931   7.022
  437    H    VAL  57           HN       VAL  57   2.135   3.105   3.146
  438    HA   VAL  57           HA       VAL  57   4.608   1.869   2.121
  439    HB   VAL  57           HB       VAL  57   2.138   2.495   0.475
  440   HG11  VAL  57          1HG1      VAL  57   3.319   1.365  -1.343
  441   HG12  VAL  57          2HG1      VAL  57   4.724   1.149  -0.299
  442   HG13  VAL  57          3HG1      VAL  57   4.216   2.771  -0.770
  443   HG21  VAL  57          3HG2      VAL  57   1.915   0.067   0.199
  444   HG22  VAL  57          1HG2      VAL  57   1.748   0.552   1.886
  445   HG23  VAL  57          2HG2      VAL  57   3.250  -0.179   1.324
  446    H    PHE  58           HN       PHE  58   6.083   3.375   1.556
  447    HA   PHE  58           HA       PHE  58   5.227   6.050   0.859
  448    HB2  PHE  58           2HB      PHE  58   6.487   7.118   2.689
  449    HB3  PHE  58           1HB      PHE  58   5.170   6.124   3.302
  450    HD1  PHE  58           1HD      PHE  58   5.678   3.906   4.315
  451    HD2  PHE  58           2HD      PHE  58   8.727   6.681   3.264
  452    HE1  PHE  58           1HE      PHE  58   7.260   2.715   5.774
  453    HE2  PHE  58           2HE      PHE  58  10.314   5.494   4.718
  454    HZ   PHE  58           HZ       PHE  58   9.582   3.506   5.975
  455    H    VAL  59           HN       VAL  59   6.898   7.379   0.087
  456    HA   VAL  59           HA       VAL  59   9.503   6.092  -0.310
  457    HB   VAL  59           HB       VAL  59   9.629   7.196  -2.568
  458   HG11  VAL  59          1HG1      VAL  59   9.207   4.811  -2.371
  459   HG12  VAL  59          2HG1      VAL  59   8.299   5.488  -3.721
  460   HG13  VAL  59          3HG1      VAL  59   7.477   5.112  -2.207
  461   HG21  VAL  59          3HG2      VAL  59   6.663   7.570  -2.144
  462   HG22  VAL  59          1HG2      VAL  59   7.509   7.793  -3.674
  463   HG23  VAL  59          2HG2      VAL  59   7.870   8.847  -2.307
  464    H    ASP  60           HN       ASP  60  11.195   7.369   0.164
  465    HA   ASP  60           HA       ASP  60  10.669  10.135   0.908
  466    HB2  ASP  60           2HB      ASP  60  12.929   8.239   1.432
  467    HB3  ASP  60           1HB      ASP  60  13.211   9.972   1.538
  468    H    LEU  61           HN       LEU  61  10.602  11.400  -0.822
  469    HA   LEU  61           HA       LEU  61  12.820  11.187  -2.749
  470    HB2  LEU  61           2HB      LEU  61   9.974  12.082  -3.209
  471    HB3  LEU  61           1HB      LEU  61  11.254  12.186  -4.407
  472    HG   LEU  61           HG       LEU  61  10.197   9.631  -3.185
  473   HD11  LEU  61          1HD1      LEU  61   8.609  10.688  -4.698
  474   HD12  LEU  61          2HD1      LEU  61   9.274   9.209  -5.394
  475   HD13  LEU  61          3HD1      LEU  61   9.849  10.782  -5.946
  476   HD21  LEU  61          3HD2      LEU  61  12.201  10.046  -5.406
  477   HD22  LEU  61          1HD2      LEU  61  11.593   8.497  -4.820
  478   HD23  LEU  61          2HD2      LEU  61  12.581   9.510  -3.770
  479    H    THR  62           HN       THR  62  12.867  12.613  -0.304
  480    HA   THR  62           HA       THR  62  12.316  15.340  -0.511
  481    HB   THR  62           HB       THR  62  14.740  14.649   0.996
  482    HG1  THR  62           1HG      THR  62  12.446  13.556   2.143
  483   HG21  THR  62          3HG2      THR  62  13.461  16.715   1.350
  484   HG22  THR  62          1HG2      THR  62  13.489  15.721   2.807
  485   HG23  THR  62          2HG2      THR  62  12.045  15.760   1.792
  486    H    GLU  63           HN       GLU  63  15.098  13.441  -1.568
  487    HA   GLU  63           HA       GLU  63  16.563  15.763  -2.442
  488    HB2  GLU  63           2HB      GLU  63  17.021  12.842  -3.025
  489    HB3  GLU  63           1HB      GLU  63  18.170  14.150  -3.288
  490    HG2  GLU  63           2HG      GLU  63  17.062  13.320  -0.624
  491    HG3  GLU  63           1HG      GLU  63  18.633  12.871  -1.263
  492    H    ALA  64           HN       ALA  64  14.552  13.280  -3.819
  493    HA   ALA  64           HA       ALA  64  13.578  12.958  -5.842
  494    HB1  ALA  64           1HB      ALA  64  12.654  15.190  -5.442
  495    HB2  ALA  64           2HB      ALA  64  12.972  14.926  -7.156
  496    HB3  ALA  64           3HB      ALA  64  14.073  15.915  -6.198
  497    H    GLY  65           HN       GLY  65  14.152  14.211  -8.350
  498    HA2  GLY  65           2HA      GLY  65  17.006  13.938  -8.795
  499    HA3  GLY  65           1HA      GLY  65  15.996  12.721  -9.569
  500    H    GLU  66           HN       GLU  66  15.949  13.236 -11.683
  501    HA   GLU  66           HA       GLU  66  15.283  16.005 -12.362
  502    HB2  GLU  66           2HB      GLU  66  15.954  15.428 -14.655
  503    HB3  GLU  66           1HB      GLU  66  17.257  15.236 -13.513
  504    HG2  GLU  66           2HG      GLU  66  15.566  12.953 -14.491
  505    HG3  GLU  66           1HG      GLU  66  17.049  13.465 -15.291
  506    H    GLY  67           HN       GLY  67  13.515  16.466 -13.589
  507    HA2  GLY  67           2HA      GLY  67  11.304  16.274 -14.189
  508    HA3  GLY  67           1HA      GLY  67  11.802  14.750 -14.904
  509    H    SER  68           HN       SER  68  10.439  13.295 -14.350
  510    HA   SER  68           HA       SER  68   9.659  13.012 -11.535
  511    HB2  SER  68           2HB      SER  68   7.832  12.873 -13.175
  512    HB3  SER  68           1HB      SER  68   8.642  11.528 -13.970
  513    HG   SER  68           HG       SER  68   6.909  11.324 -12.095
  514    H    HIS  69           HN       HIS  69  10.262  11.250 -10.366
  515    HA   HIS  69           HA       HIS  69  12.429   9.674 -11.596
  516    HB2  HIS  69           2HB      HIS  69  13.099  11.288  -9.783
  517    HB3  HIS  69           1HB      HIS  69  12.136  10.334  -8.662
  518    HD1  HIS  69           1HD      HIS  69  14.071   9.521  -7.231
  519    HD2  HIS  69           2HD      HIS  69  14.555   8.666 -11.267
  520    HE1  HIS  69           1HE      HIS  69  16.050   7.977  -7.359
  521    HE2  HIS  69           2HE      HIS  69  16.213   7.332  -9.790
  522    H    THR  70           HN       THR  70  12.115   7.572 -11.776
  523    HA   THR  70           HA       THR  70   9.862   6.355 -10.343
  524    HB   THR  70           HB       THR  70  11.475   5.086 -12.552
  525    HG1  THR  70           1HG      THR  70  10.017   7.287 -12.761
  526   HG21  THR  70          3HG2      THR  70  10.007   3.605 -11.294
  527   HG22  THR  70          1HG2      THR  70   9.389   3.839 -12.929
  528   HG23  THR  70          2HG2      THR  70   8.646   4.691 -11.575
  529    H    VAL  71           HN       VAL  71  10.245   5.149  -8.605
  530    HA   VAL  71           HA       VAL  71  12.806   3.706  -8.420
  531    HB   VAL  71           HB       VAL  71  12.802   4.097  -5.963
  532   HG11  VAL  71          1HG1      VAL  71  14.227   5.437  -7.394
  533   HG12  VAL  71          2HG1      VAL  71  13.617   6.407  -6.052
  534   HG13  VAL  71          3HG1      VAL  71  12.914   6.584  -7.660
  535   HG21  VAL  71          3HG2      VAL  71  10.607   6.071  -6.598
  536   HG22  VAL  71          1HG2      VAL  71  11.439   5.930  -5.048
  537   HG23  VAL  71          2HG2      VAL  71  10.449   4.598  -5.640
  538    H    ASP  72           HN       ASP  72  12.735   1.765  -7.173
  539    HA   ASP  72           HA       ASP  72  10.168   0.469  -7.122
  540    HB2  ASP  72           2HB      ASP  72  11.470  -1.441  -6.069
  541    HB3  ASP  72           1HB      ASP  72  11.983  -0.967  -7.684
  542    H    VAL  73           HN       VAL  73   8.881   0.115  -5.404
  543    HA   VAL  73           HA       VAL  73   9.416   1.874  -3.143
  544    HB   VAL  73           HB       VAL  73   6.873   0.383  -3.786
  545   HG11  VAL  73          1HG1      VAL  73   5.823   2.074  -2.362
  546   HG12  VAL  73          2HG1      VAL  73   7.406   2.774  -2.027
  547   HG13  VAL  73          3HG1      VAL  73   7.032   1.140  -1.478
  548   HG21  VAL  73          3HG2      VAL  73   6.078   2.497  -4.754
  549   HG22  VAL  73          1HG2      VAL  73   7.446   1.830  -5.647
  550   HG23  VAL  73          2HG2      VAL  73   7.689   3.185  -4.546
  551    H    GLU  74           HN       GLU  74  10.100   1.154  -1.258
  552    HA   GLU  74           HA       GLU  74   9.795  -1.653  -0.569
  553    HB2  GLU  74           2HB      GLU  74  11.746   0.295   0.009
  554    HB3  GLU  74           1HB      GLU  74  10.956  -0.076   1.539
  555    HG2  GLU  74           2HG      GLU  74  12.331  -1.991  -0.327
  556    HG3  GLU  74           1HG      GLU  74  12.815  -1.540   1.308
  557    H    HIS  75           HN       HIS  75   8.919  -2.239   1.547
  558    HA   HIS  75           HA       HIS  75   6.663  -0.481   2.247
  559    HB2  HIS  75           2HB      HIS  75   5.360  -2.722   2.459
  560    HB3  HIS  75           1HB      HIS  75   5.599  -2.026   0.860
  561    HD1  HIS  75           1HD      HIS  75   7.285  -4.626   3.089
  562    HD2  HIS  75           2HD      HIS  75   6.663  -3.751  -0.924
  563    HE1  HIS  75           1HE      HIS  75   8.247  -6.566   1.820
  564    HE2  HIS  75           2HE      HIS  75   8.148  -5.838  -0.590
  565    H    ARG  76           HN       ARG  76   5.837  -0.706   4.354
  566    HA   ARG  76           HA       ARG  76   7.320  -2.461   6.172
  567    HB2  ARG  76           2HB      ARG  76   6.997   0.514   6.436
  568    HB3  ARG  76           1HB      ARG  76   7.226  -0.502   7.851
  569    HG2  ARG  76           2HG      ARG  76   9.127  -0.437   5.522
  570    HG3  ARG  76           1HG      ARG  76   9.300   0.566   6.962
  571    HD2  ARG  76           2HD      ARG  76  10.685  -1.273   7.370
  572    HD3  ARG  76           1HD      ARG  76   9.219  -1.625   8.279
  573    HE   ARG  76           HE       ARG  76   9.470  -2.765   5.594
  574   HH11  ARG  76          1HH1      ARG  76   9.403  -3.221   9.061
  575   HH12  ARG  76          2HH1      ARG  76   9.418  -4.951   8.970
  576   HH21  ARG  76          1HH2      ARG  76   9.480  -5.058   5.460
  577   HH22  ARG  76          2HH2      ARG  76   9.461  -6.001   6.923
  578    H    GLY  77           HN       GLY  77   6.231  -2.629   8.321
  579    HA2  GLY  77           2HA      GLY  77   4.197  -2.340   9.604
  580    HA3  GLY  77           1HA      GLY  77   3.324  -2.207   8.088
  581    H    PHE  78           HN       PHE  78   3.579  -4.214   6.638
  582    HA   PHE  78           HA       PHE  78   2.958  -6.532   8.260
  583    HB2  PHE  78           2HB      PHE  78   2.425  -7.617   6.069
  584    HB3  PHE  78           1HB      PHE  78   1.495  -6.160   6.386
  585    HD1  PHE  78           1HD      PHE  78   1.942  -4.105   5.122
  586    HD2  PHE  78           2HD      PHE  78   3.956  -7.751   4.246
  587    HE1  PHE  78           1HE      PHE  78   2.606  -3.207   2.932
  588    HE2  PHE  78           2HE      PHE  78   4.627  -6.858   2.055
  589    HZ   PHE  78           HZ       PHE  78   3.951  -4.584   1.397
  590    HA   PRO  79           HA       PRO  79   6.973  -8.230   8.204
  591    HB2  PRO  79           2HB      PRO  79   6.398 -10.889   8.364
  592    HB3  PRO  79           1HB      PRO  79   6.236  -9.776   9.727
  593    HG2  PRO  79           2HG      PRO  79   4.130 -10.814   7.869
  594    HG3  PRO  79           1HG      PRO  79   4.066 -10.609   9.629
  595    HD2  PRO  79           2HD      PRO  79   2.932  -8.847   7.933
  596    HD3  PRO  79           1HD      PRO  79   3.648  -8.345   9.478
  597    H    GLY  80           HN       GLY  80   8.432  -8.644   6.669
  598    HA2  GLY  80           2HA      GLY  80   7.582  -9.481   4.030
  599    HA3  GLY  80           1HA      GLY  80   9.216  -9.043   4.515
  600    H    ASP  81           HN       ASP  81   7.582 -11.326   6.473
  601    HA   ASP  81           HA       ASP  81   9.493 -13.368   5.872
  602    HB2  ASP  81           2HB      ASP  81   7.211 -13.046   7.779
  603    HB3  ASP  81           1HB      ASP  81   7.928 -14.627   7.540
  604    H    LEU  82           HN       LEU  82   6.372 -12.526   4.791
  605    HA   LEU  82           HA       LEU  82   5.788 -15.214   3.820
  606    HB2  LEU  82           2HB      LEU  82   4.128 -12.692   3.687
  607    HB3  LEU  82           1HB      LEU  82   3.600 -14.303   3.243
  608    HG   LEU  82           HG       LEU  82   4.347 -13.404   6.024
  609   HD11  LEU  82          1HD1      LEU  82   1.971 -13.704   6.505
  610   HD12  LEU  82          2HD1      LEU  82   1.677 -14.094   4.810
  611   HD13  LEU  82          3HD1      LEU  82   2.224 -12.479   5.259
  612   HD21  LEU  82          3HD2      LEU  82   3.318 -16.055   5.019
  613   HD22  LEU  82          1HD2      LEU  82   3.503 -15.608   6.715
  614   HD23  LEU  82          2HD2      LEU  82   4.921 -15.738   5.676
  615    H    ALA  83           HN       ALA  83   4.762 -15.211   1.548
  616    HA   ALA  83           HA       ALA  83   6.622 -13.967  -0.290
  617    HB1  ALA  83           1HB      ALA  83   4.233 -15.739  -0.831
  618    HB2  ALA  83           2HB      ALA  83   5.902 -16.284  -0.674
  619    HB3  ALA  83           3HB      ALA  83   5.439 -15.243  -2.018
  620    H    VAL  84           HN       VAL  84   6.313 -11.917  -0.841
  621    HA   VAL  84           HA       VAL  84   3.633 -10.789  -0.589
  622    HB   VAL  84           HB       VAL  84   6.256  -9.347  -1.017
  623   HG11  VAL  84          1HG1      VAL  84   5.014  -7.351  -0.333
  624   HG12  VAL  84          2HG1      VAL  84   3.538  -8.309  -0.231
  625   HG13  VAL  84          3HG1      VAL  84   4.329  -8.075  -1.789
  626   HG21  VAL  84          3HG2      VAL  84   6.265 -10.493   1.120
  627   HG22  VAL  84          1HG2      VAL  84   4.679  -9.826   1.511
  628   HG23  VAL  84          2HG2      VAL  84   6.076  -8.757   1.377
  629    H    THR  85           HN       THR  85   2.422 -10.317  -2.291
  630    HA   THR  85           HA       THR  85   3.704 -10.245  -4.948
  631    HB   THR  85           HB       THR  85   0.774 -10.681  -4.437
  632    HG1  THR  85           1HG      THR  85   1.489 -12.507  -3.549
  633   HG21  THR  85          3HG2      THR  85   2.548 -11.379  -6.774
  634   HG22  THR  85          1HG2      THR  85   1.432 -10.015  -6.702
  635   HG23  THR  85          2HG2      THR  85   0.811 -11.665  -6.671
  636    H    VAL  86           HN       VAL  86   3.518  -8.414  -6.090
  637    HA   VAL  86           HA       VAL  86   1.843  -6.273  -4.984
  638    HB   VAL  86           HB       VAL  86   4.632  -5.781  -6.009
  639   HG11  VAL  86          1HG1      VAL  86   3.116  -3.873  -6.082
  640   HG12  VAL  86          2HG1      VAL  86   4.394  -3.627  -4.892
  641   HG13  VAL  86          3HG1      VAL  86   2.772  -4.073  -4.362
  642   HG21  VAL  86          3HG2      VAL  86   5.370  -5.551  -3.695
  643   HG22  VAL  86          1HG2      VAL  86   4.803  -7.189  -4.023
  644   HG23  VAL  86          2HG2      VAL  86   3.781  -6.064  -3.130
  645    H    GLU  87           HN       GLU  87   0.925  -4.923  -6.427
  646    HA   GLU  87           HA       GLU  87   1.523  -5.352  -9.271
  647    HB2  GLU  87           2HB      GLU  87  -0.803  -3.967  -7.902
  648    HB3  GLU  87           1HB      GLU  87  -0.556  -3.982  -9.644
  649    HG2  GLU  87           2HG      GLU  87  -1.125  -6.328  -7.854
  650    HG3  GLU  87           1HG      GLU  87  -2.158  -5.659  -9.116
  651    HA   PRO  88           HA       PRO  88   4.193  -3.100 -10.534
  652    HB2  PRO  88           2HB      PRO  88   3.176  -0.340 -10.597
  653    HB3  PRO  88           1HB      PRO  88   3.898  -1.299 -11.887
  654    HG2  PRO  88           2HG      PRO  88   1.080  -0.942 -11.245
  655    HG3  PRO  88           1HG      PRO  88   1.807  -1.702 -12.674
  656    HD2  PRO  88           2HD      PRO  88   0.419  -3.114 -10.813
  657    HD3  PRO  88           1HD      PRO  88   1.804  -3.813 -11.687
  658    H    ARG  89           HN       ARG  89   5.900  -2.759  -9.404
  659    HA   ARG  89           HA       ARG  89   5.634  -1.583  -6.743
  660    HB2  ARG  89           2HB      ARG  89   7.836  -2.688  -6.330
  661    HB3  ARG  89           1HB      ARG  89   6.462  -3.750  -6.608
  662    HG2  ARG  89           2HG      ARG  89   7.193  -4.015  -8.946
  663    HG3  ARG  89           1HG      ARG  89   8.627  -3.048  -8.565
  664    HD2  ARG  89           2HD      ARG  89   9.261  -4.614  -6.867
  665    HD3  ARG  89           1HD      ARG  89   7.804  -5.556  -7.142
  666    HE   ARG  89           HE       ARG  89   8.783  -5.811  -9.506
  667   HH11  ARG  89          1HH1      ARG  89  10.726  -5.619  -6.582
  668   HH12  ARG  89          2HH1      ARG  89  11.986  -6.629  -7.221
  669   HH21  ARG  89          1HH2      ARG  89  10.393  -7.140 -10.322
  670   HH22  ARG  89          2HH2      ARG  89  11.781  -7.543  -9.349
  671    H    MET  90           HN       MET  90   6.296  -0.447  -9.605
  672    HA   MET  90           HA       MET  90   8.620   1.161  -8.803
  673    HB2  MET  90           2HB      MET  90   7.411   0.798 -11.556
  674    HB3  MET  90           1HB      MET  90   8.875   1.692 -11.178
  675    HG2  MET  90           2HG      MET  90   8.488  -1.275 -10.838
  676    HG3  MET  90           1HG      MET  90   9.358  -0.488 -12.152
  677    HE1  MET  90           3HE      MET  90  10.908   1.862 -10.639
  678    HE2  MET  90           1HE      MET  90  11.610   0.818 -11.872
  679    HE3  MET  90           2HE      MET  90  12.443   1.051 -10.337
  680    H    ALA  91           HN       ALA  91   8.250   3.207  -8.238
  681    HA   ALA  91           HA       ALA  91   5.652   4.377  -8.998
  682    HB1  ALA  91           1HB      ALA  91   5.615   5.544  -6.872
  683    HB2  ALA  91           2HB      ALA  91   7.165   4.831  -6.430
  684    HB3  ALA  91           3HB      ALA  91   5.744   3.807  -6.614
  685    H    ARG  92           HN       ARG  92   5.670   6.231  -9.973
  686    HA   ARG  92           HA       ARG  92   8.204   7.712 -10.186
  687    HB2  ARG  92           2HB      ARG  92   7.296   8.633 -12.275
  688    HB3  ARG  92           1HB      ARG  92   7.296   6.872 -12.326
  689    HG2  ARG  92           2HG      ARG  92   4.955   6.787 -11.900
  690    HG3  ARG  92           1HG      ARG  92   4.894   8.520 -11.584
  691    HD2  ARG  92           2HD      ARG  92   5.775   8.731 -14.015
  692    HD3  ARG  92           1HD      ARG  92   5.182   7.072 -14.181
  693    HE   ARG  92           HE       ARG  92   3.516   9.381 -13.380
  694   HH11  ARG  92          1HH1      ARG  92   3.909   6.369 -15.120
  695   HH12  ARG  92          2HH1      ARG  92   2.214   6.206 -15.479
  696   HH21  ARG  92          1HH2      ARG  92   1.317   9.200 -13.843
  697   HH22  ARG  92          2HH2      ARG  92   0.725   7.831 -14.750
  698    H    VAL  93           HN       VAL  93   8.283   9.696  -9.299
  699    HA   VAL  93           HA       VAL  93   5.775  11.162  -8.904
  700    HB   VAL  93           HB       VAL  93   7.892  10.883  -6.756
  701   HG11  VAL  93          1HG1      VAL  93   5.313  12.441  -6.764
  702   HG12  VAL  93          2HG1      VAL  93   6.943  13.115  -6.776
  703   HG13  VAL  93          3HG1      VAL  93   6.371  12.218  -5.369
  704   HG21  VAL  93          3HG2      VAL  93   6.499   8.888  -6.901
  705   HG22  VAL  93          1HG2      VAL  93   5.045   9.883  -6.818
  706   HG23  VAL  93          2HG2      VAL  93   6.136   9.798  -5.434
  707    H    GLN  94           HN       GLN  94   5.909  13.173  -9.622
  708    HA   GLN  94           HA       GLN  94   8.576  14.299 -10.118
  709    HB2  GLN  94           2HB      GLN  94   7.228  14.279 -12.107
  710    HB3  GLN  94           1HB      GLN  94   5.868  15.007 -11.263
  711    HG2  GLN  94           2HG      GLN  94   7.120  17.070 -10.981
  712    HG3  GLN  94           1HG      GLN  94   8.516  16.350 -11.771
  713   HE21  GLN  94          1HE2      GLN  94   6.979  18.708 -12.471
  714   HE22  GLN  94          2HE2      GLN  94   6.429  18.438 -14.083
  715    H    LEU  95           HN       LEU  95   9.308  15.719  -8.732
  716    HA   LEU  95           HA       LEU  95   7.378  17.306  -7.181
  717    HB2  LEU  95           2HB      LEU  95  10.223  16.538  -6.523
  718    HB3  LEU  95           1HB      LEU  95   9.225  17.604  -5.549
  719    HG   LEU  95           HG       LEU  95   8.625  14.696  -6.107
  720   HD11  LEU  95          1HD1      LEU  95  10.588  15.013  -4.679
  721   HD12  LEU  95          2HD1      LEU  95   9.227  14.330  -3.788
  722   HD13  LEU  95          3HD1      LEU  95   9.634  16.036  -3.604
  723   HD21  LEU  95          3HD2      LEU  95   7.287  16.686  -4.274
  724   HD22  LEU  95          1HD2      LEU  95   6.910  14.966  -4.381
  725   HD23  LEU  95          2HD2      LEU  95   6.607  16.022  -5.761
  726    H    GLU  96           HN       GLU  96   7.308  19.390  -7.593
  727    HA   GLU  96           HA       GLU  96   9.600  20.640  -8.941
  728    HB2  GLU  96           2HB      GLU  96   7.587  20.017 -10.444
  729    HB3  GLU  96           1HB      GLU  96   6.752  21.330  -9.629
  730    HG2  GLU  96           2HG      GLU  96   8.399  22.913 -10.412
  731    HG3  GLU  96           1HG      GLU  96   9.334  21.611 -11.145
  732    H    GLU  97           HN       GLU  97   9.969  22.800  -8.408
  733    HA   GLU  97           HA       GLU  97   9.504  23.581  -5.828
  734    HB2  GLU  97           2HB      GLU  97  10.185  25.173  -8.286
  735    HB3  GLU  97           1HB      GLU  97  10.044  25.923  -6.707
  736    HG2  GLU  97           2HG      GLU  97  11.765  24.353  -5.866
  737    HG3  GLU  97           1HG      GLU  97  11.966  23.768  -7.519
  738    H    ARG  98           HN       ARG  98   7.845  24.315  -4.752
  739    HA   ARG  98           HA       ARG  98   5.312  24.794  -5.879
  740    HB2  ARG  98           2HB      ARG  98   5.676  24.103  -3.545
  741    HB3  ARG  98           1HB      ARG  98   6.402  25.661  -3.191
  742    HG2  ARG  98           2HG      ARG  98   4.320  26.776  -3.518
  743    HG3  ARG  98           1HG      ARG  98   3.566  25.302  -4.130
  744    HD2  ARG  98           2HD      ARG  98   4.693  25.602  -1.350
  745    HD3  ARG  98           1HD      ARG  98   3.000  25.864  -1.759
  746    HE   ARG  98           HE       ARG  98   3.390  23.390  -2.688
  747   HH11  ARG  98          1HH1      ARG  98   4.303  24.824   0.371
  748   HH12  ARG  98          2HH1      ARG  98   4.135  23.345   1.273
  749   HH21  ARG  98          1HH2      ARG  98   3.156  21.443  -1.527
  750   HH22  ARG  98          2HH2      ARG  98   3.473  21.432   0.187
  751    H    GLN  99           HN       GLN  99   4.220  26.692  -6.322
  752    HA   GLN  99           HA       GLN  99   5.775  28.389  -7.827
  753    HB2  GLN  99           2HB      GLN  99   3.574  29.718  -7.954
  754    HB3  GLN  99           1HB      GLN  99   3.673  28.136  -8.672
  755    HG2  GLN  99           2HG      GLN  99   2.575  28.553  -5.913
  756    HG3  GLN  99           1HG      GLN  99   1.578  28.766  -7.347
  757   HE21  GLN  99          1HE2      GLN  99   1.133  26.954  -8.647
  758   HE22  GLN  99          2HE2      GLN  99   1.274  25.344  -8.022
  759    H    THR 100           HN       THR 100   3.536  29.963  -5.616
  760    HA   THR 100           HA       THR 100   5.729  31.403  -4.347
  761    HB   THR 100           HB       THR 100   3.496  32.984  -5.632
  762    HG1  THR 100           1HG      THR 100   5.885  31.988  -6.754
  763   HG21  THR 100          3HG2      THR 100   5.087  34.826  -5.429
  764   HG22  THR 100          1HG2      THR 100   6.296  33.726  -4.762
  765   HG23  THR 100          2HG2      THR 100   4.819  34.070  -3.860
  766    H    VAL 101           HN       VAL 101   3.173  29.624  -3.933
  767    HA   VAL 101           HA       VAL 101   2.274  31.042  -1.532
  768    HB   VAL 101           HB       VAL 101   0.436  29.584  -3.451
  769   HG11  VAL 101          1HG1      VAL 101  -1.369  30.331  -1.969
  770   HG12  VAL 101          2HG1      VAL 101  -0.173  31.013  -0.864
  771   HG13  VAL 101          3HG1      VAL 101  -0.235  29.271  -1.131
  772   HG21  VAL 101          3HG2      VAL 101  -0.614  31.763  -3.809
  773   HG22  VAL 101          1HG2      VAL 101   1.082  31.782  -4.296
  774   HG23  VAL 101          2HG2      VAL 101   0.594  32.519  -2.768
  775    H    SER 102           HN       SER 102   2.732  29.810   0.161
  776    HA   SER 102           HA       SER 102   3.278  26.998  -0.144
  777    HB2  SER 102           2HB      SER 102   3.683  27.153   2.360
  778    HB3  SER 102           1HB      SER 102   4.699  28.190   1.359
  779    HG   SER 102           HG       SER 102   3.940  29.818   2.427
  780    H    VAL 103           HN       VAL 103   2.315  25.864   2.178
  781    HA   VAL 103           HA       VAL 103  -0.311  25.205   1.473
  782    HB   VAL 103           HB       VAL 103  -0.460  24.167   3.770
  783   HG11  VAL 103          1HG1      VAL 103   0.265  22.912   1.824
  784   HG12  VAL 103          2HG1      VAL 103   1.179  22.416   3.248
  785   HG13  VAL 103          3HG1      VAL 103   1.919  23.480   2.049
  786   HG21  VAL 103          3HG2      VAL 103   2.391  25.141   3.951
  787   HG22  VAL 103          1HG2      VAL 103   1.623  24.004   5.060
  788   HG23  VAL 103          2HG2      VAL 103   1.044  25.666   4.959
  789    HA   PRO 104           HA       PRO 104  -2.448  28.693   3.116
  790    HB2  PRO 104           2HB      PRO 104  -4.939  27.952   2.490
  791    HB3  PRO 104           1HB      PRO 104  -3.751  28.344   1.244
  792    HG2  PRO 104           2HG      PRO 104  -4.660  25.664   2.211
  793    HG3  PRO 104           1HG      PRO 104  -4.356  26.212   0.553
  794    HD2  PRO 104           2HD      PRO 104  -2.570  24.752   2.058
  795    HD3  PRO 104           1HD      PRO 104  -2.114  25.803   0.703
  796    H    VAL 105           HN       VAL 105  -1.853  26.280   4.883
  797    HA   VAL 105           HA       VAL 105  -4.025  25.743   6.564
  798    HB   VAL 105           HB       VAL 105  -1.109  25.880   7.367
  799   HG11  VAL 105          1HG1      VAL 105  -1.749  24.280   9.105
  800   HG12  VAL 105          2HG1      VAL 105  -3.430  24.383   8.582
  801   HG13  VAL 105          3HG1      VAL 105  -2.631  25.799   9.271
  802   HG21  VAL 105          3HG2      VAL 105  -1.030  23.488   6.857
  803   HG22  VAL 105          1HG2      VAL 105  -1.434  24.430   5.421
  804   HG23  VAL 105          2HG2      VAL 105  -2.697  23.550   6.283
  805    H    THR 106           HN       THR 106  -5.223  27.401   7.276
  806    HA   THR 106           HA       THR 106  -4.005  29.893   8.054
  807    HB   THR 106           HB       THR 106  -6.920  29.143   8.258
  808    HG1  THR 106           1HG      THR 106  -5.476  29.127   6.071
  809   HG21  THR 106          3HG2      THR 106  -5.511  31.788   7.881
  810   HG22  THR 106          1HG2      THR 106  -6.268  31.227   9.369
  811   HG23  THR 106          2HG2      THR 106  -7.259  31.556   7.945
  812    H    VAL 107           HN       VAL 107  -3.715  30.629  10.089
  813    HA   VAL 107           HA       VAL 107  -3.937  28.678  12.221
  814    HB   VAL 107           HB       VAL 107  -2.839  31.499  12.306
  815   HG11  VAL 107          1HG1      VAL 107  -1.730  30.802  14.355
  816   HG12  VAL 107          2HG1      VAL 107  -2.462  29.201  14.224
  817   HG13  VAL 107          3HG1      VAL 107  -3.480  30.615  14.510
  818   HG21  VAL 107          3HG2      VAL 107  -0.637  30.453  12.135
  819   HG22  VAL 107          1HG2      VAL 107  -1.621  30.088  10.717
  820   HG23  VAL 107          2HG2      VAL 107  -1.397  28.869  11.971
  821    H    GLU 108           HN       GLU 108  -5.315  28.726  13.884
  822    HA   GLU 108           HA       GLU 108  -6.920  29.342  15.346
  823    HB2  GLU 108           2HB      GLU 108  -5.631  31.737  14.848
  824    HB3  GLU 108           1HB      GLU 108  -7.318  32.110  14.530
  825    HG2  GLU 108           2HG      GLU 108  -6.108  31.073  17.074
  826    HG3  GLU 108           1HG      GLU 108  -6.902  32.622  16.799
  827    H    MET 109           HN       MET 109  -7.690  31.553  12.662
  828    HA   MET 109           HA       MET 109 -10.193  30.072  12.275
  829    HB2  MET 109           2HB      MET 109 -10.697  31.885  13.812
  830    HB3  MET 109           1HB      MET 109  -9.942  33.050  12.736
  831    HG2  MET 109           2HG      MET 109 -11.674  32.835  11.141
  832    HG3  MET 109           1HG      MET 109 -12.337  31.415  11.951
  833    HE1  MET 109           3HE      MET 109 -10.989  34.504  13.948
  834    HE2  MET 109           1HE      MET 109 -12.378  35.590  13.917
  835    HE3  MET 109           2HE      MET 109 -11.505  35.230  12.425
  836    H    ILE 110           HN       ILE 110 -10.734  29.802  10.220
  837    HA   ILE 110           HA       ILE 110  -8.943  30.367   8.152
  838    HB   ILE 110           HB       ILE 110 -10.446  28.487   7.991
  839   HG12  ILE 110          2HG1      ILE 110 -11.419  28.869   5.703
  840   HG13  ILE 110          1HG1      ILE 110 -10.976  30.566   5.861
  841   HG21  ILE 110          1HG2      ILE 110 -12.688  30.495   7.870
  842   HG22  ILE 110          2HG2      ILE 110 -12.348  29.379   9.192
  843   HG23  ILE 110          3HG2      ILE 110 -12.855  28.757   7.621
  844   HD11  ILE 110          3HD1      ILE 110  -9.352  29.346   4.543
  845   HD12  ILE 110          1HD1      ILE 110  -9.074  28.238   5.888
  846   HD13  ILE 110          2HD1      ILE 110  -8.634  29.940   6.039
  847    H    ASN 111           HN       ASN 111  -8.676  32.005   6.810
  848    HA   ASN 111           HA       ASN 111 -10.269  34.396   7.053
  849    HB2  ASN 111           2HB      ASN 111  -7.921  34.741   6.796
  850    HB3  ASN 111           1HB      ASN 111  -7.843  33.672   5.400
  851   HD21  ASN 111          1HD2      ASN 111  -8.848  36.811   6.561
  852   HD22  ASN 111          2HD2      ASN 111  -8.979  37.557   4.999
  853    H    LEU 112           HN       LEU 112 -11.830  35.062   5.725
  854    HA   LEU 112           HA       LEU 112 -13.416  35.072   4.109
  855    HB2  LEU 112           2HB      LEU 112 -11.321  33.605   2.496
  856    HB3  LEU 112           1HB      LEU 112 -12.815  34.250   1.843
  857    HG   LEU 112           HG       LEU 112 -10.572  35.875   3.049
  858   HD11  LEU 112          1HD1      LEU 112 -11.479  35.530   0.194
  859   HD12  LEU 112          2HD1      LEU 112  -9.974  34.934   0.894
  860   HD13  LEU 112          3HD1      LEU 112 -10.252  36.669   0.749
  861   HD21  LEU 112          3HD2      LEU 112 -12.720  36.925   3.449
  862   HD22  LEU 112          1HD2      LEU 112 -13.160  36.724   1.753
  863   HD23  LEU 112          2HD2      LEU 112 -11.841  37.805   2.198
  864    H    GLU 113           HN       GLU 113 -14.161  33.186   2.216
  865    HA   GLU 113           HA       GLU 113 -14.762  30.831   3.871
  866    HB2  GLU 113           2HB      GLU 113 -16.913  30.688   2.620
  867    HB3  GLU 113           1HB      GLU 113 -16.772  32.133   3.612
  868    HG2  GLU 113           2HG      GLU 113 -16.152  33.418   1.610
  869    HG3  GLU 113           1HG      GLU 113 -16.376  31.966   0.634
  870    H    HIS 114           HN       HIS 114 -14.151  28.943   3.073
  871    HA   HIS 114           HA       HIS 114 -13.383  28.826   0.222
  872    HB2  HIS 114           2HB      HIS 114 -11.518  28.629   1.922
  873    HB3  HIS 114           1HB      HIS 114 -12.266  27.139   2.476
  874    HD1  HIS 114           1HD      HIS 114 -11.484  25.071   1.376
  875    HD2  HIS 114           2HD      HIS 114 -10.699  28.465  -0.901
  876    HE1  HIS 114           1HE      HIS 114 -10.126  24.275  -0.593
  877    HE2  HIS 114           2HE      HIS 114  -9.554  26.363  -1.892
  878    H    HIS 115           HN       HIS 115 -14.895  27.750  -0.879
  879    HA   HIS 115           HA       HIS 115 -16.637  25.866   0.502
  880    HB2  HIS 115           2HB      HIS 115 -16.701  26.756  -2.393
  881    HB3  HIS 115           1HB      HIS 115 -17.946  25.837  -1.562
  882    HD1  HIS 115           1HD      HIS 115 -18.439  28.571  -2.972
  883    HD2  HIS 115           2HD      HIS 115 -17.791  28.061   1.108
  884    HE1  HIS 115           1HE      HIS 115 -19.480  30.575  -1.860
  885    HE2  HIS 115           2HE      HIS 115 -18.921  30.339   0.583
  886    H    HIS 116           HN       HIS 116 -15.412  24.050   0.872
  887    HA   HIS 116           HA       HIS 116 -14.724  22.522  -1.534
  888    HB2  HIS 116           2HB      HIS 116 -12.625  23.511  -0.734
  889    HB3  HIS 116           1HB      HIS 116 -12.912  22.852   0.871
  890    HD1  HIS 116           1HD      HIS 116 -11.774  21.910  -2.555
  891    HD2  HIS 116           2HD      HIS 116 -12.375  20.105   1.145
  892    HE1  HIS 116           1HE      HIS 116 -10.690  19.639  -2.716
  893    HE2  HIS 116           2HE      HIS 116 -11.229  18.502  -0.526
  894    H    HIS 117           HN       HIS 117 -16.487  21.189  -1.255
  895    HA   HIS 117           HA       HIS 117 -16.175  19.315   0.990
  896    HB2  HIS 117           2HB      HIS 117 -18.566  19.042   1.195
  897    HB3  HIS 117           1HB      HIS 117 -18.195  20.754   1.320
  898    HD1  HIS 117           1HD      HIS 117 -19.348  22.308  -0.306
  899    HD2  HIS 117           2HD      HIS 117 -19.808  18.291  -1.296
  900    HE1  HIS 117           1HE      HIS 117 -21.041  22.252  -2.163
  901    HE2  HIS 117           2HE      HIS 117 -21.126  19.838  -2.889
  902    H    HIS 118           HN       HIS 118 -16.338  17.148   0.476
  903    HA   HIS 118           HA       HIS 118 -17.021  16.456  -2.284
  904    HB2  HIS 118           2HB      HIS 118 -14.544  16.845  -2.183
  905    HB3  HIS 118           1HB      HIS 118 -14.435  15.535  -1.013
  906    HD1  HIS 118           1HD      HIS 118 -14.795  13.101  -1.915
  907    HD2  HIS 118           2HD      HIS 118 -14.870  16.072  -4.830
  908    HE1  HIS 118           1HE      HIS 118 -14.663  11.897  -4.119
  909    HE2  HIS 118           2HE      HIS 118 -14.892  13.703  -5.863
  910    H    HIS 119           HN       HIS 119 -18.561  14.998  -2.064
  911    HA   HIS 119           HA       HIS 119 -18.170  12.846  -0.091
  912    HB2  HIS 119           2HB      HIS 119 -20.658  13.951  -1.382
  913    HB3  HIS 119           1HB      HIS 119 -20.641  12.347  -0.660
  914    HD1  HIS 119           1HD      HIS 119 -20.898  12.191   1.836
  915    HD2  HIS 119           2HD      HIS 119 -20.231  16.087   0.522
  916    HE1  HIS 119           1HE      HIS 119 -21.257  13.662   3.847
  917    HE2  HIS 119           2HE      HIS 119 -20.711  15.992   3.064
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1 -11.720 -19.118  -0.115
    2    H2   MET   1           H2       MET   1 -12.157 -19.090  -1.755
    3    H3   MET   1           H3       MET   1 -10.524 -18.990  -1.309
    4    HA   MET   1           HA       MET   1 -12.269 -21.322  -0.782
    5    HB2  MET   1           2HB      MET   1 -10.232 -20.819  -2.952
    6    HB3  MET   1           1HB      MET   1 -10.765 -22.431  -2.505
    7    HG2  MET   1           2HG      MET   1 -13.075 -21.793  -3.077
    8    HG3  MET   1           1HG      MET   1 -12.481 -20.217  -3.595
    9    HE1  MET   1           2HE      MET   1 -13.423 -22.146  -6.926
   10    HE2  MET   1           3HE      MET   1 -13.762 -20.729  -5.935
   11    HE3  MET   1           1HE      MET   1 -14.214 -22.331  -5.356
   12    HA   PRO   2           HA       PRO   2  -9.096 -22.524   2.145
   13    HB2  PRO   2           2HB      PRO   2  -9.911 -25.251   1.279
   14    HB3  PRO   2           1HB      PRO   2  -9.818 -24.572   2.906
   15    HG2  PRO   2           2HG      PRO   2 -12.174 -24.969   1.729
   16    HG3  PRO   2           1HG      PRO   2 -11.885 -23.542   2.743
   17    HD2  PRO   2           2HD      PRO   2 -11.973 -23.765  -0.236
   18    HD3  PRO   2           1HD      PRO   2 -12.566 -22.462   0.813
   19    H    THR   3           HN       THR   3  -7.037 -22.360   1.509
   20    HA   THR   3           HA       THR   3  -6.269 -23.390  -1.102
   21    HB   THR   3           HB       THR   3  -4.380 -21.848   0.574
   22    HG1  THR   3           1HG      THR   3  -6.893 -20.964  -0.273
   23   HG21  THR   3          3HG2      THR   3  -3.862 -20.820  -1.605
   24   HG22  THR   3          1HG2      THR   3  -5.153 -21.770  -2.343
   25   HG23  THR   3          2HG2      THR   3  -3.740 -22.579  -1.665
   26    H    PHE   4           HN       PHE   4  -4.680 -24.875  -1.439
   27    HA   PHE   4           HA       PHE   4  -3.884 -26.457   0.866
   28    HB2  PHE   4           2HB      PHE   4  -3.786 -27.077  -2.063
   29    HB3  PHE   4           1HB      PHE   4  -3.422 -28.196  -0.771
   30    HD1  PHE   4           1HD      PHE   4  -5.228 -28.998   0.719
   31    HD2  PHE   4           2HD      PHE   4  -6.022 -26.602  -2.711
   32    HE1  PHE   4           1HE      PHE   4  -7.596 -29.654   0.812
   33    HE2  PHE   4           2HE      PHE   4  -8.393 -27.255  -2.621
   34    HZ   PHE   4           HZ       PHE   4  -9.182 -28.784  -0.859
   35    H    ASP   5           HN       ASP   5  -1.790 -26.734   1.433
   36    HA   ASP   5           HA       ASP   5   0.357 -26.099   1.763
   37    HB2  ASP   5           2HB      ASP   5   0.662 -27.620  -0.167
   38    HB3  ASP   5           1HB      ASP   5   0.516 -26.242  -1.252
   39    H    HIS   6           HN       HIS   6  -0.148 -24.103   2.598
   40    HA   HIS   6           HA       HIS   6   0.180 -21.871   2.864
   41    HB2  HIS   6           2HB      HIS   6   1.270 -21.845   0.040
   42    HB3  HIS   6           1HB      HIS   6   1.398 -20.540   1.211
   43    HD1  HIS   6           1HD      HIS   6   2.982 -23.703   0.146
   44    HD2  HIS   6           2HD      HIS   6   3.227 -21.068   3.361
   45    HE1  HIS   6           1HE      HIS   6   5.114 -24.291   1.346
   46    HE2  HIS   6           2HE      HIS   6   5.230 -22.713   3.311
   47    H    GLY   7           HN       GLY   7  -1.047 -20.001   2.544
   48    HA2  GLY   7           2HA      GLY   7  -3.172 -20.285   0.506
   49    HA3  GLY   7           1HA      GLY   7  -3.493 -19.713   2.137
   50    H    ASN   8           HN       ASN   8  -4.447 -17.981   0.648
   51    HA   ASN   8           HA       ASN   8  -2.387 -15.954   0.089
   52    HB2  ASN   8           2HB      ASN   8  -5.076 -16.278  -1.260
   53    HB3  ASN   8           1HB      ASN   8  -3.912 -15.008  -1.596
   54   HD21  ASN   8          1HD2      ASN   8  -2.158 -15.436  -2.884
   55   HD22  ASN   8          2HD2      ASN   8  -1.964 -16.929  -3.744
   56    H    LEU   9           HN       LEU   9  -2.984 -13.777   0.494
   57    HA   LEU   9           HA       LEU   9  -5.446 -13.222   1.932
   58    HB2  LEU   9           2HB      LEU   9  -3.879 -13.880   3.721
   59    HB3  LEU   9           1HB      LEU   9  -2.740 -12.670   3.162
   60    HG   LEU   9           HG       LEU   9  -4.448 -10.916   3.686
   61   HD11  LEU   9          1HD1      LEU   9  -5.878 -13.247   4.946
   62   HD12  LEU   9          2HD1      LEU   9  -6.449 -12.239   3.617
   63   HD13  LEU   9          3HD1      LEU   9  -6.262 -11.550   5.227
   64   HD21  LEU   9          3HD2      LEU   9  -4.076 -10.991   6.106
   65   HD22  LEU   9          1HD2      LEU   9  -2.612 -11.370   5.199
   66   HD23  LEU   9          2HD2      LEU   9  -3.534 -12.663   5.963
   67    H    SER  10           HN       SER  10  -6.200 -11.280   1.321
   68    HA   SER  10           HA       SER  10  -4.405  -9.602  -0.272
   69    HB2  SER  10           2HB      SER  10  -7.427  -9.601  -0.086
   70    HB3  SER  10           1HB      SER  10  -6.464  -8.617  -1.185
   71    HG   SER  10           HG       SER  10  -5.717 -10.515  -2.169
   72    H    LEU  11           HN       LEU  11  -3.697  -7.710   0.473
   73    HA   LEU  11           HA       LEU  11  -4.804  -6.606   2.928
   74    HB2  LEU  11           2HB      LEU  11  -2.476  -5.774   1.192
   75    HB3  LEU  11           1HB      LEU  11  -2.988  -4.877   2.609
   76    HG   LEU  11           HG       LEU  11  -2.030  -7.744   2.649
   77   HD11  LEU  11          1HD1      LEU  11  -0.231  -6.202   2.057
   78   HD12  LEU  11          2HD1      LEU  11  -0.010  -6.856   3.678
   79   HD13  LEU  11          3HD1      LEU  11  -0.612  -5.213   3.465
   80   HD21  LEU  11          3HD2      LEU  11  -3.583  -7.223   4.457
   81   HD22  LEU  11          1HD2      LEU  11  -2.622  -5.805   4.883
   82   HD23  LEU  11          2HD2      LEU  11  -1.941  -7.421   5.071
   83    H    GLY  12           HN       GLY  12  -5.228  -6.344  -0.395
   84    HA2  GLY  12           2HA      GLY  12  -6.984  -5.195  -1.416
   85    HA3  GLY  12           1HA      GLY  12  -7.107  -4.163   0.004
   86    H    GLU  13           HN       GLU  13  -7.222  -2.346  -1.354
   87    HA   GLU  13           HA       GLU  13  -4.742  -1.679  -2.771
   88    HB2  GLU  13           2HB      GLU  13  -6.123   0.201  -3.730
   89    HB3  GLU  13           1HB      GLU  13  -6.637  -1.417  -4.183
   90    HG2  GLU  13           2HG      GLU  13  -8.359  -1.276  -2.367
   91    HG3  GLU  13           1HG      GLU  13  -7.915   0.420  -2.176
   92    H    LEU  14           HN       LEU  14  -3.310  -0.674  -1.572
   93    HA   LEU  14           HA       LEU  14  -4.200   1.004   0.659
   94    HB2  LEU  14           2HB      LEU  14  -1.465  -0.087  -0.018
   95    HB3  LEU  14           1HB      LEU  14  -1.839   0.879   1.397
   96    HG   LEU  14           HG       LEU  14  -2.960  -1.866   0.806
   97   HD11  LEU  14          1HD1      LEU  14  -1.584  -2.592   2.689
   98   HD12  LEU  14          2HD1      LEU  14  -0.907  -0.968   2.825
   99   HD13  LEU  14          3HD1      LEU  14  -0.592  -1.938   1.384
  100   HD21  LEU  14          3HD2      LEU  14  -3.853  -1.747   3.082
  101   HD22  LEU  14          1HD2      LEU  14  -4.533  -0.485   2.055
  102   HD23  LEU  14          2HD2      LEU  14  -3.272  -0.088   3.223
  103    H    GLU  15           HN       GLU  15  -3.229   3.082   1.002
  104    HA   GLU  15           HA       GLU  15  -2.789   4.452  -1.534
  105    HB2  GLU  15           2HB      GLU  15  -3.383   5.556   1.220
  106    HB3  GLU  15           1HB      GLU  15  -3.215   6.520  -0.242
  107    HG2  GLU  15           2HG      GLU  15  -5.136   5.376  -1.220
  108    HG3  GLU  15           1HG      GLU  15  -5.298   4.399   0.236
  109    H    LEU  16           HN       LEU  16  -0.996   5.611  -2.009
  110    HA   LEU  16           HA       LEU  16   1.396   4.926  -0.506
  111    HB2  LEU  16           2HB      LEU  16   1.429   4.677  -2.919
  112    HB3  LEU  16           1HB      LEU  16   1.008   6.365  -3.131
  113    HG   LEU  16           HG       LEU  16   3.198   6.923  -1.967
  114   HD11  LEU  16          1HD1      LEU  16   3.756   4.024  -2.564
  115   HD12  LEU  16          2HD1      LEU  16   3.574   4.726  -0.955
  116   HD13  LEU  16          3HD1      LEU  16   4.919   5.216  -1.984
  117   HD21  LEU  16          3HD2      LEU  16   2.889   7.161  -4.367
  118   HD22  LEU  16          1HD2      LEU  16   3.295   5.462  -4.599
  119   HD23  LEU  16          2HD2      LEU  16   4.512   6.585  -3.995
  120    H    THR  17           HN       THR  17   2.602   6.285   0.683
  121    HA   THR  17           HA       THR  17   1.841   9.130   0.720
  122    HB   THR  17           HB       THR  17   3.383   7.621   2.842
  123    HG1  THR  17           1HG      THR  17   0.898   7.280   2.280
  124   HG21  THR  17          3HG2      THR  17   3.762  10.030   2.868
  125   HG22  THR  17          1HG2      THR  17   2.778   9.552   4.253
  126   HG23  THR  17          2HG2      THR  17   2.023  10.322   2.855
  127    H    VAL  18           HN       VAL  18   3.289  10.557  -0.089
  128    HA   VAL  18           HA       VAL  18   5.986   9.547  -0.693
  129    HB   VAL  18           HB       VAL  18   4.531  11.860  -1.993
  130   HG11  VAL  18          1HG1      VAL  18   6.334  11.735  -3.668
  131   HG12  VAL  18          2HG1      VAL  18   7.136  10.510  -2.685
  132   HG13  VAL  18          3HG1      VAL  18   6.934  12.147  -2.061
  133   HG21  VAL  18          3HG2      VAL  18   5.028   9.065  -3.021
  134   HG22  VAL  18          1HG2      VAL  18   4.314  10.391  -3.937
  135   HG23  VAL  18          2HG2      VAL  18   3.467   9.732  -2.539
  136    H    LEU  19           HN       LEU  19   7.702  10.440   0.239
  137    HA   LEU  19           HA       LEU  19   7.321  12.867   1.844
  138    HB2  LEU  19           2HB      LEU  19   9.620  10.902   1.815
  139    HB3  LEU  19           1HB      LEU  19   9.454  12.263   2.906
  140    HG   LEU  19           HG       LEU  19   7.627   9.864   2.811
  141   HD11  LEU  19          1HD1      LEU  19   9.723  10.666   4.821
  142   HD12  LEU  19          2HD1      LEU  19   9.842   9.334   3.673
  143   HD13  LEU  19          3HD1      LEU  19   8.632   9.287   4.952
  144   HD21  LEU  19          3HD2      LEU  19   7.698  12.207   4.706
  145   HD22  LEU  19          1HD2      LEU  19   6.665  10.786   4.858
  146   HD23  LEU  19          2HD2      LEU  19   6.456  11.888   3.497
  147    H    TYR  20           HN       TYR  20   7.913  14.721   0.995
  148    HA   TYR  20           HA       TYR  20  10.272  14.898  -0.710
  149    HB2  TYR  20           2HB      TYR  20   9.054  16.134  -2.458
  150    HB3  TYR  20           1HB      TYR  20   8.435  14.496  -2.278
  151    HD1  TYR  20           1HD      TYR  20   6.283  14.182  -0.911
  152    HD2  TYR  20           2HD      TYR  20   7.612  17.977  -2.302
  153    HE1  TYR  20           1HE      TYR  20   4.011  15.076  -0.631
  154    HE2  TYR  20           2HE      TYR  20   5.343  18.876  -2.017
  155    HH   TYR  20           HH       TYR  20   3.043  18.070  -1.938
  156    H    ASP  21           HN       ASP  21   8.750  15.909   1.882
  157    HA   ASP  21           HA       ASP  21   8.663  17.737   3.206
  158    HB2  ASP  21           2HB      ASP  21  11.193  17.658   2.387
  159    HB3  ASP  21           1HB      ASP  21  10.739  19.187   1.642
  160    H    GLU  22           HN       GLU  22   8.930  20.424   2.832
  161    HA   GLU  22           HA       GLU  22   6.946  21.037   0.743
  162    HB2  GLU  22           2HB      GLU  22   7.134  22.241   3.513
  163    HB3  GLU  22           1HB      GLU  22   5.932  22.632   2.293
  164    HG2  GLU  22           2HG      GLU  22   5.108  20.323   2.393
  165    HG3  GLU  22           1HG      GLU  22   6.284  19.976   3.652
  166    H    GLU  23           HN       GLU  23   9.892  21.208   0.806
  167    HA   GLU  23           HA       GLU  23  10.725  23.862   1.303
  168    HB2  GLU  23           2HB      GLU  23  12.046  21.842  -0.509
  169    HB3  GLU  23           1HB      GLU  23  12.800  23.231   0.254
  170    HG2  GLU  23           2HG      GLU  23  12.400  22.226   2.455
  171    HG3  GLU  23           1HG      GLU  23  11.693  20.818   1.664
  172    H    ARG  24           HN       ARG  24  10.775  22.268  -1.894
  173    HA   ARG  24           HA       ARG  24   9.611  24.669  -3.069
  174    HB2  ARG  24           2HB      ARG  24  12.435  23.931  -3.242
  175    HB3  ARG  24           1HB      ARG  24  11.685  24.214  -4.805
  176    HG2  ARG  24           2HG      ARG  24  11.627  26.139  -2.489
  177    HG3  ARG  24           1HG      ARG  24  12.723  26.233  -3.870
  178    HD2  ARG  24           2HD      ARG  24  10.963  26.654  -5.370
  179    HD3  ARG  24           1HD      ARG  24   9.742  26.156  -4.203
  180    HE   ARG  24           HE       ARG  24  11.104  28.349  -3.139
  181   HH11  ARG  24          1HH1      ARG  24   9.011  27.605  -5.827
  182   HH12  ARG  24          2HH1      ARG  24   8.249  29.164  -5.854
  183   HH21  ARG  24          1HH2      ARG  24  10.111  30.408  -3.146
  184   HH22  ARG  24          2HH2      ARG  24   8.895  30.776  -4.332
  185    H    TYR  25           HN       TYR  25   9.287  21.542  -2.846
  186    HA   TYR  25           HA       TYR  25   8.507  21.261  -5.665
  187    HB2  TYR  25           2HB      TYR  25   9.826  19.179  -3.911
  188    HB3  TYR  25           1HB      TYR  25   9.028  18.800  -5.433
  189    HD1  TYR  25           2HD      TYR  25   9.990  19.545  -7.558
  190    HD2  TYR  25           1HD      TYR  25  11.978  20.253  -3.864
  191    HE1  TYR  25           2HE      TYR  25  12.069  20.038  -8.776
  192    HE2  TYR  25           1HE      TYR  25  14.061  20.750  -5.070
  193    HH   TYR  25           HH       TYR  25  14.173  21.309  -8.400
  194    H    ASP  26           HN       ASP  26   6.635  20.065  -6.057
  195    HA   ASP  26           HA       ASP  26   5.211  18.947  -3.777
  196    HB2  ASP  26           2HB      ASP  26   4.416  21.331  -4.150
  197    HB3  ASP  26           1HB      ASP  26   3.793  20.793  -5.706
  198    H    ILE  27           HN       ILE  27   3.297  17.645  -4.560
  199    HA   ILE  27           HA       ILE  27   4.360  15.913  -6.622
  200    HB   ILE  27           HB       ILE  27   1.852  15.603  -4.968
  201   HG12  ILE  27          2HG1      ILE  27   4.590  14.353  -4.644
  202   HG13  ILE  27          1HG1      ILE  27   3.919  15.622  -3.624
  203   HG21  ILE  27          1HG2      ILE  27   3.313  13.613  -6.701
  204   HG22  ILE  27          2HG2      ILE  27   1.746  14.344  -7.051
  205   HG23  ILE  27          3HG2      ILE  27   1.926  13.261  -5.671
  206   HD11  ILE  27          3HD1      ILE  27   2.825  12.832  -3.919
  207   HD12  ILE  27          1HD1      ILE  27   2.158  14.102  -2.892
  208   HD13  ILE  27          2HD1      ILE  27   3.763  13.447  -2.556
  209    H    VAL  28           HN       VAL  28   3.919  16.172  -8.677
  210    HA   VAL  28           HA       VAL  28   1.475  17.504  -9.542
  211    HB   VAL  28           HB       VAL  28   3.763  16.372 -11.172
  212   HG11  VAL  28          1HG1      VAL  28   2.834  17.709 -13.015
  213   HG12  VAL  28          2HG1      VAL  28   1.446  18.114 -12.006
  214   HG13  VAL  28          3HG1      VAL  28   1.728  16.440 -12.488
  215   HG21  VAL  28          3HG2      VAL  28   4.455  18.231  -9.768
  216   HG22  VAL  28          1HG2      VAL  28   3.127  19.214 -10.390
  217   HG23  VAL  28          2HG2      VAL  28   4.428  18.705 -11.468
  218    H    GLU  29           HN       GLU  29   3.054  14.348  -9.821
  219    HA   GLU  29           HA       GLU  29   0.458  13.081 -10.001
  220    HB2  GLU  29           2HB      GLU  29   0.983  11.770 -11.975
  221    HB3  GLU  29           1HB      GLU  29   1.061  13.483 -12.364
  222    HG2  GLU  29           2HG      GLU  29   3.521  13.375 -12.128
  223    HG3  GLU  29           1HG      GLU  29   3.386  11.636 -11.881
  224    H    GLN  30           HN       GLN  30   0.615  10.735  -9.664
  225    HA   GLN  30           HA       GLN  30   3.071   9.646  -8.621
  226    HB2  GLN  30           2HB      GLN  30   2.361   9.466  -6.304
  227    HB3  GLN  30           1HB      GLN  30   2.322  11.158  -6.781
  228    HG2  GLN  30           2HG      GLN  30  -0.132  10.888  -7.210
  229    HG3  GLN  30           1HG      GLN  30  -0.013   9.287  -6.485
  230   HE21  GLN  30          1HE2      GLN  30  -0.062  12.676  -5.946
  231   HE22  GLN  30          2HE2      GLN  30  -0.149  12.624  -4.221
  232    H    THR  31           HN       THR  31   2.319   7.527  -7.244
  233    HA   THR  31           HA       THR  31   0.030   6.356  -8.664
  234    HB   THR  31           HB       THR  31   2.020   5.073  -9.120
  235    HG1  THR  31           1HG      THR  31   0.322   3.777  -7.240
  236   HG21  THR  31          3HG2      THR  31   3.334   3.975  -7.378
  237   HG22  THR  31          1HG2      THR  31   2.362   4.771  -6.140
  238   HG23  THR  31          2HG2      THR  31   3.388   5.731  -7.207
  239    H    GLU  32           HN       GLU  32  -1.608   7.003  -7.401
  240    HA   GLU  32           HA       GLU  32  -1.339   7.604  -4.673
  241    HB2  GLU  32           2HB      GLU  32  -3.905   7.085  -6.167
  242    HB3  GLU  32           1HB      GLU  32  -3.711   8.028  -4.694
  243    HG2  GLU  32           2HG      GLU  32  -2.287   9.610  -5.948
  244    HG3  GLU  32           1HG      GLU  32  -2.633   8.699  -7.418
  245    H    THR  33           HN       THR  33  -2.609   4.732  -6.281
  246    HA   THR  33           HA       THR  33  -2.792   3.478  -3.627
  247    HB   THR  33           HB       THR  33  -4.737   2.124  -4.639
  248    HG1  THR  33           1HG      THR  33  -5.902   3.283  -6.255
  249   HG21  THR  33          3HG2      THR  33  -5.120   5.052  -3.999
  250   HG22  THR  33          1HG2      THR  33  -5.013   3.742  -2.825
  251   HG23  THR  33          2HG2      THR  33  -6.372   3.812  -3.944
  252    H    VAL  34           HN       VAL  34  -2.234   1.357  -3.464
  253    HA   VAL  34           HA       VAL  34  -1.329  -0.016  -5.901
  254    HB   VAL  34           HB       VAL  34   0.574  -0.967  -4.553
  255   HG11  VAL  34          1HG1      VAL  34   1.016   0.649  -6.237
  256   HG12  VAL  34          2HG1      VAL  34   1.983   1.071  -4.820
  257   HG13  VAL  34          3HG1      VAL  34   0.508   1.971  -5.184
  258   HG21  VAL  34          3HG2      VAL  34  -0.210  -0.414  -2.319
  259   HG22  VAL  34          1HG2      VAL  34  -0.124   1.307  -2.691
  260   HG23  VAL  34          2HG2      VAL  34   1.354   0.344  -2.619
  261    H    GLN  35           HN       GLN  35  -1.521  -2.244  -5.881
  262    HA   GLN  35           HA       GLN  35  -3.248  -3.307  -3.782
  263    HB2  GLN  35           2HB      GLN  35  -2.490  -4.394  -6.496
  264    HB3  GLN  35           1HB      GLN  35  -3.522  -5.239  -5.348
  265    HG2  GLN  35           2HG      GLN  35  -5.162  -3.481  -5.463
  266    HG3  GLN  35           1HG      GLN  35  -4.104  -2.524  -6.493
  267   HE21  GLN  35          1HE2      GLN  35  -3.235  -4.897  -7.987
  268   HE22  GLN  35          2HE2      GLN  35  -4.544  -5.296  -9.040
  269    H    VAL  36           HN       VAL  36  -2.586  -4.670  -2.320
  270    HA   VAL  36           HA       VAL  36   0.066  -5.932  -2.615
  271    HB   VAL  36           HB       VAL  36  -1.058  -4.987   0.025
  272   HG11  VAL  36          1HG1      VAL  36   1.220  -5.285   0.816
  273   HG12  VAL  36          2HG1      VAL  36   1.737  -5.766  -0.799
  274   HG13  VAL  36          3HG1      VAL  36   0.611  -6.779   0.102
  275   HG21  VAL  36          3HG2      VAL  36  -0.719  -3.024  -1.401
  276   HG22  VAL  36          1HG2      VAL  36   0.935  -3.541  -1.722
  277   HG23  VAL  36          2HG2      VAL  36   0.456  -3.073  -0.089
  278    H    ASP  37           HN       ASP  37  -0.069  -8.055  -2.570
  279    HA   ASP  37           HA       ASP  37  -2.156  -9.321  -0.922
  280    HB2  ASP  37           2HB      ASP  37  -1.231 -10.126  -3.690
  281    HB3  ASP  37           1HB      ASP  37  -2.200 -11.166  -2.650
  282    H    LEU  38           HN       LEU  38  -1.529 -11.119   0.232
  283    HA   LEU  38           HA       LEU  38   1.374 -11.632   0.230
  284    HB2  LEU  38           2HB      LEU  38  -0.547 -11.752   2.555
  285    HB3  LEU  38           1HB      LEU  38   1.169 -12.104   2.627
  286    HG   LEU  38           HG       LEU  38  -0.021  -9.405   1.971
  287   HD11  LEU  38          1HD1      LEU  38   1.309 -10.434   4.474
  288   HD12  LEU  38          2HD1      LEU  38  -0.390  -9.996   4.294
  289   HD13  LEU  38          3HD1      LEU  38   0.857  -8.756   4.173
  290   HD21  LEU  38          3HD2      LEU  38   2.280  -8.598   2.195
  291   HD22  LEU  38          1HD2      LEU  38   2.136  -9.769   0.884
  292   HD23  LEU  38          2HD2      LEU  38   2.839 -10.254   2.428
  293    H    GLU  39           HN       GLU  39   2.093 -13.725   0.375
  294    HA   GLU  39           HA       GLU  39   0.035 -15.827   0.520
  295    HB2  GLU  39           2HB      GLU  39   2.479 -15.657  -1.210
  296    HB3  GLU  39           1HB      GLU  39   1.811 -17.221  -0.758
  297    HG2  GLU  39           2HG      GLU  39  -0.354 -16.500  -1.720
  298    HG3  GLU  39           1HG      GLU  39   0.440 -15.032  -2.277
  299    H    GLY  40           HN       GLY  40   0.665 -17.779   1.514
  300    HA2  GLY  40           2HA      GLY  40   2.826 -18.775   2.595
  301    HA3  GLY  40           1HA      GLY  40   2.672 -17.357   3.622
  302    HA   PRO  41           HA       PRO  41   0.451 -20.876   5.682
  303    HB2  PRO  41           2HB      PRO  41   1.474 -19.493   8.078
  304    HB3  PRO  41           1HB      PRO  41   1.602 -21.193   7.620
  305    HG2  PRO  41           2HG      PRO  41   3.722 -19.558   7.541
  306    HG3  PRO  41           1HG      PRO  41   3.493 -20.850   6.347
  307    HD2  PRO  41           2HD      PRO  41   2.991 -17.912   6.082
  308    HD3  PRO  41           1HD      PRO  41   3.698 -19.044   4.912
  309    H    ARG  42           HN       ARG  42  -1.657 -20.582   5.902
  310    HA   ARG  42           HA       ARG  42  -2.875 -18.067   6.169
  311    HB2  ARG  42           2HB      ARG  42  -3.938 -20.861   6.451
  312    HB3  ARG  42           1HB      ARG  42  -4.967 -19.463   6.730
  313    HG2  ARG  42           2HG      ARG  42  -4.316 -18.668   4.428
  314    HG3  ARG  42           1HG      ARG  42  -3.572 -20.249   4.186
  315    HD2  ARG  42           2HD      ARG  42  -6.467 -19.788   4.899
  316    HD3  ARG  42           1HD      ARG  42  -5.866 -20.103   3.274
  317    HE   ARG  42           HE       ARG  42  -4.923 -22.212   4.673
  318   HH11  ARG  42          1HH1      ARG  42  -8.127 -20.797   4.424
  319   HH12  ARG  42          2HH1      ARG  42  -8.945 -22.319   4.649
  320   HH21  ARG  42          1HH2      ARG  42  -5.988 -24.186   4.968
  321   HH22  ARG  42          2HH2      ARG  42  -7.730 -24.258   4.947
  322    H    GLY  43           HN       GLY  43  -1.863 -20.394   8.576
  323    HA2  GLY  43           2HA      GLY  43  -3.241 -19.462  10.802
  324    HA3  GLY  43           1HA      GLY  43  -1.611 -20.118  10.847
  325    H    VAL  44           HN       VAL  44  -0.140 -18.273   9.513
  326    HA   VAL  44           HA       VAL  44   0.138 -16.160  11.386
  327    HB   VAL  44           HB       VAL  44   1.318 -16.374   8.603
  328   HG11  VAL  44          1HG1      VAL  44   3.014 -14.804   9.421
  329   HG12  VAL  44          2HG1      VAL  44   2.143 -14.668  10.950
  330   HG13  VAL  44          3HG1      VAL  44   1.398 -14.097   9.457
  331   HG21  VAL  44          3HG2      VAL  44   3.340 -17.196   9.751
  332   HG22  VAL  44          1HG2      VAL  44   1.962 -18.280   9.946
  333   HG23  VAL  44          2HG2      VAL  44   2.443 -17.220  11.270
  334    H    LEU  45           HN       LEU  45  -1.197 -16.382   8.132
  335    HA   LEU  45           HA       LEU  45  -1.722 -13.697   7.639
  336    HB2  LEU  45           2HB      LEU  45  -3.339 -16.097   6.770
  337    HB3  LEU  45           1HB      LEU  45  -3.436 -14.499   6.056
  338    HG   LEU  45           HG       LEU  45  -0.997 -16.282   6.008
  339   HD11  LEU  45          1HD1      LEU  45  -2.972 -15.593   3.834
  340   HD12  LEU  45          2HD1      LEU  45  -2.785 -17.164   4.612
  341   HD13  LEU  45          3HD1      LEU  45  -1.483 -16.513   3.619
  342   HD21  LEU  45          3HD2      LEU  45  -0.446 -13.901   5.999
  343   HD22  LEU  45          1HD2      LEU  45  -1.547 -13.651   4.642
  344   HD23  LEU  45          2HD2      LEU  45  -0.104 -14.647   4.437
  345    H    THR  46           HN       THR  46  -3.678 -16.102   9.354
  346    HA   THR  46           HA       THR  46  -5.976 -14.446   9.630
  347    HB   THR  46           HB       THR  46  -5.223 -16.778  11.404
  348    HG1  THR  46           1HG      THR  46  -5.166 -17.321   9.125
  349   HG21  THR  46          3HG2      THR  46  -7.893 -15.624  10.597
  350   HG22  THR  46          1HG2      THR  46  -7.114 -15.419  12.167
  351   HG23  THR  46          2HG2      THR  46  -7.644 -17.020  11.648
  352    H    VAL  47           HN       VAL  47  -3.259 -15.218  11.818
  353    HA   VAL  47           HA       VAL  47  -4.226 -13.815  14.055
  354    HB   VAL  47           HB       VAL  47  -1.350 -14.328  13.261
  355   HG11  VAL  47          1HG1      VAL  47  -0.825 -14.009  15.621
  356   HG12  VAL  47          2HG1      VAL  47  -2.511 -13.626  15.956
  357   HG13  VAL  47          3HG1      VAL  47  -1.548 -12.549  14.943
  358   HG21  VAL  47          3HG2      VAL  47  -2.633 -16.389  13.453
  359   HG22  VAL  47          1HG2      VAL  47  -3.227 -15.890  15.037
  360   HG23  VAL  47          2HG2      VAL  47  -1.514 -16.237  14.808
  361    H    PHE  48           HN       PHE  48  -2.156 -12.779  11.381
  362    HA   PHE  48           HA       PHE  48  -1.757 -10.130  12.289
  363    HB2  PHE  48           2HB      PHE  48  -0.365 -11.254  10.562
  364    HB3  PHE  48           1HB      PHE  48  -1.728 -11.194   9.453
  365    HD1  PHE  48           2HD      PHE  48   0.617  -9.087  11.389
  366    HD2  PHE  48           1HD      PHE  48  -2.118  -9.304   8.137
  367    HE1  PHE  48           2HE      PHE  48   1.362  -6.871  10.623
  368    HE2  PHE  48           1HE      PHE  48  -1.377  -7.089   7.359
  369    HZ   PHE  48           HZ       PHE  48   0.364  -5.870   8.607
  370    H    ARG  49           HN       ARG  49  -4.237 -11.690  10.372
  371    HA   ARG  49           HA       ARG  49  -5.532  -9.418   9.381
  372    HB2  ARG  49           2HB      ARG  49  -5.705 -11.905   8.725
  373    HB3  ARG  49           1HB      ARG  49  -6.892 -12.016  10.018
  374    HG2  ARG  49           2HG      ARG  49  -7.630  -9.796   8.549
  375    HG3  ARG  49           1HG      ARG  49  -7.162 -11.001   7.354
  376    HD2  ARG  49           2HD      ARG  49  -9.496 -11.276   7.797
  377    HD3  ARG  49           1HD      ARG  49  -8.638 -12.629   8.535
  378    HE   ARG  49           HE       ARG  49  -9.056 -10.441  10.345
  379   HH11  ARG  49          1HH1      ARG  49 -10.516 -13.295   8.955
  380   HH12  ARG  49          2HH1      ARG  49 -11.663 -13.502  10.240
  381   HH21  ARG  49          1HH2      ARG  49 -10.519 -10.714  12.066
  382   HH22  ARG  49          2HH2      ARG  49 -11.655 -12.038  12.037
  383    H    PHE  50           HN       PHE  50  -5.614 -10.936  12.511
  384    HA   PHE  50           HA       PHE  50  -8.155  -9.973  13.332
  385    HB2  PHE  50           2HB      PHE  50  -5.765 -11.083  14.766
  386    HB3  PHE  50           1HB      PHE  50  -7.092 -10.376  15.671
  387    HD1  PHE  50           1HD      PHE  50  -9.493 -11.259  14.714
  388    HD2  PHE  50           2HD      PHE  50  -5.796 -13.360  14.627
  389    HE1  PHE  50           1HE      PHE  50 -10.713 -13.391  14.608
  390    HE2  PHE  50           2HE      PHE  50  -7.010 -15.499  14.514
  391    HZ   PHE  50           HZ       PHE  50  -9.473 -15.514  14.505
  392    H    ALA  51           HN       ALA  51  -4.945  -8.614  13.297
  393    HA   ALA  51           HA       ALA  51  -5.618  -6.492  15.138
  394    HB1  ALA  51           1HB      ALA  51  -3.362  -7.439  15.152
  395    HB2  ALA  51           2HB      ALA  51  -3.335  -5.720  14.761
  396    HB3  ALA  51           3HB      ALA  51  -3.129  -6.919  13.483
  397    H    ARG  52           HN       ARG  52  -5.884  -4.339  14.603
  398    HA   ARG  52           HA       ARG  52  -6.909  -3.712  12.047
  399    HB2  ARG  52           2HB      ARG  52  -6.022  -1.958  14.332
  400    HB3  ARG  52           1HB      ARG  52  -6.860  -1.381  12.914
  401    HG2  ARG  52           2HG      ARG  52  -8.758  -2.881  13.488
  402    HG3  ARG  52           1HG      ARG  52  -7.913  -3.282  14.983
  403    HD2  ARG  52           2HD      ARG  52  -9.508  -1.581  15.490
  404    HD3  ARG  52           1HD      ARG  52  -7.907  -0.845  15.541
  405    HE   ARG  52           HE       ARG  52  -9.160  -0.577  12.982
  406   HH11  ARG  52          1HH1      ARG  52  -8.938   0.801  16.198
  407   HH12  ARG  52          2HH1      ARG  52  -9.508   2.368  15.698
  408   HH21  ARG  52          1HH2      ARG  52  -9.911   1.468  12.326
  409   HH22  ARG  52          2HH2      ARG  52 -10.101   2.741  13.499
  410    HA   PRO  53           HA       PRO  53  -3.510  -2.839   9.473
  411    HB2  PRO  53           2HB      PRO  53  -4.023  -0.088   8.967
  412    HB3  PRO  53           1HB      PRO  53  -4.427  -1.473   7.953
  413    HG2  PRO  53           2HG      PRO  53  -6.123   0.048   9.837
  414    HG3  PRO  53           1HG      PRO  53  -6.588  -0.888   8.408
  415    HD2  PRO  53           2HD      PRO  53  -7.075  -1.754  10.913
  416    HD3  PRO  53           1HD      PRO  53  -6.690  -2.872   9.585
  417    H    SER  54           HN       SER  54  -1.546  -2.699  10.228
  418    HA   SER  54           HA       SER  54  -0.702  -0.332  11.715
  419    HB2  SER  54           2HB      SER  54   0.124  -3.214  11.954
  420    HB3  SER  54           1HB      SER  54   0.957  -1.893  12.732
  421    HG   SER  54           HG       SER  54  -1.794  -2.441  13.098
  422    H    TYR  55           HN       TYR  55  -0.738  -1.361   8.809
  423    HA   TYR  55           HA       TYR  55   2.126  -1.295   8.228
  424    HB2  TYR  55           2HB      TYR  55   1.141  -2.062   5.886
  425    HB3  TYR  55           1HB      TYR  55   1.433  -3.209   7.187
  426    HD1  TYR  55           1HD      TYR  55  -1.207  -1.264   5.460
  427    HD2  TYR  55           2HD      TYR  55  -0.336  -4.396   8.202
  428    HE1  TYR  55           1HE      TYR  55  -3.569  -1.957   5.414
  429    HE2  TYR  55           2HE      TYR  55  -2.688  -5.101   8.164
  430    HH   TYR  55           HH       TYR  55  -4.959  -3.849   5.878
  431    H    GLU  56           HN       GLU  56   2.920  -0.027   6.525
  432    HA   GLU  56           HA       GLU  56   1.194   2.115   5.543
  433    HB2  GLU  56           2HB      GLU  56   2.205   2.869   7.700
  434    HB3  GLU  56           1HB      GLU  56   3.797   2.634   6.994
  435    HG2  GLU  56           2HG      GLU  56   3.331   4.341   5.327
  436    HG3  GLU  56           1HG      GLU  56   1.715   4.562   5.998
  437    H    VAL  57           HN       VAL  57   1.883   2.972   3.587
  438    HA   VAL  57           HA       VAL  57   4.340   1.804   2.444
  439    HB   VAL  57           HB       VAL  57   1.819   2.515   0.917
  440   HG11  VAL  57          1HG1      VAL  57   4.355   1.135   0.044
  441   HG12  VAL  57          2HG1      VAL  57   3.850   2.768  -0.402
  442   HG13  VAL  57          3HG1      VAL  57   2.919   1.373  -0.954
  443   HG21  VAL  57          3HG2      VAL  57   1.431   0.558   2.304
  444   HG22  VAL  57          1HG2      VAL  57   2.910  -0.186   1.700
  445   HG23  VAL  57          2HG2      VAL  57   1.554   0.086   0.609
  446    H    PHE  58           HN       PHE  58   5.819   3.301   1.863
  447    HA   PHE  58           HA       PHE  58   4.979   5.942   1.038
  448    HB2  PHE  58           2HB      PHE  58   6.203   7.143   2.752
  449    HB3  PHE  58           1HB      PHE  58   5.025   6.086   3.516
  450    HD1  PHE  58           2HD      PHE  58   5.814   3.944   4.569
  451    HD2  PHE  58           1HD      PHE  58   8.501   6.958   3.218
  452    HE1  PHE  58           2HE      PHE  58   7.597   2.973   5.955
  453    HE2  PHE  58           1HE      PHE  58  10.290   5.990   4.605
  454    HZ   PHE  58           HZ       PHE  58   9.838   3.995   5.975
  455    H    VAL  59           HN       VAL  59   6.663   7.190   0.113
  456    HA   VAL  59           HA       VAL  59   9.195   5.746  -0.315
  457    HB   VAL  59           HB       VAL  59   7.858   7.460  -2.406
  458   HG11  VAL  59          1HG1      VAL  59  10.261   7.416  -2.602
  459   HG12  VAL  59          2HG1      VAL  59   9.532   6.491  -3.914
  460   HG13  VAL  59          3HG1      VAL  59  10.259   5.653  -2.542
  461   HG21  VAL  59          3HG2      VAL  59   7.974   4.455  -2.250
  462   HG22  VAL  59          1HG2      VAL  59   7.399   5.387  -3.634
  463   HG23  VAL  59          2HG2      VAL  59   6.528   5.454  -2.102
  464    H    ASP  60           HN       ASP  60  10.993   6.948  -0.083
  465    HA   ASP  60           HA       ASP  60  10.625   9.763   0.663
  466    HB2  ASP  60           2HB      ASP  60  11.527   8.610   2.523
  467    HB3  ASP  60           1HB      ASP  60  12.671   7.726   1.519
  468    H    LEU  61           HN       LEU  61  11.213  11.161  -0.792
  469    HA   LEU  61           HA       LEU  61  13.660  10.733  -2.341
  470    HB2  LEU  61           2HB      LEU  61  10.959  11.444  -3.492
  471    HB3  LEU  61           1HB      LEU  61  12.468  11.589  -4.373
  472    HG   LEU  61           HG       LEU  61  11.459   8.975  -3.245
  473   HD11  LEU  61          1HD1      LEU  61   9.862   9.737  -4.876
  474   HD12  LEU  61          2HD1      LEU  61  10.838   8.442  -5.571
  475   HD13  LEU  61          3HD1      LEU  61  11.154  10.121  -6.011
  476   HD21  LEU  61          3HD2      LEU  61  13.584   9.631  -5.282
  477   HD22  LEU  61          1HD2      LEU  61  13.084   8.012  -4.798
  478   HD23  LEU  61          2HD2      LEU  61  13.866   9.081  -3.632
  479    H    THR  62           HN       THR  62  13.175  12.273  -0.074
  480    HA   THR  62           HA       THR  62  12.361  14.906  -0.503
  481    HB   THR  62           HB       THR  62  13.901  15.281   1.591
  482    HG1  THR  62           1HG      THR  62  13.559  12.520   1.985
  483   HG21  THR  62          3HG2      THR  62  12.141  14.360   3.023
  484   HG22  THR  62          1HG2      THR  62  11.504  13.438   1.659
  485   HG23  THR  62          2HG2      THR  62  11.450  15.200   1.636
  486    H    GLU  63           HN       GLU  63  15.430  13.383  -1.167
  487    HA   GLU  63           HA       GLU  63  16.722  15.987  -1.491
  488    HB2  GLU  63           2HB      GLU  63  17.844  13.194  -1.511
  489    HB3  GLU  63           1HB      GLU  63  18.791  14.626  -1.824
  490    HG2  GLU  63           2HG      GLU  63  18.134  15.442   0.408
  491    HG3  GLU  63           1HG      GLU  63  17.391  13.881   0.694
  492    H    ALA  64           HN       ALA  64  14.791  14.263  -3.377
  493    HA   ALA  64           HA       ALA  64  16.482  14.097  -5.730
  494    HB1  ALA  64           1HB      ALA  64  13.528  13.555  -5.475
  495    HB2  ALA  64           2HB      ALA  64  14.802  12.355  -5.267
  496    HB3  ALA  64           3HB      ALA  64  14.563  13.126  -6.835
  497    H    GLY  65           HN       GLY  65  16.928  15.871  -6.806
  498    HA2  GLY  65           2HA      GLY  65  14.747  17.805  -7.291
  499    HA3  GLY  65           1HA      GLY  65  16.430  18.282  -7.102
  500    H    GLU  66           HN       GLU  66  14.071  16.901  -9.171
  501    HA   GLU  66           HA       GLU  66  15.626  17.301 -11.541
  502    HB2  GLU  66           2HB      GLU  66  16.020  14.877 -10.205
  503    HB3  GLU  66           1HB      GLU  66  14.861  14.484 -11.463
  504    HG2  GLU  66           2HG      GLU  66  17.503  15.842 -11.953
  505    HG3  GLU  66           1HG      GLU  66  17.226  14.107 -12.097
  506    H    GLY  67           HN       GLY  67  14.239  15.736 -13.308
  507    HA2  GLY  67           2HA      GLY  67  11.555  16.800 -13.185
  508    HA3  GLY  67           1HA      GLY  67  12.230  15.801 -14.466
  509    H    SER  68           HN       SER  68  10.612  14.268 -14.609
  510    HA   SER  68           HA       SER  68   9.482  13.056 -12.292
  511    HB2  SER  68           2HB      SER  68   8.336  13.140 -14.496
  512    HB3  SER  68           1HB      SER  68   9.497  11.970 -15.114
  513    HG   SER  68           HG       SER  68   7.263  11.562 -13.674
  514    H    HIS  69           HN       HIS  69  10.018  11.263 -11.268
  515    HA   HIS  69           HA       HIS  69  12.443   9.862 -12.104
  516    HB2  HIS  69           2HB      HIS  69  13.151   9.952  -9.615
  517    HB3  HIS  69           1HB      HIS  69  13.447  11.356 -10.631
  518    HD1  HIS  69           1HD      HIS  69  11.917  13.463 -10.211
  519    HD2  HIS  69           2HD      HIS  69  11.417  10.350  -7.496
  520    HE1  HIS  69           1HE      HIS  69  10.716  14.467  -8.246
  521    HE2  HIS  69           2HE      HIS  69  10.259  12.525  -6.710
  522    H    THR  70           HN       THR  70  12.538   7.750 -11.612
  523    HA   THR  70           HA       THR  70  10.123   6.616 -10.351
  524    HB   THR  70           HB       THR  70  11.774   5.220 -12.448
  525    HG1  THR  70           1HG      THR  70  11.119   7.009 -13.550
  526   HG21  THR  70          3HG2      THR  70   9.764   3.943 -12.828
  527   HG22  THR  70          1HG2      THR  70   8.849   4.980 -11.730
  528   HG23  THR  70          2HG2      THR  70  10.116   3.932 -11.101
  529    H    VAL  71           HN       VAL  71  10.443   5.276  -8.651
  530    HA   VAL  71           HA       VAL  71  13.081   4.025  -8.296
  531    HB   VAL  71           HB       VAL  71  13.037   4.557  -5.871
  532   HG11  VAL  71          1HG1      VAL  71  14.400   5.904  -7.382
  533   HG12  VAL  71          2HG1      VAL  71  13.755   6.884  -6.066
  534   HG13  VAL  71          3HG1      VAL  71  13.031   6.979  -7.672
  535   HG21  VAL  71          3HG2      VAL  71  10.768   6.401  -6.615
  536   HG22  VAL  71          1HG2      VAL  71  11.570   6.329  -5.044
  537   HG23  VAL  71          2HG2      VAL  71  10.640   4.946  -5.625
  538    H    ASP  72           HN       ASP  72  13.064   2.360  -6.571
  539    HA   ASP  72           HA       ASP  72  10.810   0.614  -6.771
  540    HB2  ASP  72           2HB      ASP  72  13.168  -0.167  -6.549
  541    HB3  ASP  72           1HB      ASP  72  13.196   0.463  -4.907
  542    H    VAL  73           HN       VAL  73   9.248   0.148  -5.246
  543    HA   VAL  73           HA       VAL  73   8.818   2.281  -3.309
  544    HB   VAL  73           HB       VAL  73   6.964   0.063  -4.195
  545   HG11  VAL  73          1HG1      VAL  73   5.207   1.339  -3.070
  546   HG12  VAL  73          2HG1      VAL  73   6.412   2.489  -2.493
  547   HG13  VAL  73          3HG1      VAL  73   6.450   0.818  -1.934
  548   HG21  VAL  73          3HG2      VAL  73   7.435   1.634  -5.978
  549   HG22  VAL  73          1HG2      VAL  73   7.046   2.989  -4.917
  550   HG23  VAL  73          2HG2      VAL  73   5.788   1.849  -5.392
  551    H    GLU  74           HN       GLU  74   9.480   2.050  -1.324
  552    HA   GLU  74           HA       GLU  74   9.839  -0.592  -0.168
  553    HB2  GLU  74           2HB      GLU  74  10.586   2.159   0.847
  554    HB3  GLU  74           1HB      GLU  74  10.939   0.652   1.687
  555    HG2  GLU  74           2HG      GLU  74  12.334  -0.085  -0.143
  556    HG3  GLU  74           1HG      GLU  74  11.911   1.347  -1.075
  557    H    HIS  75           HN       HIS  75   8.949  -1.116   1.939
  558    HA   HIS  75           HA       HIS  75   6.445   0.300   2.519
  559    HB2  HIS  75           2HB      HIS  75   5.356  -1.982   2.792
  560    HB3  HIS  75           1HB      HIS  75   5.682  -1.464   1.143
  561    HD1  HIS  75           1HD      HIS  75   7.054  -3.006  -0.281
  562    HD2  HIS  75           2HD      HIS  75   7.245  -3.988   3.754
  563    HE1  HIS  75           1HE      HIS  75   8.287  -5.184  -0.177
  564    HE2  HIS  75           2HE      HIS  75   8.634  -5.600   2.274
  565    H    ARG  76           HN       ARG  76   5.616   0.027   4.623
  566    HA   ARG  76           HA       ARG  76   7.530  -1.103   6.564
  567    HB2  ARG  76           2HB      ARG  76   6.845   1.612   6.189
  568    HB3  ARG  76           1HB      ARG  76   6.028   1.103   7.658
  569    HG2  ARG  76           2HG      ARG  76   8.966   0.681   7.167
  570    HG3  ARG  76           1HG      ARG  76   8.304   2.109   7.966
  571    HD2  ARG  76           2HD      ARG  76   7.347   0.715   9.709
  572    HD3  ARG  76           1HD      ARG  76   7.916  -0.738   8.887
  573    HE   ARG  76           HE       ARG  76  10.173   0.736   9.284
  574   HH11  ARG  76          1HH1      ARG  76   7.635  -0.432  11.402
  575   HH12  ARG  76          2HH1      ARG  76   8.695  -0.651  12.762
  576   HH21  ARG  76          1HH2      ARG  76  11.560   0.497  11.076
  577   HH22  ARG  76          2HH2      ARG  76  10.920  -0.104  12.581
  578    H    GLY  77           HN       GLY  77   6.548  -1.717   8.626
  579    HA2  GLY  77           2HA      GLY  77   4.515  -1.909   9.959
  580    HA3  GLY  77           1HA      GLY  77   3.638  -2.122   8.453
  581    H    PHE  78           HN       PHE  78   3.812  -4.089   7.318
  582    HA   PHE  78           HA       PHE  78   4.194  -6.365   9.029
  583    HB2  PHE  78           2HB      PHE  78   3.498  -7.672   7.022
  584    HB3  PHE  78           1HB      PHE  78   2.355  -6.408   7.453
  585    HD1  PHE  78           2HD      PHE  78   2.173  -4.381   6.062
  586    HD2  PHE  78           1HD      PHE  78   4.663  -7.647   4.947
  587    HE1  PHE  78           2HE      PHE  78   2.280  -3.508   3.765
  588    HE2  PHE  78           1HE      PHE  78   4.772  -6.780   2.647
  589    HZ   PHE  78           HZ       PHE  78   3.582  -4.709   2.055
  590    HA   PRO  79           HA       PRO  79   8.361  -7.157   7.739
  591    HB2  PRO  79           2HB      PRO  79   8.710  -9.553   8.875
  592    HB3  PRO  79           1HB      PRO  79   8.496  -8.099   9.857
  593    HG2  PRO  79           2HG      PRO  79   6.534 -10.250   9.196
  594    HG3  PRO  79           1HG      PRO  79   6.770  -9.373  10.717
  595    HD2  PRO  79           2HD      PRO  79   4.811  -8.811   8.826
  596    HD3  PRO  79           1HD      PRO  79   5.375  -7.689  10.079
  597    H    GLY  80           HN       GLY  80   9.650  -8.700   6.496
  598    HA2  GLY  80           2HA      GLY  80   8.121  -9.776   4.284
  599    HA3  GLY  80           1HA      GLY  80   9.872  -9.701   4.407
  600    H    ASP  81           HN       ASP  81   7.569 -11.157   6.645
  601    HA   ASP  81           HA       ASP  81   9.044 -13.634   6.690
  602    HB2  ASP  81           2HB      ASP  81   7.857 -12.595   8.689
  603    HB3  ASP  81           1HB      ASP  81   6.352 -13.086   7.930
  604    H    LEU  82           HN       LEU  82   6.044 -12.409   5.429
  605    HA   LEU  82           HA       LEU  82   5.340 -14.983   4.247
  606    HB2  LEU  82           2HB      LEU  82   3.840 -12.357   4.267
  607    HB3  LEU  82           1HB      LEU  82   3.210 -13.904   3.735
  608    HG   LEU  82           HG       LEU  82   4.111 -13.397   6.564
  609   HD11  LEU  82          1HD1      LEU  82   1.327 -13.202   5.429
  610   HD12  LEU  82          2HD1      LEU  82   2.307 -11.853   6.007
  611   HD13  LEU  82          3HD1      LEU  82   1.767 -13.097   7.133
  612   HD21  LEU  82          3HD2      LEU  82   2.357 -15.514   5.333
  613   HD22  LEU  82          1HD2      LEU  82   2.752 -15.361   7.045
  614   HD23  LEU  82          2HD2      LEU  82   4.022 -15.732   5.878
  615    H    ALA  83           HN       ALA  83   4.377 -14.694   1.911
  616    HA   ALA  83           HA       ALA  83   6.445 -13.488   0.287
  617    HB1  ALA  83           1HB      ALA  83   5.483 -15.639  -0.362
  618    HB2  ALA  83           2HB      ALA  83   5.206 -14.421  -1.608
  619    HB3  ALA  83           3HB      ALA  83   3.897 -14.886  -0.524
  620    H    VAL  84           HN       VAL  84   6.431 -11.421  -0.185
  621    HA   VAL  84           HA       VAL  84   3.961  -9.907   0.163
  622    HB   VAL  84           HB       VAL  84   6.795  -8.899  -0.194
  623   HG11  VAL  84          1HG1      VAL  84   5.910  -6.760   0.589
  624   HG12  VAL  84          2HG1      VAL  84   4.289  -7.449   0.652
  625   HG13  VAL  84          3HG1      VAL  84   5.114  -7.276  -0.897
  626   HG21  VAL  84          3HG2      VAL  84   6.735  -8.440   2.211
  627   HG22  VAL  84          1HG2      VAL  84   6.540 -10.162   1.880
  628   HG23  VAL  84          2HG2      VAL  84   5.139  -9.184   2.313
  629    H    THR  85           HN       THR  85   2.758  -9.521  -1.558
  630    HA   THR  85           HA       THR  85   4.127  -9.098  -4.125
  631    HB   THR  85           HB       THR  85   1.228  -9.768  -3.985
  632    HG1  THR  85           1HG      THR  85   2.206 -11.427  -2.775
  633   HG21  THR  85          3HG2      THR  85   3.395 -10.412  -5.982
  634   HG22  THR  85          1HG2      THR  85   2.236  -9.088  -6.115
  635   HG23  THR  85          2HG2      THR  85   1.676 -10.759  -6.170
  636    H    VAL  86           HN       VAL  86   4.063  -7.159  -4.833
  637    HA   VAL  86           HA       VAL  86   1.778  -5.378  -4.304
  638    HB   VAL  86           HB       VAL  86   4.129  -3.871  -4.942
  639   HG11  VAL  86          1HG1      VAL  86   2.498  -4.008  -2.395
  640   HG12  VAL  86          2HG1      VAL  86   2.205  -2.961  -3.783
  641   HG13  VAL  86          3HG1      VAL  86   3.650  -2.734  -2.798
  642   HG21  VAL  86          3HG2      VAL  86   4.544  -5.750  -2.620
  643   HG22  VAL  86          1HG2      VAL  86   5.470  -4.270  -2.876
  644   HG23  VAL  86          2HG2      VAL  86   5.535  -5.564  -4.070
  645    H    GLU  87           HN       GLU  87   1.153  -4.218  -6.343
  646    HA   GLU  87           HA       GLU  87   3.536  -4.042  -7.987
  647    HB2  GLU  87           2HB      GLU  87   2.184  -4.412 -10.080
  648    HB3  GLU  87           1HB      GLU  87   2.600  -5.816  -9.109
  649    HG2  GLU  87           2HG      GLU  87   0.365  -5.871  -8.186
  650    HG3  GLU  87           1HG      GLU  87  -0.059  -4.411  -9.082
  651    HA   PRO  88           HA       PRO  88   3.605  -1.239 -10.037
  652    HB2  PRO  88           2HB      PRO  88   4.819   0.831  -8.765
  653    HB3  PRO  88           1HB      PRO  88   3.118   0.865  -9.214
  654    HG2  PRO  88           2HG      PRO  88   4.270   0.786  -6.560
  655    HG3  PRO  88           1HG      PRO  88   2.562   0.919  -7.003
  656    HD2  PRO  88           2HD      PRO  88   4.127  -1.492  -6.257
  657    HD3  PRO  88           1HD      PRO  88   2.375  -1.205  -6.141
  658    H    ARG  89           HN       ARG  89   5.664  -1.978 -10.663
  659    HA   ARG  89           HA       ARG  89   7.126  -3.220  -8.449
  660    HB2  ARG  89           2HB      ARG  89   7.851  -4.800  -9.856
  661    HB3  ARG  89           1HB      ARG  89   6.526  -4.238 -10.861
  662    HG2  ARG  89           2HG      ARG  89   7.983  -2.980 -12.221
  663    HG3  ARG  89           1HG      ARG  89   9.334  -3.219 -11.105
  664    HD2  ARG  89           2HD      ARG  89   9.234  -5.620 -11.501
  665    HD3  ARG  89           1HD      ARG  89   7.892  -5.374 -12.607
  666    HE   ARG  89           HE       ARG  89   9.964  -3.810 -13.566
  667   HH11  ARG  89          1HH1      ARG  89   9.373  -7.204 -12.964
  668   HH12  ARG  89          2HH1      ARG  89  10.539  -7.755 -14.124
  669   HH21  ARG  89          1HH2      ARG  89  11.510  -4.533 -15.108
  670   HH22  ARG  89          2HH2      ARG  89  11.757  -6.234 -15.337
  671    H    MET  90           HN       MET  90   7.198  -0.606 -10.555
  672    HA   MET  90           HA       MET  90   9.318   0.597  -9.011
  673    HB2  MET  90           2HB      MET  90  10.289  -0.496 -11.192
  674    HB3  MET  90           1HB      MET  90   9.501   0.850 -12.005
  675    HG2  MET  90           2HG      MET  90  10.781   2.397 -10.541
  676    HG3  MET  90           1HG      MET  90  11.656   1.000  -9.917
  677    HE1  MET  90           3HE      MET  90  14.345   2.683 -12.193
  678    HE2  MET  90           1HE      MET  90  13.990   2.041 -10.592
  679    HE3  MET  90           2HE      MET  90  13.151   3.481 -11.168
  680    H    ALA  91           HN       ALA  91   8.645   2.697  -8.576
  681    HA   ALA  91           HA       ALA  91   6.256   3.536 -10.095
  682    HB1  ALA  91           1HB      ALA  91   5.672   2.691  -7.881
  683    HB2  ALA  91           2HB      ALA  91   5.308   4.408  -8.042
  684    HB3  ALA  91           3HB      ALA  91   6.733   3.889  -7.146
  685    H    ARG  92           HN       ARG  92   5.924   5.663 -10.493
  686    HA   ARG  92           HA       ARG  92   8.273   7.381 -10.162
  687    HB2  ARG  92           2HB      ARG  92   7.702   8.492 -12.166
  688    HB3  ARG  92           1HB      ARG  92   7.492   6.784 -12.510
  689    HG2  ARG  92           2HG      ARG  92   5.217   8.599 -11.746
  690    HG3  ARG  92           1HG      ARG  92   5.717   8.322 -13.413
  691    HD2  ARG  92           2HD      ARG  92   4.859   6.158 -11.492
  692    HD3  ARG  92           1HD      ARG  92   3.808   6.910 -12.692
  693    HE   ARG  92           HE       ARG  92   5.885   6.049 -14.179
  694   HH11  ARG  92          1HH1      ARG  92   3.762   4.452 -11.880
  695   HH12  ARG  92          2HH1      ARG  92   3.952   2.895 -12.612
  696   HH21  ARG  92          1HH2      ARG  92   6.103   4.007 -15.146
  697   HH22  ARG  92          2HH2      ARG  92   5.269   2.634 -14.468
  698    H    VAL  93           HN       VAL  93   8.057   9.422  -9.379
  699    HA   VAL  93           HA       VAL  93   5.362  10.458  -8.933
  700    HB   VAL  93           HB       VAL  93   6.058   9.593  -6.747
  701   HG11  VAL  93          1HG1      VAL  93   8.453   9.645  -6.985
  702   HG12  VAL  93          2HG1      VAL  93   7.982  10.582  -5.566
  703   HG13  VAL  93          3HG1      VAL  93   8.441  11.407  -7.055
  704   HG21  VAL  93          3HG2      VAL  93   4.691  11.607  -6.808
  705   HG22  VAL  93          1HG2      VAL  93   6.144  12.605  -6.865
  706   HG23  VAL  93          2HG2      VAL  93   5.792  11.636  -5.432
  707    H    GLN  94           HN       GLN  94   5.157  12.547  -9.521
  708    HA   GLN  94           HA       GLN  94   7.571  13.785 -10.631
  709    HB2  GLN  94           2HB      GLN  94   5.783  13.494 -12.223
  710    HB3  GLN  94           1HB      GLN  94   4.638  14.280 -11.151
  711    HG2  GLN  94           2HG      GLN  94   5.280  15.743 -12.969
  712    HG3  GLN  94           1HG      GLN  94   5.814  16.395 -11.428
  713   HE21  GLN  94          1HE2      GLN  94   6.748  16.906 -14.134
  714   HE22  GLN  94          2HE2      GLN  94   8.439  16.585 -14.100
  715    H    LEU  95           HN       LEU  95   8.509  15.363  -9.609
  716    HA   LEU  95           HA       LEU  95   6.926  16.992  -7.736
  717    HB2  LEU  95           2HB      LEU  95   9.887  16.377  -7.693
  718    HB3  LEU  95           1HB      LEU  95   9.067  17.456  -6.582
  719    HG   LEU  95           HG       LEU  95   8.601  14.480  -6.814
  720   HD11  LEU  95          1HD1      LEU  95   9.969  16.126  -4.686
  721   HD12  LEU  95          2HD1      LEU  95  10.746  15.001  -5.803
  722   HD13  LEU  95          3HD1      LEU  95   9.625  14.398  -4.583
  723   HD21  LEU  95          3HD2      LEU  95   6.567  15.671  -6.196
  724   HD22  LEU  95          1HD2      LEU  95   7.436  16.508  -4.907
  725   HD23  LEU  95          2HD2      LEU  95   7.204  14.759  -4.825
  726    H    GLU  96           HN       GLU  96   6.686  19.036  -8.280
  727    HA   GLU  96           HA       GLU  96   8.657  20.360  -9.980
  728    HB2  GLU  96           2HB      GLU  96   6.591  19.253 -11.238
  729    HB3  GLU  96           1HB      GLU  96   5.771  20.700 -10.687
  730    HG2  GLU  96           2HG      GLU  96   8.337  20.834 -12.228
  731    HG3  GLU  96           1HG      GLU  96   6.776  20.696 -13.028
  732    H    GLU  97           HN       GLU  97   8.708  22.577  -9.682
  733    HA   GLU  97           HA       GLU  97   7.914  23.621  -7.211
  734    HB2  GLU  97           2HB      GLU  97   9.733  24.500  -8.707
  735    HB3  GLU  97           1HB      GLU  97   8.485  25.175  -9.743
  736    HG2  GLU  97           2HG      GLU  97   7.724  26.591  -7.912
  737    HG3  GLU  97           1HG      GLU  97   8.965  25.907  -6.862
  738    H    ARG  98           HN       ARG  98   5.777  23.427  -6.746
  739    HA   ARG  98           HA       ARG  98   3.805  25.001  -8.126
  740    HB2  ARG  98           2HB      ARG  98   4.242  22.790  -9.453
  741    HB3  ARG  98           1HB      ARG  98   3.372  22.021  -8.145
  742    HG2  ARG  98           2HG      ARG  98   1.863  22.402  -9.948
  743    HG3  ARG  98           1HG      ARG  98   1.438  23.498  -8.634
  744    HD2  ARG  98           2HD      ARG  98   1.349  24.662 -10.756
  745    HD3  ARG  98           1HD      ARG  98   2.661  25.301  -9.766
  746    HE   ARG  98           HE       ARG  98   4.081  23.673 -11.186
  747   HH11  ARG  98          1HH1      ARG  98   1.297  25.465 -12.330
  748   HH12  ARG  98          2HH1      ARG  98   1.874  25.560 -13.969
  749   HH21  ARG  98          1HH2      ARG  98   4.830  23.763 -13.312
  750   HH22  ARG  98          2HH2      ARG  98   3.877  24.563 -14.536
  751    H    GLN  99           HN       GLN  99   1.557  24.387  -7.130
  752    HA   GLN  99           HA       GLN  99   1.777  22.895  -4.645
  753    HB2  GLN  99           2HB      GLN  99   1.958  25.366  -4.145
  754    HB3  GLN  99           1HB      GLN  99   0.314  25.532  -4.753
  755    HG2  GLN  99           2HG      GLN  99  -0.431  23.896  -3.065
  756    HG3  GLN  99           1HG      GLN  99   1.208  23.866  -2.420
  757   HE21  GLN  99          1HE2      GLN  99  -1.278  24.634  -1.138
  758   HE22  GLN  99          2HE2      GLN  99  -1.060  26.255  -0.578
  759    H    THR 100           HN       THR 100   0.313  21.355  -4.690
  760    HA   THR 100           HA       THR 100  -2.135  21.769  -6.280
  761    HB   THR 100           HB       THR 100  -0.618  19.888  -6.952
  762    HG1  THR 100           1HG      THR 100  -2.314  18.614  -7.435
  763   HG21  THR 100          3HG2      THR 100  -1.465  18.694  -4.311
  764   HG22  THR 100          1HG2      THR 100   0.165  19.205  -4.744
  765   HG23  THR 100          2HG2      THR 100  -0.587  17.850  -5.584
  766    H    VAL 101           HN       VAL 101  -3.717  19.769  -5.202
  767    HA   VAL 101           HA       VAL 101  -4.565  20.983  -2.734
  768    HB   VAL 101           HB       VAL 101  -5.629  18.506  -4.106
  769   HG11  VAL 101          1HG1      VAL 101  -6.826  20.216  -1.927
  770   HG12  VAL 101          2HG1      VAL 101  -6.240  18.559  -1.758
  771   HG13  VAL 101          3HG1      VAL 101  -7.651  18.899  -2.766
  772   HG21  VAL 101          3HG2      VAL 101  -7.415  19.993  -4.922
  773   HG22  VAL 101          1HG2      VAL 101  -5.827  20.437  -5.549
  774   HG23  VAL 101          2HG2      VAL 101  -6.554  21.373  -4.243
  775    H    SER 102           HN       SER 102  -3.017  20.614  -1.195
  776    HA   SER 102           HA       SER 102  -1.919  18.011  -0.727
  777    HB2  SER 102           2HB      SER 102  -0.753  20.209  -0.232
  778    HB3  SER 102           1HB      SER 102  -1.849  20.393   1.137
  779    HG   SER 102           HG       SER 102   0.326  18.714   0.810
  780    H    VAL 103           HN       VAL 103  -3.100  16.439   0.097
  781    HA   VAL 103           HA       VAL 103  -5.289  17.053   1.936
  782    HB   VAL 103           HB       VAL 103  -4.598  14.443   0.570
  783   HG11  VAL 103          1HG1      VAL 103  -5.810  14.070   2.639
  784   HG12  VAL 103          2HG1      VAL 103  -6.852  13.738   1.255
  785   HG13  VAL 103          3HG1      VAL 103  -7.037  15.243   2.158
  786   HG21  VAL 103          3HG2      VAL 103  -5.274  16.136  -1.038
  787   HG22  VAL 103          1HG2      VAL 103  -6.719  16.483  -0.089
  788   HG23  VAL 103          2HG2      VAL 103  -6.531  14.911  -0.866
  789    HA   PRO 104           HA       PRO 104  -2.512  15.751   5.225
  790    HB2  PRO 104           2HB      PRO 104  -4.780  16.365   6.966
  791    HB3  PRO 104           1HB      PRO 104  -3.186  17.117   6.908
  792    HG2  PRO 104           2HG      PRO 104  -5.416  18.401   6.091
  793    HG3  PRO 104           1HG      PRO 104  -3.829  18.679   5.345
  794    HD2  PRO 104           2HD      PRO 104  -6.115  16.993   4.376
  795    HD3  PRO 104           1HD      PRO 104  -5.057  18.089   3.459
  796    H    VAL 105           HN       VAL 105  -2.388  13.566   5.062
  797    HA   VAL 105           HA       VAL 105  -4.681  12.025   6.069
  798    HB   VAL 105           HB       VAL 105  -4.230  11.363   3.809
  799   HG11  VAL 105          1HG1      VAL 105  -1.369  10.907   4.645
  800   HG12  VAL 105          2HG1      VAL 105  -1.958  12.182   3.578
  801   HG13  VAL 105          3HG1      VAL 105  -2.063  10.494   3.077
  802   HG21  VAL 105          3HG2      VAL 105  -3.692   8.985   4.086
  803   HG22  VAL 105          1HG2      VAL 105  -4.815   9.560   5.319
  804   HG23  VAL 105          2HG2      VAL 105  -3.115   9.316   5.720
  805    H    THR 106           HN       THR 106  -4.440  11.420   8.097
  806    HA   THR 106           HA       THR 106  -2.069  10.086   8.976
  807    HB   THR 106           HB       THR 106  -1.283  12.397   9.174
  808    HG1  THR 106           1HG      THR 106  -0.716  10.801  10.805
  809   HG21  THR 106          3HG2      THR 106  -3.668  12.779  10.977
  810   HG22  THR 106          1HG2      THR 106  -3.392  13.556   9.417
  811   HG23  THR 106          2HG2      THR 106  -2.344  13.933  10.788
  812    H    VAL 107           HN       VAL 107  -2.361   8.964  10.867
  813    HA   VAL 107           HA       VAL 107  -4.836   9.384  12.385
  814    HB   VAL 107           HB       VAL 107  -5.071   6.912  12.661
  815   HG11  VAL 107          1HG1      VAL 107  -6.512   8.085  11.110
  816   HG12  VAL 107          2HG1      VAL 107  -6.100   6.494  10.470
  817   HG13  VAL 107          3HG1      VAL 107  -5.301   7.932   9.835
  818   HG21  VAL 107          3HG2      VAL 107  -2.823   6.215  12.081
  819   HG22  VAL 107          1HG2      VAL 107  -3.044   6.797  10.430
  820   HG23  VAL 107          2HG2      VAL 107  -3.992   5.430  11.016
  821    H    GLU 108           HN       GLU 108  -4.619   8.929  14.612
  822    HA   GLU 108           HA       GLU 108  -1.832   8.959  15.457
  823    HB2  GLU 108           2HB      GLU 108  -2.733   9.586  17.683
  824    HB3  GLU 108           1HB      GLU 108  -3.177  10.701  16.399
  825    HG2  GLU 108           2HG      GLU 108  -5.386   9.615  16.274
  826    HG3  GLU 108           1HG      GLU 108  -4.930   8.591  17.638
  827    H    MET 109           HN       MET 109  -0.858   7.175  15.925
  828    HA   MET 109           HA       MET 109  -2.400   4.852  16.817
  829    HB2  MET 109           2HB      MET 109   0.466   5.029  15.858
  830    HB3  MET 109           1HB      MET 109  -0.381   3.550  16.277
  831    HG2  MET 109           2HG      MET 109  -1.943   3.917  14.435
  832    HG3  MET 109           1HG      MET 109  -1.093   5.404  14.017
  833    HE1  MET 109           3HE      MET 109  -0.119   2.992  11.087
  834    HE2  MET 109           1HE      MET 109  -0.878   4.518  11.534
  835    HE3  MET 109           2HE      MET 109  -1.662   2.993  11.940
  836    H    ILE 110           HN       ILE 110  -2.647   4.930  18.970
  837    HA   ILE 110           HA       ILE 110  -0.199   5.252  20.564
  838    HB   ILE 110           HB       ILE 110  -1.618   7.174  20.955
  839   HG12  ILE 110          2HG1      ILE 110  -1.780   5.245  23.281
  840   HG13  ILE 110          1HG1      ILE 110  -0.373   6.214  22.862
  841   HG21  ILE 110          1HG2      ILE 110  -3.753   6.213  20.265
  842   HG22  ILE 110          2HG2      ILE 110  -3.877   6.984  21.846
  843   HG23  ILE 110          3HG2      ILE 110  -3.787   5.227  21.727
  844   HD11  ILE 110          3HD1      ILE 110  -1.663   8.250  23.278
  845   HD12  ILE 110          1HD1      ILE 110  -1.586   7.210  24.700
  846   HD13  ILE 110          2HD1      ILE 110  -3.054   7.263  23.726
  847    H    ASN 111           HN       ASN 111   0.303   3.631  21.873
  848    HA   ASN 111           HA       ASN 111  -1.708   1.845  22.934
  849    HB2  ASN 111           2HB      ASN 111  -1.185   0.790  20.772
  850    HB3  ASN 111           1HB      ASN 111   0.529   0.811  21.168
  851   HD21  ASN 111          1HD2      ASN 111   0.675  -1.418  20.964
  852   HD22  ASN 111          2HD2      ASN 111   0.042  -2.502  22.164
  853    H    LEU 112           HN       LEU 112  -1.149   1.203  24.919
  854    HA   LEU 112           HA       LEU 112   1.591   1.811  25.790
  855    HB2  LEU 112           2HB      LEU 112   0.479   1.753  28.124
  856    HB3  LEU 112           1HB      LEU 112   0.258   3.156  27.102
  857    HG   LEU 112           HG       LEU 112  -1.969   2.099  26.407
  858   HD11  LEU 112          1HD1      LEU 112  -1.480   0.486  28.903
  859   HD12  LEU 112          2HD1      LEU 112  -1.513  -0.152  27.261
  860   HD13  LEU 112          3HD1      LEU 112  -2.972   0.542  27.965
  861   HD21  LEU 112          3HD2      LEU 112  -3.106   2.974  28.392
  862   HD22  LEU 112          1HD2      LEU 112  -1.814   4.045  27.849
  863   HD23  LEU 112          2HD2      LEU 112  -1.566   3.005  29.254
  864    H    GLU 113           HN       GLU 113  -0.257  -0.738  24.909
  865    HA   GLU 113           HA       GLU 113  -0.157  -2.985  25.175
  866    HB2  GLU 113           2HB      GLU 113   2.631  -2.098  25.802
  867    HB3  GLU 113           1HB      GLU 113   2.201  -3.791  26.005
  868    HG2  GLU 113           2HG      GLU 113   1.904  -2.210  23.458
  869    HG3  GLU 113           1HG      GLU 113   3.215  -3.332  23.820
  870    H    HIS 114           HN       HIS 114   1.339  -4.517  27.081
  871    HA   HIS 114           HA       HIS 114  -0.280  -3.956  29.461
  872    HB2  HIS 114           2HB      HIS 114   1.069  -6.532  28.603
  873    HB3  HIS 114           1HB      HIS 114   0.078  -6.326  30.046
  874    HD1  HIS 114           1HD      HIS 114  -0.864  -8.434  28.150
  875    HD2  HIS 114           2HD      HIS 114  -1.999  -4.451  27.782
  876    HE1  HIS 114           1HE      HIS 114  -2.985  -8.452  26.799
  877    HE2  HIS 114           2HE      HIS 114  -3.756  -6.050  26.768
  878    H    HIS 115           HN       HIS 115   0.665  -3.631  31.417
  879    HA   HIS 115           HA       HIS 115   3.341  -2.689  31.391
  880    HB2  HIS 115           2HB      HIS 115   1.408  -3.154  33.661
  881    HB3  HIS 115           1HB      HIS 115   2.998  -2.430  33.876
  882    HD1  HIS 115           1HD      HIS 115  -0.456  -1.622  33.045
  883    HD2  HIS 115           2HD      HIS 115   3.280   0.109  32.447
  884    HE1  HIS 115           1HE      HIS 115  -0.907   0.771  32.422
  885    HE2  HIS 115           2HE      HIS 115   1.365   1.849  32.320
  886    H    HIS 116           HN       HIS 116   5.143  -3.438  32.512
  887    HA   HIS 116           HA       HIS 116   6.625  -4.934  33.367
  888    HB2  HIS 116           2HB      HIS 116   4.779  -5.558  34.967
  889    HB3  HIS 116           1HB      HIS 116   4.307  -6.821  33.841
  890    HD1  HIS 116           1HD      HIS 116   4.801  -8.684  35.518
  891    HD2  HIS 116           2HD      HIS 116   8.095  -6.293  34.648
  892    HE1  HIS 116           1HE      HIS 116   6.792  -9.894  36.470
  893    HE2  HIS 116           2HE      HIS 116   8.786  -8.533  35.749
  894    H    HIS 117           HN       HIS 117   4.969  -5.100  30.659
  895    HA   HIS 117           HA       HIS 117   6.537  -7.366  29.626
  896    HB2  HIS 117           2HB      HIS 117   4.225  -7.880  29.286
  897    HB3  HIS 117           1HB      HIS 117   3.873  -6.250  28.733
  898    HD1  HIS 117           1HD      HIS 117   5.588  -9.429  27.574
  899    HD2  HIS 117           2HD      HIS 117   4.120  -5.850  26.041
  900    HE1  HIS 117           1HE      HIS 117   5.649  -9.683  25.073
  901    HE2  HIS 117           2HE      HIS 117   4.551  -7.596  24.182
  902    H    HIS 118           HN       HIS 118   8.386  -6.338  29.062
  903    HA   HIS 118           HA       HIS 118   8.397  -4.570  26.828
  904    HB2  HIS 118           2HB      HIS 118   7.727  -3.047  28.737
  905    HB3  HIS 118           1HB      HIS 118   9.295  -3.380  29.464
  906    HD1  HIS 118           1HD      HIS 118  11.315  -2.155  28.525
  907    HD2  HIS 118           2HD      HIS 118   7.813  -1.466  26.385
  908    HE1  HIS 118           1HE      HIS 118  11.825  -0.227  26.985
  909    HE2  HIS 118           2HE      HIS 118   9.626   0.305  25.862
  910    H    HIS 119           HN       HIS 119  10.392  -4.541  25.872
  911    HA   HIS 119           HA       HIS 119  12.531  -6.012  27.237
  912    HB2  HIS 119           2HB      HIS 119  11.927  -5.466  24.351
  913    HB3  HIS 119           1HB      HIS 119  13.575  -5.841  24.844
  914    HD1  HIS 119           1HD      HIS 119  14.157  -8.238  25.077
  915    HD2  HIS 119           2HD      HIS 119  10.045  -7.612  24.986
  916    HE1  HIS 119           1HE      HIS 119  13.124 -10.531  24.965
  917    HE2  HIS 119           2HE      HIS 119  10.638 -10.133  25.084
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1 -11.360 -30.116  10.217
    2    H2   MET   1           H2       MET   1 -10.200 -31.124   9.512
    3    H3   MET   1           H3       MET   1 -10.292 -29.493   9.057
    4    HA   MET   1           HA       MET   1  -9.775 -28.883  11.385
    5    HB2  MET   1           2HB      MET   1  -9.291 -31.851  11.548
    6    HB3  MET   1           1HB      MET   1  -8.549 -30.713  12.662
    7    HG2  MET   1           2HG      MET   1 -10.528 -31.699  13.637
    8    HG3  MET   1           1HG      MET   1 -10.759 -29.972  13.382
    9    HE1  MET   1           2HE      MET   1 -14.357 -31.454  12.858
   10    HE2  MET   1           3HE      MET   1 -13.354 -30.357  13.807
   11    HE3  MET   1           1HE      MET   1 -13.141 -32.099  13.963
   12    HA   PRO   2           HA       PRO   2  -5.327 -30.402   9.917
   13    HB2  PRO   2           2HB      PRO   2  -5.414 -31.181   7.237
   14    HB3  PRO   2           1HB      PRO   2  -5.190 -32.250   8.624
   15    HG2  PRO   2           2HG      PRO   2  -7.664 -31.637   7.083
   16    HG3  PRO   2           1HG      PRO   2  -7.141 -33.165   7.810
   17    HD2  PRO   2           2HD      PRO   2  -9.040 -31.671   8.944
   18    HD3  PRO   2           1HD      PRO   2  -7.847 -32.544   9.931
   19    H    THR   3           HN       THR   3  -7.043 -29.618   6.904
   20    HA   THR   3           HA       THR   3  -6.856 -27.965   5.396
   21    HB   THR   3           HB       THR   3  -6.755 -25.593   6.290
   22    HG1  THR   3           1HG      THR   3  -5.941 -26.788   8.476
   23   HG21  THR   3          3HG2      THR   3  -8.844 -26.751   5.751
   24   HG22  THR   3          1HG2      THR   3  -9.037 -25.681   7.140
   25   HG23  THR   3          2HG2      THR   3  -8.891 -27.422   7.382
   26    H    PHE   4           HN       PHE   4  -5.271 -27.745   4.021
   27    HA   PHE   4           HA       PHE   4  -2.554 -27.748   4.627
   28    HB2  PHE   4           2HB      PHE   4  -3.533 -28.249   2.422
   29    HB3  PHE   4           1HB      PHE   4  -3.857 -26.544   2.216
   30    HD1  PHE   4           2HD      PHE   4  -0.978 -28.729   3.106
   31    HD2  PHE   4           1HD      PHE   4  -2.408 -25.401   0.880
   32    HE1  PHE   4           2HE      PHE   4   1.247 -28.459   2.089
   33    HE2  PHE   4           1HE      PHE   4  -0.192 -25.128  -0.150
   34    HZ   PHE   4           HZ       PHE   4   1.640 -26.662   0.456
   35    H    ASP   5           HN       ASP   5  -1.207 -26.270   5.320
   36    HA   ASP   5           HA       ASP   5  -2.423 -23.800   6.243
   37    HB2  ASP   5           2HB      ASP   5  -1.106 -25.250   7.787
   38    HB3  ASP   5           1HB      ASP   5   0.340 -24.847   6.869
   39    H    HIS   6           HN       HIS   6  -2.290 -23.497   3.687
   40    HA   HIS   6           HA       HIS   6  -0.390 -21.290   3.470
   41    HB2  HIS   6           2HB      HIS   6  -0.717 -23.494   1.443
   42    HB3  HIS   6           1HB      HIS   6  -0.192 -21.887   0.960
   43    HD1  HIS   6           1HD      HIS   6   2.216 -21.244   1.435
   44    HD2  HIS   6           2HD      HIS   6   1.148 -24.934   3.030
   45    HE1  HIS   6           1HE      HIS   6   4.366 -22.318   2.169
   46    HE2  HIS   6           2HE      HIS   6   3.714 -24.640   2.897
   47    H    GLY   7           HN       GLY   7  -1.454 -19.502   2.987
   48    HA2  GLY   7           2HA      GLY   7  -3.887 -19.698   1.366
   49    HA3  GLY   7           1HA      GLY   7  -4.035 -19.032   2.988
   50    H    ASN   8           HN       ASN   8  -4.871 -17.222   1.632
   51    HA   ASN   8           HA       ASN   8  -2.665 -15.408   0.933
   52    HB2  ASN   8           2HB      ASN   8  -5.284 -15.606  -0.574
   53    HB3  ASN   8           1HB      ASN   8  -3.936 -14.542  -0.949
   54   HD21  ASN   8          1HD2      ASN   8  -2.168 -15.342  -2.019
   55   HD22  ASN   8          2HD2      ASN   8  -2.132 -16.917  -2.731
   56    H    LEU   9           HN       LEU   9  -3.114 -13.219   1.279
   57    HA   LEU   9           HA       LEU   9  -5.668 -12.462   2.445
   58    HB2  LEU   9           2HB      LEU   9  -4.227 -13.190   4.351
   59    HB3  LEU   9           1HB      LEU   9  -3.060 -11.964   3.892
   60    HG   LEU   9           HG       LEU   9  -4.708 -10.204   4.367
   61   HD11  LEU   9          1HD1      LEU   9  -6.809 -10.800   5.524
   62   HD12  LEU   9          2HD1      LEU   9  -6.476 -12.504   5.207
   63   HD13  LEU   9          3HD1      LEU   9  -6.756 -11.397   3.863
   64   HD21  LEU   9          3HD2      LEU   9  -4.758 -10.470   6.799
   65   HD22  LEU   9          1HD2      LEU   9  -3.191 -10.928   6.133
   66   HD23  LEU   9          2HD2      LEU   9  -4.339 -12.172   6.625
   67    H    SER  10           HN       SER  10  -6.241 -10.548   1.616
   68    HA   SER  10           HA       SER  10  -4.209  -9.125   0.062
   69    HB2  SER  10           2HB      SER  10  -6.642 -10.024  -0.725
   70    HB3  SER  10           1HB      SER  10  -7.064  -8.386  -0.224
   71    HG   SER  10           HG       SER  10  -5.020  -9.116  -2.066
   72    H    LEU  11           HN       LEU  11  -3.535  -7.148   0.656
   73    HA   LEU  11           HA       LEU  11  -4.662  -5.966   3.052
   74    HB2  LEU  11           2HB      LEU  11  -2.366  -5.060   1.316
   75    HB3  LEU  11           1HB      LEU  11  -2.790  -4.382   2.875
   76    HG   LEU  11           HG       LEU  11  -1.799  -7.193   2.372
   77   HD11  LEU  11          1HD1      LEU  11  -0.475  -4.830   3.691
   78   HD12  LEU  11          2HD1      LEU  11  -0.072  -5.498   2.109
   79   HD13  LEU  11          3HD1      LEU  11   0.194  -6.457   3.565
   80   HD21  LEU  11          3HD2      LEU  11  -3.353  -7.143   4.232
   81   HD22  LEU  11          1HD2      LEU  11  -2.476  -5.790   4.950
   82   HD23  LEU  11          2HD2      LEU  11  -1.701  -7.367   4.812
   83    H    GLY  12           HN       GLY  12  -4.640  -5.417  -0.383
   84    HA2  GLY  12           2HA      GLY  12  -6.559  -4.307  -1.351
   85    HA3  GLY  12           1HA      GLY  12  -6.565  -3.227   0.036
   86    H    GLU  13           HN       GLU  13  -6.693  -1.668  -1.875
   87    HA   GLU  13           HA       GLU  13  -4.186  -1.139  -3.216
   88    HB2  GLU  13           2HB      GLU  13  -6.784   0.393  -3.096
   89    HB3  GLU  13           1HB      GLU  13  -5.383   0.938  -4.003
   90    HG2  GLU  13           2HG      GLU  13  -5.516  -1.262  -5.251
   91    HG3  GLU  13           1HG      GLU  13  -7.094  -1.474  -4.489
   92    H    LEU  14           HN       LEU  14  -2.562  -0.242  -2.152
   93    HA   LEU  14           HA       LEU  14  -3.145   1.636   0.011
   94    HB2  LEU  14           2HB      LEU  14  -0.614   0.243  -0.837
   95    HB3  LEU  14           1HB      LEU  14  -0.640   1.515   0.369
   96    HG   LEU  14           HG       LEU  14  -2.063  -1.134   0.567
   97   HD11  LEU  14          1HD1      LEU  14  -0.482  -1.586   2.364
   98   HD12  LEU  14          2HD1      LEU  14   0.302  -0.034   2.080
   99   HD13  LEU  14          3HD1      LEU  14   0.364  -1.292   0.844
  100   HD21  LEU  14          3HD2      LEU  14  -2.639  -0.437   2.830
  101   HD22  LEU  14          1HD2      LEU  14  -3.330   0.658   1.632
  102   HD23  LEU  14          2HD2      LEU  14  -1.897   1.136   2.542
  103    H    GLU  15           HN       GLU  15  -2.885   3.732  -0.190
  104    HA   GLU  15           HA       GLU  15  -2.105   4.858  -2.721
  105    HB2  GLU  15           2HB      GLU  15  -2.926   6.146  -0.107
  106    HB3  GLU  15           1HB      GLU  15  -2.630   7.029  -1.604
  107    HG2  GLU  15           2HG      GLU  15  -4.454   5.882  -2.690
  108    HG3  GLU  15           1HG      GLU  15  -4.699   4.862  -1.276
  109    H    LEU  16           HN       LEU  16  -0.204   5.832  -3.211
  110    HA   LEU  16           HA       LEU  16   1.990   5.021  -1.514
  111    HB2  LEU  16           2HB      LEU  16   1.768   4.803  -4.087
  112    HB3  LEU  16           1HB      LEU  16   2.235   6.488  -4.124
  113    HG   LEU  16           HG       LEU  16   4.097   4.882  -4.549
  114   HD11  LEU  16          1HD1      LEU  16   4.389   6.637  -2.119
  115   HD12  LEU  16          2HD1      LEU  16   4.599   7.123  -3.802
  116   HD13  LEU  16          3HD1      LEU  16   5.717   5.973  -3.069
  117   HD21  LEU  16          3HD2      LEU  16   5.054   3.687  -2.638
  118   HD22  LEU  16          1HD2      LEU  16   3.434   3.119  -3.036
  119   HD23  LEU  16          2HD2      LEU  16   3.678   4.182  -1.650
  120    H    THR  17           HN       THR  17   2.769   6.284   0.003
  121    HA   THR  17           HA       THR  17   2.293   9.153  -0.073
  122    HB   THR  17           HB       THR  17   3.638   7.503   2.080
  123    HG1  THR  17           1HG      THR  17   1.206   7.273   1.341
  124   HG21  THR  17          3HG2      THR  17   2.378  10.252   2.176
  125   HG22  THR  17          1HG2      THR  17   4.110   9.917   2.199
  126   HG23  THR  17          2HG2      THR  17   3.092   9.390   3.539
  127    H    VAL  18           HN       VAL  18   3.750  10.542  -0.824
  128    HA   VAL  18           HA       VAL  18   6.528   9.630  -1.140
  129    HB   VAL  18           HB       VAL  18   5.123  11.908  -2.557
  130   HG11  VAL  18          1HG1      VAL  18   7.500  12.289  -2.339
  131   HG12  VAL  18          2HG1      VAL  18   7.100  11.909  -4.015
  132   HG13  VAL  18          3HG1      VAL  18   7.846  10.684  -2.986
  133   HG21  VAL  18          3HG2      VAL  18   4.197   9.784  -3.260
  134   HG22  VAL  18          1HG2      VAL  18   5.818   9.137  -3.530
  135   HG23  VAL  18          2HG2      VAL  18   5.210  10.449  -4.540
  136    H    LEU  19           HN       LEU  19   8.027  10.487   0.135
  137    HA   LEU  19           HA       LEU  19   7.365  12.799   1.774
  138    HB2  LEU  19           2HB      LEU  19   9.855  11.080   1.735
  139    HB3  LEU  19           1HB      LEU  19   9.497  12.329   2.913
  140    HG   LEU  19           HG       LEU  19   7.922   9.780   2.534
  141   HD11  LEU  19          1HD1      LEU  19   8.863   9.099   4.659
  142   HD12  LEU  19          2HD1      LEU  19   9.791  10.595   4.752
  143   HD13  LEU  19          3HD1      LEU  19  10.152   9.413   3.495
  144   HD21  LEU  19          3HD2      LEU  19   6.768  10.438   4.587
  145   HD22  LEU  19          1HD2      LEU  19   6.522  11.627   3.307
  146   HD23  LEU  19          2HD2      LEU  19   7.663  11.956   4.609
  147    H    TYR  20           HN       TYR  20   7.819  14.779   1.094
  148    HA   TYR  20           HA       TYR  20  10.234  15.231  -0.494
  149    HB2  TYR  20           2HB      TYR  20   9.056  16.579  -2.135
  150    HB3  TYR  20           1HB      TYR  20   8.374  14.958  -2.098
  151    HD1  TYR  20           1HD      TYR  20   6.248  14.692  -0.520
  152    HD2  TYR  20           2HD      TYR  20   7.627  18.383  -2.136
  153    HE1  TYR  20           1HE      TYR  20   4.006  15.657  -0.225
  154    HE2  TYR  20           2HE      TYR  20   5.390  19.354  -1.838
  155    HH   TYR  20           HH       TYR  20   3.051  18.576  -1.663
  156    H    ASP  21           HN       ASP  21   8.304  16.023   2.048
  157    HA   ASP  21           HA       ASP  21   8.265  17.684   3.582
  158    HB2  ASP  21           2HB      ASP  21  10.824  17.295   3.228
  159    HB3  ASP  21           1HB      ASP  21  10.772  18.857   2.413
  160    H    GLU  22           HN       GLU  22   9.237  20.362   3.330
  161    HA   GLU  22           HA       GLU  22   7.387  21.424   1.295
  162    HB2  GLU  22           2HB      GLU  22   8.219  22.700   3.909
  163    HB3  GLU  22           1HB      GLU  22   6.997  23.292   2.792
  164    HG2  GLU  22           2HG      GLU  22   5.594  21.381   3.257
  165    HG3  GLU  22           1HG      GLU  22   6.838  20.692   4.298
  166    H    GLU  23           HN       GLU  23  10.098  20.673   0.897
  167    HA   GLU  23           HA       GLU  23  12.070  22.551   1.276
  168    HB2  GLU  23           2HB      GLU  23  11.647  20.677  -1.056
  169    HB3  GLU  23           1HB      GLU  23  13.144  21.538  -0.741
  170    HG2  GLU  23           2HG      GLU  23  11.898  19.632   1.216
  171    HG3  GLU  23           1HG      GLU  23  13.085  19.151   0.005
  172    H    ARG  24           HN       ARG  24  10.554  22.077  -1.875
  173    HA   ARG  24           HA       ARG  24   9.867  24.830  -2.241
  174    HB2  ARG  24           2HB      ARG  24  12.500  24.448  -2.523
  175    HB3  ARG  24           1HB      ARG  24  11.992  24.018  -4.148
  176    HG2  ARG  24           2HG      ARG  24  10.914  26.186  -4.398
  177    HG3  ARG  24           1HG      ARG  24  11.402  26.623  -2.759
  178    HD2  ARG  24           2HD      ARG  24  13.781  26.200  -3.496
  179    HD3  ARG  24           1HD      ARG  24  13.161  26.114  -5.144
  180    HE   ARG  24           HE       ARG  24  12.351  28.503  -3.800
  181   HH11  ARG  24          1HH1      ARG  24  14.963  26.982  -5.571
  182   HH12  ARG  24          2HH1      ARG  24  15.686  28.490  -6.046
  183   HH21  ARG  24          1HH2      ARG  24  13.314  30.492  -4.422
  184   HH22  ARG  24          2HH2      ARG  24  14.767  30.473  -5.384
  185    H    TYR  25           HN       TYR  25   9.153  21.839  -2.732
  186    HA   TYR  25           HA       TYR  25   8.226  22.150  -5.490
  187    HB2  TYR  25           2HB      TYR  25   9.420  19.617  -4.338
  188    HB3  TYR  25           1HB      TYR  25   8.809  19.832  -5.974
  189    HD1  TYR  25           2HD      TYR  25  10.041  21.370  -7.535
  190    HD2  TYR  25           1HD      TYR  25  11.641  20.198  -3.776
  191    HE1  TYR  25           2HE      TYR  25  12.283  22.038  -8.289
  192    HE2  TYR  25           1HE      TYR  25  13.890  20.860  -4.516
  193    HH   TYR  25           HH       TYR  25  14.429  22.700  -7.357
  194    H    ASP  26           HN       ASP  26   6.418  20.734  -6.005
  195    HA   ASP  26           HA       ASP  26   5.133  19.433  -3.723
  196    HB2  ASP  26           2HB      ASP  26   4.065  21.667  -4.023
  197    HB3  ASP  26           1HB      ASP  26   3.629  21.205  -5.663
  198    H    ILE  27           HN       ILE  27   3.401  17.921  -4.468
  199    HA   ILE  27           HA       ILE  27   4.565  16.323  -6.582
  200    HB   ILE  27           HB       ILE  27   2.185  15.744  -4.815
  201   HG12  ILE  27          2HG1      ILE  27   5.058  14.804  -4.616
  202   HG13  ILE  27          1HG1      ILE  27   4.296  15.983  -3.557
  203   HG21  ILE  27          1HG2      ILE  27   2.122  14.478  -6.896
  204   HG22  ILE  27          2HG2      ILE  27   2.483  13.418  -5.533
  205   HG23  ILE  27          3HG2      ILE  27   3.775  13.927  -6.620
  206   HD11  ILE  27          3HD1      ILE  27   3.516  13.091  -3.831
  207   HD12  ILE  27          1HD1      ILE  27   2.743  14.268  -2.769
  208   HD13  ILE  27          2HD1      ILE  27   4.424  13.804  -2.499
  209    H    VAL  28           HN       VAL  28   4.080  16.925  -8.590
  210    HA   VAL  28           HA       VAL  28   1.441  17.858  -9.310
  211    HB   VAL  28           HB       VAL  28   3.792  17.174 -11.092
  212   HG11  VAL  28          1HG1      VAL  28   1.251  18.685 -11.701
  213   HG12  VAL  28          2HG1      VAL  28   1.685  17.087 -12.308
  214   HG13  VAL  28          3HG1      VAL  28   2.622  18.500 -12.794
  215   HG21  VAL  28          3HG2      VAL  28   4.155  19.587 -11.206
  216   HG22  VAL  28          1HG2      VAL  28   4.300  18.992  -9.553
  217   HG23  VAL  28          2HG2      VAL  28   2.840  19.843 -10.059
  218    H    GLU  29           HN       GLU  29   3.445  15.012  -9.949
  219    HA   GLU  29           HA       GLU  29   0.998  13.476 -10.473
  220    HB2  GLU  29           2HB      GLU  29   3.510  13.555 -12.134
  221    HB3  GLU  29           1HB      GLU  29   2.430  12.171 -12.168
  222    HG2  GLU  29           2HG      GLU  29   1.452  14.946 -12.729
  223    HG3  GLU  29           1HG      GLU  29   2.168  13.935 -13.983
  224    H    GLN  30           HN       GLN  30   1.207  11.205  -9.988
  225    HA   GLN  30           HA       GLN  30   3.587  10.269  -8.662
  226    HB2  GLN  30           2HB      GLN  30   2.549   9.941  -6.470
  227    HB3  GLN  30           1HB      GLN  30   2.562  11.647  -6.894
  228    HG2  GLN  30           2HG      GLN  30   0.199  11.405  -7.643
  229    HG3  GLN  30           1HG      GLN  30   0.222   9.759  -7.014
  230   HE21  GLN  30          1HE2      GLN  30   0.154  13.125  -6.238
  231   HE22  GLN  30          2HE2      GLN  30  -0.186  12.943  -4.554
  232    H    THR  31           HN       THR  31   2.790   8.103  -7.389
  233    HA   THR  31           HA       THR  31   1.194   6.600  -9.324
  234    HB   THR  31           HB       THR  31   2.790   5.537  -6.983
  235    HG1  THR  31           1HG      THR  31   3.719   6.635  -9.147
  236   HG21  THR  31          3HG2      THR  31   1.642   4.161  -9.418
  237   HG22  THR  31          1HG2      THR  31   1.032   4.021  -7.768
  238   HG23  THR  31          2HG2      THR  31   2.630   3.396  -8.174
  239    H    GLU  32           HN       GLU  32  -0.911   6.529  -8.926
  240    HA   GLU  32           HA       GLU  32  -2.116   7.568  -6.657
  241    HB2  GLU  32           2HB      GLU  32  -3.193   5.697  -8.754
  242    HB3  GLU  32           1HB      GLU  32  -4.195   6.440  -7.517
  243    HG2  GLU  32           2HG      GLU  32  -2.580   7.901  -9.595
  244    HG3  GLU  32           1HG      GLU  32  -4.327   7.658  -9.614
  245    H    THR  33           HN       THR  33  -2.270   4.104  -7.554
  246    HA   THR  33           HA       THR  33  -2.050   3.462  -4.708
  247    HB   THR  33           HB       THR  33  -3.896   1.717  -5.082
  248    HG1  THR  33           1HG      THR  33  -5.176   1.935  -6.812
  249   HG21  THR  33          3HG2      THR  33  -5.675   3.325  -4.544
  250   HG22  THR  33          1HG2      THR  33  -4.625   4.650  -5.045
  251   HG23  THR  33          2HG2      THR  33  -4.198   3.668  -3.644
  252    H    VAL  34           HN       VAL  34  -1.259   1.434  -4.236
  253    HA   VAL  34           HA       VAL  34  -0.483  -0.264  -6.516
  254    HB   VAL  34           HB       VAL  34   1.428  -1.063  -5.064
  255   HG11  VAL  34          1HG1      VAL  34   1.827   0.392  -6.945
  256   HG12  VAL  34          2HG1      VAL  34   2.880   0.852  -5.606
  257   HG13  VAL  34          3HG1      VAL  34   1.444   1.812  -5.970
  258   HG21  VAL  34          3HG2      VAL  34   0.757   1.428  -3.496
  259   HG22  VAL  34          1HG2      VAL  34   2.217   0.454  -3.299
  260   HG23  VAL  34          2HG2      VAL  34   0.638  -0.234  -2.918
  261    H    GLN  35           HN       GLN  35  -0.588  -2.504  -6.172
  262    HA   GLN  35           HA       GLN  35  -2.462  -3.253  -4.042
  263    HB2  GLN  35           2HB      GLN  35  -3.188  -3.747  -6.341
  264    HB3  GLN  35           1HB      GLN  35  -1.735  -4.702  -6.599
  265    HG2  GLN  35           2HG      GLN  35  -3.515  -6.207  -6.186
  266    HG3  GLN  35           1HG      GLN  35  -2.479  -6.206  -4.761
  267   HE21  GLN  35          1HE2      GLN  35  -4.110  -6.951  -3.422
  268   HE22  GLN  35          2HE2      GLN  35  -5.459  -5.973  -2.960
  269    H    VAL  36           HN       VAL  36  -1.691  -4.273  -2.353
  270    HA   VAL  36           HA       VAL  36   0.684  -5.976  -2.709
  271    HB   VAL  36           HB       VAL  36   1.316  -4.122  -1.330
  272   HG11  VAL  36          1HG1      VAL  36  -0.869  -3.340  -0.646
  273   HG12  VAL  36          2HG1      VAL  36   0.162  -3.571   0.765
  274   HG13  VAL  36          3HG1      VAL  36  -1.082  -4.758   0.379
  275   HG21  VAL  36          3HG2      VAL  36   0.810  -6.560   0.366
  276   HG22  VAL  36          1HG2      VAL  36   1.914  -5.248   0.774
  277   HG23  VAL  36          2HG2      VAL  36   2.222  -6.250  -0.644
  278    H    ASP  37           HN       ASP  37   0.441  -8.033  -2.293
  279    HA   ASP  37           HA       ASP  37  -1.936  -8.919  -0.791
  280    HB2  ASP  37           2HB      ASP  37  -2.076  -9.096  -3.361
  281    HB3  ASP  37           1HB      ASP  37  -0.863 -10.363  -3.210
  282    H    LEU  38           HN       LEU  38  -1.621 -10.733   0.525
  283    HA   LEU  38           HA       LEU  38   1.224 -11.442   0.840
  284    HB2  LEU  38           2HB      LEU  38  -0.921 -11.255   2.953
  285    HB3  LEU  38           1HB      LEU  38   0.727 -11.775   3.238
  286    HG   LEU  38           HG       LEU  38  -0.113  -9.025   2.327
  287   HD11  LEU  38          1HD1      LEU  38   0.584  -8.311   4.542
  288   HD12  LEU  38          2HD1      LEU  38   0.945  -9.983   4.977
  289   HD13  LEU  38          3HD1      LEU  38  -0.716  -9.497   4.641
  290   HD21  LEU  38          3HD2      LEU  38   2.065  -9.645   1.437
  291   HD22  LEU  38          1HD2      LEU  38   2.605 -10.109   3.051
  292   HD23  LEU  38          2HD2      LEU  38   2.226  -8.422   2.698
  293    H    GLU  39           HN       GLU  39   1.808 -13.519   0.993
  294    HA   GLU  39           HA       GLU  39  -0.313 -15.552   1.212
  295    HB2  GLU  39           2HB      GLU  39   2.272 -15.699  -0.342
  296    HB3  GLU  39           1HB      GLU  39   1.240 -17.082  -0.022
  297    HG2  GLU  39           2HG      GLU  39  -0.592 -15.897  -1.201
  298    HG3  GLU  39           1HG      GLU  39   0.578 -14.660  -1.633
  299    H    GLY  40           HN       GLY  40   0.507 -17.616   2.064
  300    HA2  GLY  40           2HA      GLY  40   2.704 -18.453   3.167
  301    HA3  GLY  40           1HA      GLY  40   2.412 -17.102   4.249
  302    HA   PRO  41           HA       PRO  41   0.551 -20.837   6.208
  303    HB2  PRO  41           2HB      PRO  41   1.292 -19.379   8.657
  304    HB3  PRO  41           1HB      PRO  41   1.701 -21.025   8.163
  305    HG2  PRO  41           2HG      PRO  41   3.537 -19.069   8.197
  306    HG3  PRO  41           1HG      PRO  41   3.555 -20.346   6.966
  307    HD2  PRO  41           2HD      PRO  41   2.564 -17.524   6.758
  308    HD3  PRO  41           1HD      PRO  41   3.516 -18.471   5.592
  309    H    ARG  42           HN       ARG  42  -1.550 -20.928   6.605
  310    HA   ARG  42           HA       ARG  42  -3.179 -18.629   6.675
  311    HB2  ARG  42           2HB      ARG  42  -3.781 -21.519   7.310
  312    HB3  ARG  42           1HB      ARG  42  -5.010 -20.261   7.271
  313    HG2  ARG  42           2HG      ARG  42  -4.431 -19.811   4.914
  314    HG3  ARG  42           1HG      ARG  42  -3.276 -21.143   4.970
  315    HD2  ARG  42           2HD      ARG  42  -5.055 -22.719   5.402
  316    HD3  ARG  42           1HD      ARG  42  -6.232 -21.410   5.509
  317    HE   ARG  42           HE       ARG  42  -4.799 -21.606   2.991
  318   HH11  ARG  42          1HH1      ARG  42  -7.670 -22.463   4.808
  319   HH12  ARG  42          2HH1      ARG  42  -8.623 -22.795   3.394
  320   HH21  ARG  42          1HH2      ARG  42  -6.065 -21.997   1.122
  321   HH22  ARG  42          2HH2      ARG  42  -7.716 -22.514   1.310
  322    H    GLY  43           HN       GLY  43  -1.848 -20.674   9.191
  323    HA2  GLY  43           2HA      GLY  43  -3.343 -19.712  11.368
  324    HA3  GLY  43           1HA      GLY  43  -1.715 -20.366  11.466
  325    H    VAL  44           HN       VAL  44  -0.230 -18.590  10.088
  326    HA   VAL  44           HA       VAL  44   0.126 -16.467  11.905
  327    HB   VAL  44           HB       VAL  44   1.174 -16.687   9.071
  328   HG11  VAL  44          1HG1      VAL  44   2.940 -15.174   9.834
  329   HG12  VAL  44          2HG1      VAL  44   2.150 -15.047  11.406
  330   HG13  VAL  44          3HG1      VAL  44   1.347 -14.424   9.965
  331   HG21  VAL  44          3HG2      VAL  44   2.398 -17.576  11.683
  332   HG22  VAL  44          1HG2      VAL  44   3.194 -17.611  10.109
  333   HG23  VAL  44          2HG2      VAL  44   1.785 -18.629  10.408
  334    H    LEU  45           HN       LEU  45  -1.348 -16.623   8.689
  335    HA   LEU  45           HA       LEU  45  -1.876 -13.903   8.341
  336    HB2  LEU  45           2HB      LEU  45  -3.427 -16.300   7.373
  337    HB3  LEU  45           1HB      LEU  45  -3.683 -14.662   6.805
  338    HG   LEU  45           HG       LEU  45  -1.132 -16.245   6.480
  339   HD11  LEU  45          1HD1      LEU  45  -3.234 -15.467   4.465
  340   HD12  LEU  45          2HD1      LEU  45  -2.962 -17.091   5.097
  341   HD13  LEU  45          3HD1      LEU  45  -1.721 -16.307   4.119
  342   HD21  LEU  45          3HD2      LEU  45  -1.910 -13.526   5.434
  343   HD22  LEU  45          1HD2      LEU  45  -0.432 -14.403   5.032
  344   HD23  LEU  45          2HD2      LEU  45  -0.710 -13.853   6.684
  345    H    THR  46           HN       THR  46  -3.663 -16.373  10.099
  346    HA   THR  46           HA       THR  46  -6.015 -14.846  10.537
  347    HB   THR  46           HB       THR  46  -4.932 -17.078  12.277
  348    HG1  THR  46           1HG      THR  46  -5.075 -17.882  10.199
  349   HG21  THR  46          3HG2      THR  46  -7.286 -17.464  12.821
  350   HG22  THR  46          1HG2      THR  46  -7.756 -16.110  11.793
  351   HG23  THR  46          2HG2      THR  46  -6.811 -15.821  13.251
  352    H    VAL  47           HN       VAL  47  -3.004 -15.223  12.381
  353    HA   VAL  47           HA       VAL  47  -3.774 -13.691  14.623
  354    HB   VAL  47           HB       VAL  47  -0.996 -13.935  13.438
  355   HG11  VAL  47          1HG1      VAL  47  -1.230 -12.139  15.095
  356   HG12  VAL  47          2HG1      VAL  47  -0.216 -13.452  15.697
  357   HG13  VAL  47          3HG1      VAL  47  -1.882 -13.298  16.255
  358   HG21  VAL  47          3HG2      VAL  47  -0.683 -15.801  14.986
  359   HG22  VAL  47          1HG2      VAL  47  -1.989 -16.130  13.845
  360   HG23  VAL  47          2HG2      VAL  47  -2.363 -15.658  15.503
  361    H    PHE  48           HN       PHE  48  -2.408 -12.865  11.497
  362    HA   PHE  48           HA       PHE  48  -2.062 -10.089  11.988
  363    HB2  PHE  48           2HB      PHE  48  -0.934 -11.416  10.174
  364    HB3  PHE  48           1HB      PHE  48  -2.472 -11.472   9.325
  365    HD1  PHE  48           1HD      PHE  48   0.258  -9.283  10.448
  366    HD2  PHE  48           2HD      PHE  48  -3.269  -9.596   8.090
  367    HE1  PHE  48           1HE      PHE  48   0.796  -7.143   9.362
  368    HE2  PHE  48           2HE      PHE  48  -2.738  -7.456   7.003
  369    HZ   PHE  48           HZ       PHE  48  -0.704  -6.227   7.636
  370    H    ARG  49           HN       ARG  49  -4.758 -12.058  10.995
  371    HA   ARG  49           HA       ARG  49  -6.440 -10.164   9.857
  372    HB2  ARG  49           2HB      ARG  49  -6.964 -12.687  11.418
  373    HB3  ARG  49           1HB      ARG  49  -8.227 -11.779  10.641
  374    HG2  ARG  49           2HG      ARG  49  -7.136 -12.140   8.467
  375    HG3  ARG  49           1HG      ARG  49  -5.913 -13.120   9.286
  376    HD2  ARG  49           2HD      ARG  49  -7.803 -14.546  10.144
  377    HD3  ARG  49           1HD      ARG  49  -8.866 -13.662   9.051
  378    HE   ARG  49           HE       ARG  49  -6.851 -15.628   8.331
  379   HH11  ARG  49          1HH1      ARG  49  -9.063 -13.147   7.266
  380   HH12  ARG  49          2HH1      ARG  49  -9.132 -13.716   5.622
  381   HH21  ARG  49          1HH2      ARG  49  -6.929 -16.414   6.197
  382   HH22  ARG  49          2HH2      ARG  49  -7.899 -15.586   5.008
  383    H    PHE  50           HN       PHE  50  -5.915 -11.077  13.229
  384    HA   PHE  50           HA       PHE  50  -8.078  -9.507  14.226
  385    HB2  PHE  50           2HB      PHE  50  -5.749 -10.865  15.586
  386    HB3  PHE  50           1HB      PHE  50  -7.032 -10.032  16.441
  387    HD1  PHE  50           2HD      PHE  50  -9.482 -10.798  15.575
  388    HD2  PHE  50           1HD      PHE  50  -5.933 -13.138  15.468
  389    HE1  PHE  50           2HE      PHE  50 -10.842 -12.845  15.512
  390    HE2  PHE  50           1HE      PHE  50  -7.285 -15.190  15.402
  391    HZ   PHE  50           HZ       PHE  50  -9.745 -15.048  15.422
  392    H    ALA  51           HN       ALA  51  -4.668  -9.022  13.700
  393    HA   ALA  51           HA       ALA  51  -4.554  -6.576  15.219
  394    HB1  ALA  51           1HB      ALA  51  -2.586  -7.729  13.244
  395    HB2  ALA  51           2HB      ALA  51  -2.574  -7.986  14.989
  396    HB3  ALA  51           3HB      ALA  51  -2.288  -6.374  14.332
  397    H    ARG  52           HN       ARG  52  -5.343  -4.704  14.531
  398    HA   ARG  52           HA       ARG  52  -6.474  -4.348  12.003
  399    HB2  ARG  52           2HB      ARG  52  -5.878  -2.618  14.342
  400    HB3  ARG  52           1HB      ARG  52  -6.310  -1.843  12.831
  401    HG2  ARG  52           2HG      ARG  52  -8.398  -3.066  12.759
  402    HG3  ARG  52           1HG      ARG  52  -7.957  -3.932  14.233
  403    HD2  ARG  52           2HD      ARG  52  -8.237  -0.939  14.057
  404    HD3  ARG  52           1HD      ARG  52  -9.537  -2.017  14.562
  405    HE   ARG  52           HE       ARG  52  -7.765  -2.753  16.309
  406   HH11  ARG  52          1HH1      ARG  52  -8.314   0.507  15.132
  407   HH12  ARG  52          2HH1      ARG  52  -7.742   1.249  16.597
  408   HH21  ARG  52          1HH2      ARG  52  -7.069  -1.772  18.237
  409   HH22  ARG  52          2HH2      ARG  52  -7.044  -0.036  18.358
  410    HA   PRO  53           HA       PRO  53  -3.475  -3.291   9.094
  411    HB2  PRO  53           2HB      PRO  53  -4.417  -0.784   8.241
  412    HB3  PRO  53           1HB      PRO  53  -4.821  -2.364   7.567
  413    HG2  PRO  53           2HG      PRO  53  -6.327  -0.682   9.500
  414    HG3  PRO  53           1HG      PRO  53  -6.938  -1.783   8.253
  415    HD2  PRO  53           2HD      PRO  53  -6.988  -2.437  10.852
  416    HD3  PRO  53           1HD      PRO  53  -6.666  -3.654   9.599
  417    H    SER  54           HN       SER  54  -1.489  -2.752   9.547
  418    HA   SER  54           HA       SER  54  -0.906  -0.010  10.344
  419    HB2  SER  54           2HB      SER  54   0.200  -2.602  11.360
  420    HB3  SER  54           1HB      SER  54   1.112  -1.116  11.480
  421    HG   SER  54           HG       SER  54  -1.486  -0.901  12.335
  422    H    TYR  55           HN       TYR  55  -0.947  -1.863   7.837
  423    HA   TYR  55           HA       TYR  55   1.800  -1.841   6.994
  424    HB2  TYR  55           2HB      TYR  55   0.753  -2.617   4.775
  425    HB3  TYR  55           1HB      TYR  55   0.679  -3.702   6.156
  426    HD1  TYR  55           1HD      TYR  55  -1.281  -1.457   3.987
  427    HD2  TYR  55           2HD      TYR  55  -1.421  -4.319   7.129
  428    HE1  TYR  55           1HE      TYR  55  -3.711  -1.654   3.689
  429    HE2  TYR  55           2HE      TYR  55  -3.854  -4.525   6.843
  430    HH   TYR  55           HH       TYR  55  -5.496  -3.237   4.131
  431    H    GLU  56           HN       GLU  56   2.789  -0.458   5.694
  432    HA   GLU  56           HA       GLU  56   1.277   1.780   4.569
  433    HB2  GLU  56           2HB      GLU  56   1.880   2.396   6.869
  434    HB3  GLU  56           1HB      GLU  56   3.564   2.041   6.527
  435    HG2  GLU  56           2HG      GLU  56   3.553   3.849   4.842
  436    HG3  GLU  56           1HG      GLU  56   1.909   4.253   5.346
  437    H    VAL  57           HN       VAL  57   2.289   2.770   2.830
  438    HA   VAL  57           HA       VAL  57   4.918   1.737   2.023
  439    HB   VAL  57           HB       VAL  57   4.143   1.806  -0.360
  440   HG11  VAL  57          1HG1      VAL  57   2.672  -0.111   1.447
  441   HG12  VAL  57          2HG1      VAL  57   4.315  -0.311   0.835
  442   HG13  VAL  57          3HG1      VAL  57   2.949  -0.334  -0.281
  443   HG21  VAL  57          3HG2      VAL  57   2.212   3.257  -0.145
  444   HG22  VAL  57          1HG2      VAL  57   1.415   2.088   0.910
  445   HG23  VAL  57          2HG2      VAL  57   1.704   1.692  -0.783
  446    H    PHE  58           HN       PHE  58   6.337   3.275   1.407
  447    HA   PHE  58           HA       PHE  58   5.417   5.869   0.517
  448    HB2  PHE  58           2HB      PHE  58   6.534   7.124   2.297
  449    HB3  PHE  58           1HB      PHE  58   5.278   6.087   2.964
  450    HD1  PHE  58           2HD      PHE  58   5.910   4.015   4.179
  451    HD2  PHE  58           1HD      PHE  58   8.808   6.858   2.903
  452    HE1  PHE  58           2HE      PHE  58   7.548   3.037   5.732
  453    HE2  PHE  58           1HE      PHE  58  10.450   5.882   4.454
  454    HZ   PHE  58           HZ       PHE  58   9.822   3.969   5.870
  455    H    VAL  59           HN       VAL  59   7.168   7.258  -0.177
  456    HA   VAL  59           HA       VAL  59   9.790   5.956  -0.399
  457    HB   VAL  59           HB       VAL  59  10.045   6.853  -2.708
  458   HG11  VAL  59          1HG1      VAL  59   7.748   4.934  -2.352
  459   HG12  VAL  59          2HG1      VAL  59   9.460   4.513  -2.374
  460   HG13  VAL  59          3HG1      VAL  59   8.690   5.155  -3.827
  461   HG21  VAL  59          3HG2      VAL  59   8.058   7.505  -3.973
  462   HG22  VAL  59          1HG2      VAL  59   8.350   8.608  -2.628
  463   HG23  VAL  59          2HG2      VAL  59   7.082   7.387  -2.508
  464    H    ASP  60           HN       ASP  60  11.488   7.295   0.024
  465    HA   ASP  60           HA       ASP  60  10.825  10.079   0.665
  466    HB2  ASP  60           2HB      ASP  60  12.008   8.667   2.375
  467    HB3  ASP  60           1HB      ASP  60  13.386   8.585   1.283
  468    H    LEU  61           HN       LEU  61  11.185  11.531  -0.829
  469    HA   LEU  61           HA       LEU  61  13.623  11.327  -2.434
  470    HB2  LEU  61           2HB      LEU  61  10.826  11.754  -3.462
  471    HB3  LEU  61           1HB      LEU  61  12.244  12.224  -4.382
  472    HG   LEU  61           HG       LEU  61  11.728   9.403  -3.431
  473   HD11  LEU  61          1HD1      LEU  61  11.165   8.914  -5.769
  474   HD12  LEU  61          2HD1      LEU  61  11.222  10.639  -6.131
  475   HD13  LEU  61          3HD1      LEU  61  10.009  10.010  -5.015
  476   HD21  LEU  61          3HD2      LEU  61  13.703  10.573  -5.385
  477   HD22  LEU  61          1HD2      LEU  61  13.464   8.851  -5.087
  478   HD23  LEU  61          2HD2      LEU  61  14.067   9.894  -3.799
  479    H    THR  62           HN       THR  62  13.161  12.787  -0.129
  480    HA   THR  62           HA       THR  62  12.433  15.478  -0.550
  481    HB   THR  62           HB       THR  62  13.848  15.861   1.539
  482    HG1  THR  62           1HG      THR  62  13.971  13.004   1.585
  483   HG21  THR  62          3HG2      THR  62  11.725  13.712   1.642
  484   HG22  THR  62          1HG2      THR  62  11.438  15.451   1.658
  485   HG23  THR  62          2HG2      THR  62  12.273  14.683   3.008
  486    H    GLU  63           HN       GLU  63  15.227  13.683  -1.400
  487    HA   GLU  63           HA       GLU  63  16.908  16.054  -1.652
  488    HB2  GLU  63           2HB      GLU  63  17.526  13.138  -2.099
  489    HB3  GLU  63           1HB      GLU  63  18.693  14.438  -2.172
  490    HG2  GLU  63           2HG      GLU  63  18.301  14.930   0.144
  491    HG3  GLU  63           1HG      GLU  63  17.090  13.667   0.222
  492    H    ALA  64           HN       ALA  64  14.557  14.859  -3.486
  493    HA   ALA  64           HA       ALA  64  15.937  14.851  -6.041
  494    HB1  ALA  64           1HB      ALA  64  14.080  13.311  -5.707
  495    HB2  ALA  64           2HB      ALA  64  13.720  14.452  -7.001
  496    HB3  ALA  64           3HB      ALA  64  12.994  14.665  -5.409
  497    H    GLY  65           HN       GLY  65  14.862  16.242  -7.826
  498    HA2  GLY  65           2HA      GLY  65  14.459  18.962  -6.744
  499    HA3  GLY  65           1HA      GLY  65  15.419  18.642  -8.181
  500    H    GLU  66           HN       GLU  66  14.423  18.838 -10.091
  501    HA   GLU  66           HA       GLU  66  11.500  19.038 -10.090
  502    HB2  GLU  66           2HB      GLU  66  13.516  19.980 -12.130
  503    HB3  GLU  66           1HB      GLU  66  11.782  20.172 -12.256
  504    HG2  GLU  66           2HG      GLU  66  11.804  21.565 -10.233
  505    HG3  GLU  66           1HG      GLU  66  13.562  21.418 -10.184
  506    H    GLY  67           HN       GLY  67  10.285  17.979 -11.668
  507    HA2  GLY  67           2HA      GLY  67  10.007  16.579 -13.556
  508    HA3  GLY  67           1HA      GLY  67  11.663  16.022 -13.349
  509    H    SER  68           HN       SER  68  10.017  14.078 -13.759
  510    HA   SER  68           HA       SER  68   9.115  13.040 -11.182
  511    HB2  SER  68           2HB      SER  68   7.613  12.848 -13.148
  512    HB3  SER  68           1HB      SER  68   8.804  11.817 -13.936
  513    HG   SER  68           HG       SER  68   7.758  11.214 -11.383
  514    H    HIS  69           HN       HIS  69   9.974  11.301 -10.223
  515    HA   HIS  69           HA       HIS  69  12.307  10.027 -11.482
  516    HB2  HIS  69           2HB      HIS  69  12.857  11.840  -9.705
  517    HB3  HIS  69           1HB      HIS  69  12.287  10.651  -8.539
  518    HD1  HIS  69           1HD      HIS  69  13.905   8.818  -7.885
  519    HD2  HIS  69           2HD      HIS  69  15.177  10.998 -11.181
  520    HE1  HIS  69           1HE      HIS  69  16.261   8.061  -8.324
  521    HE2  HIS  69           2HE      HIS  69  17.079   9.571 -10.178
  522    H    THR  70           HN       THR  70  12.169   7.874 -11.462
  523    HA   THR  70           HA       THR  70  10.080   6.626  -9.834
  524    HB   THR  70           HB       THR  70  11.799   5.295 -11.937
  525    HG1  THR  70           1HG      THR  70   9.988   5.739 -13.341
  526   HG21  THR  70          3HG2      THR  70   9.071   4.628 -10.820
  527   HG22  THR  70          1HG2      THR  70  10.574   3.792 -10.435
  528   HG23  THR  70          2HG2      THR  70   9.923   3.725 -12.073
  529    H    VAL  71           HN       VAL  71  10.527   5.493  -8.046
  530    HA   VAL  71           HA       VAL  71  13.208   4.316  -7.758
  531    HB   VAL  71           HB       VAL  71  13.084   4.764  -5.297
  532   HG11  VAL  71          1HG1      VAL  71  13.123   7.200  -7.072
  533   HG12  VAL  71          2HG1      VAL  71  14.483   6.121  -6.760
  534   HG13  VAL  71          3HG1      VAL  71  13.809   7.089  -5.450
  535   HG21  VAL  71          3HG2      VAL  71  11.593   6.561  -4.527
  536   HG22  VAL  71          1HG2      VAL  71  10.700   5.149  -5.095
  537   HG23  VAL  71          2HG2      VAL  71  10.823   6.583  -6.115
  538    H    ASP  72           HN       ASP  72  13.214   2.601  -6.006
  539    HA   ASP  72           HA       ASP  72  11.014   0.794  -6.517
  540    HB2  ASP  72           2HB      ASP  72  13.489   0.158  -6.402
  541    HB3  ASP  72           1HB      ASP  72  13.354   0.324  -4.657
  542    H    VAL  73           HN       VAL  73   9.524   0.059  -5.001
  543    HA   VAL  73           HA       VAL  73   9.064   2.008  -2.893
  544    HB   VAL  73           HB       VAL  73   7.262  -0.181  -3.924
  545   HG11  VAL  73          1HG1      VAL  73   6.744   0.389  -1.602
  546   HG12  VAL  73          2HG1      VAL  73   5.478   0.979  -2.680
  547   HG13  VAL  73          3HG1      VAL  73   6.676   2.099  -2.025
  548   HG21  VAL  73          3HG2      VAL  73   7.291   2.795  -4.446
  549   HG22  VAL  73          1HG2      VAL  73   6.022   1.688  -4.968
  550   HG23  VAL  73          2HG2      VAL  73   7.657   1.516  -5.607
  551    H    GLU  74           HN       GLU  74   9.830   1.643  -0.942
  552    HA   GLU  74           HA       GLU  74  10.013  -1.067   0.116
  553    HB2  GLU  74           2HB      GLU  74  10.783   1.596   1.344
  554    HB3  GLU  74           1HB      GLU  74  11.040   0.025   2.093
  555    HG2  GLU  74           2HG      GLU  74  12.466  -0.599   0.152
  556    HG3  GLU  74           1HG      GLU  74  12.294   1.053  -0.437
  557    H    HIS  75           HN       HIS  75   8.943  -1.665   2.082
  558    HA   HIS  75           HA       HIS  75   6.641  -0.042   2.851
  559    HB2  HIS  75           2HB      HIS  75   5.270  -2.294   2.599
  560    HB3  HIS  75           1HB      HIS  75   5.457  -1.189   1.241
  561    HD1  HIS  75           1HD      HIS  75   7.096  -4.361   2.588
  562    HD2  HIS  75           2HD      HIS  75   6.502  -2.328  -0.986
  563    HE1  HIS  75           1HE      HIS  75   8.017  -5.864   0.797
  564    HE2  HIS  75           2HE      HIS  75   7.917  -4.467  -1.303
  565    H    ARG  76           HN       ARG  76   5.718  -0.617   4.838
  566    HA   ARG  76           HA       ARG  76   6.980  -2.789   6.332
  567    HB2  ARG  76           2HB      ARG  76   8.209  -0.553   6.698
  568    HB3  ARG  76           1HB      ARG  76   6.767  -0.045   7.566
  569    HG2  ARG  76           2HG      ARG  76   7.036  -1.855   9.143
  570    HG3  ARG  76           1HG      ARG  76   8.429  -2.459   8.245
  571    HD2  ARG  76           2HD      ARG  76   9.598  -0.332   8.701
  572    HD3  ARG  76           1HD      ARG  76   8.218   0.192   9.669
  573    HE   ARG  76           HE       ARG  76   8.993  -2.257  10.693
  574   HH11  ARG  76          1HH1      ARG  76  10.443   0.901  10.301
  575   HH12  ARG  76          2HH1      ARG  76  11.494   0.735  11.672
  576   HH21  ARG  76          1HH2      ARG  76  10.347  -2.472  12.526
  577   HH22  ARG  76          2HH2      ARG  76  11.419  -1.172  12.959
  578    H    GLY  77           HN       GLY  77   5.821  -3.147   8.455
  579    HA2  GLY  77           2HA      GLY  77   3.695  -2.631   9.661
  580    HA3  GLY  77           1HA      GLY  77   2.938  -2.598   8.076
  581    H    PHE  78           HN       PHE  78   4.392  -4.786   7.011
  582    HA   PHE  78           HA       PHE  78   3.525  -7.026   8.700
  583    HB2  PHE  78           2HB      PHE  78   3.378  -8.305   6.490
  584    HB3  PHE  78           1HB      PHE  78   2.126  -7.106   6.787
  585    HD1  PHE  78           2HD      PHE  78   5.058  -7.963   4.768
  586    HD2  PHE  78           1HD      PHE  78   2.011  -5.080   5.483
  587    HE1  PHE  78           2HE      PHE  78   5.580  -6.882   2.620
  588    HE2  PHE  78           1HE      PHE  78   2.526  -3.996   3.335
  589    HZ   PHE  78           HZ       PHE  78   4.316  -4.895   1.899
  590    HA   PRO  79           HA       PRO  79   7.791  -8.107   8.723
  591    HB2  PRO  79           2HB      PRO  79   7.150 -10.869   9.310
  592    HB3  PRO  79           1HB      PRO  79   7.764  -9.625  10.399
  593    HG2  PRO  79           2HG      PRO  79   5.251 -10.679  10.574
  594    HG3  PRO  79           1HG      PRO  79   5.679  -9.052  11.131
  595    HD2  PRO  79           2HD      PRO  79   4.318  -9.896   8.605
  596    HD3  PRO  79           1HD      PRO  79   3.996  -8.494   9.650
  597    H    GLY  80           HN       GLY  80   9.392  -9.490   7.735
  598    HA2  GLY  80           2HA      GLY  80   8.732 -10.167   5.013
  599    HA3  GLY  80           1HA      GLY  80  10.310 -10.299   5.768
  600    H    ASP  81           HN       ASP  81   7.918 -11.778   7.582
  601    HA   ASP  81           HA       ASP  81   8.896 -14.408   7.063
  602    HB2  ASP  81           2HB      ASP  81   8.176 -13.722   9.296
  603    HB3  ASP  81           1HB      ASP  81   6.550 -13.445   8.696
  604    H    LEU  82           HN       LEU  82   6.223 -12.474   6.031
  605    HA   LEU  82           HA       LEU  82   4.839 -14.732   4.822
  606    HB2  LEU  82           2HB      LEU  82   4.131 -11.797   4.910
  607    HB3  LEU  82           1HB      LEU  82   3.110 -13.069   4.274
  608    HG   LEU  82           HG       LEU  82   3.992 -12.830   7.150
  609   HD11  LEU  82          1HD1      LEU  82   1.326 -12.236   5.871
  610   HD12  LEU  82          2HD1      LEU  82   2.452 -11.050   6.530
  611   HD13  LEU  82          3HD1      LEU  82   1.674 -12.216   7.601
  612   HD21  LEU  82          3HD2      LEU  82   2.023 -14.702   5.839
  613   HD22  LEU  82          1HD2      LEU  82   2.347 -14.589   7.569
  614   HD23  LEU  82          2HD2      LEU  82   3.610 -15.140   6.468
  615    H    ALA  83           HN       ALA  83   4.158 -14.600   2.567
  616    HA   ALA  83           HA       ALA  83   6.300 -13.576   0.873
  617    HB1  ALA  83           1HB      ALA  83   5.559 -15.890   0.541
  618    HB2  ALA  83           2HB      ALA  83   5.268 -14.915  -0.899
  619    HB3  ALA  83           3HB      ALA  83   3.933 -15.316   0.179
  620    H    VAL  84           HN       VAL  84   6.073 -11.844  -0.462
  621    HA   VAL  84           HA       VAL  84   3.483 -10.455  -0.285
  622    HB   VAL  84           HB       VAL  84   6.191  -9.205  -0.753
  623   HG11  VAL  84          1HG1      VAL  84   4.330  -7.909  -1.642
  624   HG12  VAL  84          2HG1      VAL  84   5.054  -7.109  -0.248
  625   HG13  VAL  84          3HG1      VAL  84   3.527  -7.973  -0.073
  626   HG21  VAL  84          3HG2      VAL  84   4.585  -9.421   1.788
  627   HG22  VAL  84          1HG2      VAL  84   6.023  -8.420   1.582
  628   HG23  VAL  84          2HG2      VAL  84   6.145 -10.174   1.460
  629    H    THR  85           HN       THR  85   2.358 -10.227  -2.101
  630    HA   THR  85           HA       THR  85   3.785 -10.260  -4.683
  631    HB   THR  85           HB       THR  85   0.795 -10.302  -4.249
  632    HG1  THR  85           1HG      THR  85   2.116 -12.167  -3.388
  633   HG21  THR  85          3HG2      THR  85   2.507 -11.031  -6.625
  634   HG22  THR  85          1HG2      THR  85   1.499  -9.595  -6.470
  635   HG23  THR  85          2HG2      THR  85   0.752 -11.192  -6.538
  636    H    VAL  86           HN       VAL  86   3.743  -8.446  -5.992
  637    HA   VAL  86           HA       VAL  86   2.539  -6.058  -4.765
  638    HB   VAL  86           HB       VAL  86   5.280  -6.069  -6.014
  639   HG11  VAL  86          1HG1      VAL  86   5.483  -3.864  -4.957
  640   HG12  VAL  86          2HG1      VAL  86   3.822  -3.997  -4.381
  641   HG13  VAL  86          3HG1      VAL  86   4.153  -3.928  -6.112
  642   HG21  VAL  86          3HG2      VAL  86   5.310  -7.410  -3.969
  643   HG22  VAL  86          1HG2      VAL  86   4.586  -6.072  -3.080
  644   HG23  VAL  86          2HG2      VAL  86   6.204  -5.902  -3.766
  645    H    GLU  87           HN       GLU  87   1.439  -4.821  -6.074
  646    HA   GLU  87           HA       GLU  87   1.881  -4.991  -8.980
  647    HB2  GLU  87           2HB      GLU  87  -0.495  -4.893  -7.403
  648    HB3  GLU  87           1HB      GLU  87  -0.382  -3.363  -8.263
  649    HG2  GLU  87           2HG      GLU  87  -0.578  -4.343 -10.323
  650    HG3  GLU  87           1HG      GLU  87   0.060  -5.891  -9.772
  651    HA   PRO  88           HA       PRO  88   4.140  -2.341 -10.377
  652    HB2  PRO  88           2HB      PRO  88   2.941   0.223  -9.458
  653    HB3  PRO  88           1HB      PRO  88   3.711  -0.164 -10.997
  654    HG2  PRO  88           2HG      PRO  88   0.919  -0.311 -10.379
  655    HG3  PRO  88           1HG      PRO  88   1.717  -0.807 -11.883
  656    HD2  PRO  88           2HD      PRO  88   0.454  -2.552 -10.150
  657    HD3  PRO  88           1HD      PRO  88   1.765  -3.028 -11.258
  658    H    ARG  89           HN       ARG  89   6.066  -2.049  -9.605
  659    HA   ARG  89           HA       ARG  89   6.235  -2.167  -6.675
  660    HB2  ARG  89           2HB      ARG  89   8.139  -3.194  -8.774
  661    HB3  ARG  89           1HB      ARG  89   8.259  -3.465  -7.034
  662    HG2  ARG  89           2HG      ARG  89   5.993  -4.507  -7.163
  663    HG3  ARG  89           1HG      ARG  89   6.150  -4.457  -8.915
  664    HD2  ARG  89           2HD      ARG  89   8.233  -5.725  -7.177
  665    HD3  ARG  89           1HD      ARG  89   6.807  -6.604  -7.718
  666    HE   ARG  89           HE       ARG  89   7.565  -6.165 -10.024
  667   HH11  ARG  89          1HH1      ARG  89   9.904  -5.730  -7.450
  668   HH12  ARG  89          2HH1      ARG  89  11.264  -6.132  -8.458
  669   HH21  ARG  89          1HH2      ARG  89   9.353  -6.700 -11.337
  670   HH22  ARG  89          2HH2      ARG  89  10.950  -6.700 -10.647
  671    H    MET  90           HN       MET  90   7.253  -0.447  -9.414
  672    HA   MET  90           HA       MET  90   9.035   1.191  -7.745
  673    HB2  MET  90           2HB      MET  90   9.043   0.845 -10.752
  674    HB3  MET  90           1HB      MET  90  10.089   1.940  -9.863
  675    HG2  MET  90           2HG      MET  90  11.086   0.039  -8.691
  676    HG3  MET  90           1HG      MET  90  10.045  -1.055  -9.596
  677    HE1  MET  90           3HE      MET  90  13.378   1.518 -11.485
  678    HE2  MET  90           1HE      MET  90  13.051   1.450  -9.754
  679    HE3  MET  90           2HE      MET  90  11.881   2.192 -10.844
  680    H    ALA  91           HN       ALA  91   8.624   3.362  -7.600
  681    HA   ALA  91           HA       ALA  91   6.063   4.196  -8.804
  682    HB1  ALA  91           1HB      ALA  91   5.836   3.737  -6.409
  683    HB2  ALA  91           2HB      ALA  91   5.585   5.445  -6.768
  684    HB3  ALA  91           3HB      ALA  91   7.111   4.907  -6.065
  685    H    ARG  92           HN       ARG  92   6.038   6.011  -9.883
  686    HA   ARG  92           HA       ARG  92   8.398   7.747  -9.764
  687    HB2  ARG  92           2HB      ARG  92   7.681   8.597 -11.962
  688    HB3  ARG  92           1HB      ARG  92   7.949   6.860 -11.990
  689    HG2  ARG  92           2HG      ARG  92   5.612   6.419 -12.009
  690    HG3  ARG  92           1HG      ARG  92   5.231   8.110 -11.675
  691    HD2  ARG  92           2HD      ARG  92   6.198   8.736 -13.844
  692    HD3  ARG  92           1HD      ARG  92   6.532   7.036 -14.175
  693    HE   ARG  92           HE       ARG  92   4.129   6.659 -14.184
  694   HH11  ARG  92          1HH1      ARG  92   5.213   9.973 -14.448
  695   HH12  ARG  92          2HH1      ARG  92   3.731  10.544 -15.158
  696   HH21  ARG  92          1HH2      ARG  92   2.194   7.381 -15.156
  697   HH22  ARG  92          2HH2      ARG  92   2.022   9.065 -15.572
  698    H    VAL  93           HN       VAL  93   8.217   9.678  -8.897
  699    HA   VAL  93           HA       VAL  93   5.553  10.929  -8.786
  700    HB   VAL  93           HB       VAL  93   6.285  10.270  -6.528
  701   HG11  VAL  93          1HG1      VAL  93   8.217  11.334  -5.481
  702   HG12  VAL  93          2HG1      VAL  93   8.630  12.100  -7.016
  703   HG13  VAL  93          3HG1      VAL  93   8.691  10.343  -6.859
  704   HG21  VAL  93          3HG2      VAL  93   6.321  13.249  -6.990
  705   HG22  VAL  93          1HG2      VAL  93   6.041  12.457  -5.439
  706   HG23  VAL  93          2HG2      VAL  93   4.893  12.242  -6.760
  707    H    GLN  94           HN       GLN  94   5.433  13.033  -9.462
  708    HA   GLN  94           HA       GLN  94   7.895  14.119 -10.643
  709    HB2  GLN  94           2HB      GLN  94   6.049  13.836 -12.207
  710    HB3  GLN  94           1HB      GLN  94   4.990  14.780 -11.168
  711    HG2  GLN  94           2HG      GLN  94   6.410  16.751 -11.538
  712    HG3  GLN  94           1HG      GLN  94   7.420  15.802 -12.622
  713   HE21  GLN  94          1HE2      GLN  94   5.905  18.190 -13.162
  714   HE22  GLN  94          2HE2      GLN  94   4.807  17.782 -14.430
  715    H    LEU  95           HN       LEU  95   8.890  15.669  -9.575
  716    HA   LEU  95           HA       LEU  95   7.322  17.336  -7.733
  717    HB2  LEU  95           2HB      LEU  95  10.294  16.813  -7.860
  718    HB3  LEU  95           1HB      LEU  95   9.534  17.942  -6.755
  719    HG   LEU  95           HG       LEU  95   9.124  14.950  -6.801
  720   HD11  LEU  95          1HD1      LEU  95  10.229  15.029  -4.614
  721   HD12  LEU  95          2HD1      LEU  95  10.504  16.759  -4.824
  722   HD13  LEU  95          3HD1      LEU  95  11.285  15.605  -5.904
  723   HD21  LEU  95          3HD2      LEU  95   7.993  17.007  -4.909
  724   HD22  LEU  95          1HD2      LEU  95   7.755  15.262  -4.831
  725   HD23  LEU  95          2HD2      LEU  95   7.083  16.186  -6.175
  726    H    GLU  96           HN       GLU  96   7.136  19.447  -8.071
  727    HA   GLU  96           HA       GLU  96   8.723  20.676 -10.220
  728    HB2  GLU  96           2HB      GLU  96   6.483  20.051 -11.075
  729    HB3  GLU  96           1HB      GLU  96   5.743  20.999  -9.795
  730    HG2  GLU  96           2HG      GLU  96   6.650  23.029 -10.712
  731    HG3  GLU  96           1HG      GLU  96   7.534  22.117 -11.936
  732    H    GLU  97           HN       GLU  97   9.205  22.869  -9.911
  733    HA   GLU  97           HA       GLU  97   9.263  23.716  -7.170
  734    HB2  GLU  97           2HB      GLU  97  11.054  24.132  -8.941
  735    HB3  GLU  97           1HB      GLU  97   9.994  25.379  -9.581
  736    HG2  GLU  97           2HG      GLU  97  10.074  26.545  -7.427
  737    HG3  GLU  97           1HG      GLU  97  11.165  25.309  -6.807
  738    H    ARG  98           HN       ARG  98   6.658  23.366  -8.184
  739    HA   ARG  98           HA       ARG  98   5.538  25.982  -7.577
  740    HB2  ARG  98           2HB      ARG  98   5.395  25.947  -9.937
  741    HB3  ARG  98           1HB      ARG  98   4.866  24.283  -9.969
  742    HG2  ARG  98           2HG      ARG  98   2.713  24.880  -9.131
  743    HG3  ARG  98           1HG      ARG  98   3.241  26.536  -8.813
  744    HD2  ARG  98           2HD      ARG  98   1.869  26.285 -10.879
  745    HD3  ARG  98           1HD      ARG  98   3.463  26.983 -11.154
  746    HE   ARG  98           HE       ARG  98   3.546  24.168 -11.516
  747   HH11  ARG  98          1HH1      ARG  98   2.435  27.111 -13.082
  748   HH12  ARG  98          2HH1      ARG  98   2.555  26.447 -14.682
  749   HH21  ARG  98          1HH2      ARG  98   3.713  23.314 -13.590
  750   HH22  ARG  98          2HH2      ARG  98   3.243  24.265 -14.975
  751    H    GLN  99           HN       GLN  99   3.616  25.849  -6.469
  752    HA   GLN  99           HA       GLN  99   3.177  23.210  -5.293
  753    HB2  GLN  99           2HB      GLN  99   3.730  25.216  -3.865
  754    HB3  GLN  99           1HB      GLN  99   2.146  25.857  -4.294
  755    HG2  GLN  99           2HG      GLN  99   1.077  23.926  -3.331
  756    HG3  GLN  99           1HG      GLN  99   2.648  23.228  -2.951
  757   HE21  GLN  99          1HE2      GLN  99   2.237  23.128  -0.767
  758   HE22  GLN  99          2HE2      GLN  99   2.193  24.535   0.237
  759    H    THR 100           HN       THR 100   1.329  22.109  -5.513
  760    HA   THR 100           HA       THR 100  -0.799  23.350  -7.103
  761    HB   THR 100           HB       THR 100  -0.452  20.416  -6.507
  762    HG1  THR 100           1HG      THR 100   1.365  21.068  -7.666
  763   HG21  THR 100          3HG2      THR 100  -1.895  20.116  -8.454
  764   HG22  THR 100          1HG2      THR 100  -1.977  21.863  -8.680
  765   HG23  THR 100          2HG2      THR 100  -2.689  21.124  -7.244
  766    H    VAL 101           HN       VAL 101  -0.731  20.768  -4.768
  767    HA   VAL 101           HA       VAL 101  -2.042  21.878  -2.629
  768    HB   VAL 101           HB       VAL 101  -3.917  22.358  -4.173
  769   HG11  VAL 101          1HG1      VAL 101  -4.113  19.364  -4.456
  770   HG12  VAL 101          2HG1      VAL 101  -3.651  20.505  -5.720
  771   HG13  VAL 101          3HG1      VAL 101  -5.286  20.536  -5.060
  772   HG21  VAL 101          3HG2      VAL 101  -4.392  22.024  -1.819
  773   HG22  VAL 101          1HG2      VAL 101  -4.527  20.284  -2.071
  774   HG23  VAL 101          2HG2      VAL 101  -5.706  21.374  -2.799
  775    H    SER 102           HN       SER 102  -2.129  20.400  -1.001
  776    HA   SER 102           HA       SER 102  -2.099  17.558  -1.696
  777    HB2  SER 102           2HB      SER 102   0.254  18.332  -1.301
  778    HB3  SER 102           1HB      SER 102  -0.221  18.809   0.327
  779    HG   SER 102           HG       SER 102   0.729  16.561  -0.215
  780    H    VAL 103           HN       VAL 103  -3.781  16.675  -0.708
  781    HA   VAL 103           HA       VAL 103  -4.527  17.686   1.948
  782    HB   VAL 103           HB       VAL 103  -6.210  18.461   0.434
  783   HG11  VAL 103          1HG1      VAL 103  -6.486  15.616  -0.520
  784   HG12  VAL 103          2HG1      VAL 103  -5.834  16.974  -1.440
  785   HG13  VAL 103          3HG1      VAL 103  -7.536  16.957  -0.978
  786   HG21  VAL 103          3HG2      VAL 103  -8.221  17.369   1.326
  787   HG22  VAL 103          1HG2      VAL 103  -7.020  17.680   2.582
  788   HG23  VAL 103          2HG2      VAL 103  -7.218  16.051   1.935
  789    HA   PRO 104           HA       PRO 104  -4.102  13.301   2.808
  790    HB2  PRO 104           2HB      PRO 104  -2.986  13.716   5.279
  791    HB3  PRO 104           1HB      PRO 104  -2.067  13.663   3.774
  792    HG2  PRO 104           2HG      PRO 104  -2.566  15.920   5.508
  793    HG3  PRO 104           1HG      PRO 104  -1.534  15.839   4.072
  794    HD2  PRO 104           2HD      PRO 104  -4.270  16.883   4.351
  795    HD3  PRO 104           1HD      PRO 104  -3.079  17.175   3.066
  796    H    VAL 105           HN       VAL 105  -6.195  12.665   3.125
  797    HA   VAL 105           HA       VAL 105  -7.488  13.512   5.622
  798    HB   VAL 105           HB       VAL 105  -8.869  13.907   3.670
  799   HG11  VAL 105          1HG1      VAL 105  -7.930  12.267   2.149
  800   HG12  VAL 105          2HG1      VAL 105  -9.681  12.089   2.250
  801   HG13  VAL 105          3HG1      VAL 105  -8.631  10.957   3.101
  802   HG21  VAL 105          3HG2      VAL 105  -9.883  11.584   5.303
  803   HG22  VAL 105          1HG2      VAL 105 -10.882  12.635   4.301
  804   HG23  VAL 105          2HG2      VAL 105 -10.036  13.296   5.699
  805    H    THR 106           HN       THR 106  -7.403  12.182   7.282
  806    HA   THR 106           HA       THR 106  -6.473   9.468   6.904
  807    HB   THR 106           HB       THR 106  -7.132  10.914   9.471
  808    HG1  THR 106           1HG      THR 106  -5.333  11.953   8.995
  809   HG21  THR 106          3HG2      THR 106  -5.741   9.183  10.526
  810   HG22  THR 106          1HG2      THR 106  -5.537   8.400   8.958
  811   HG23  THR 106          2HG2      THR 106  -7.133   8.479   9.705
  812    H    VAL 107           HN       VAL 107  -7.927   8.070   6.285
  813    HA   VAL 107           HA       VAL 107 -10.602   8.065   7.526
  814    HB   VAL 107           HB       VAL 107  -9.724   6.749   4.942
  815   HG11  VAL 107          1HG1      VAL 107 -12.103   6.392   4.550
  816   HG12  VAL 107          2HG1      VAL 107 -12.478   7.122   6.111
  817   HG13  VAL 107          3HG1      VAL 107 -11.583   5.605   6.042
  818   HG21  VAL 107          3HG2      VAL 107 -11.004   8.502   3.814
  819   HG22  VAL 107          1HG2      VAL 107  -9.674   9.179   4.755
  820   HG23  VAL 107          2HG2      VAL 107 -11.326   9.270   5.368
  821    H    GLU 108           HN       GLU 108 -11.331   6.199   8.533
  822    HA   GLU 108           HA       GLU 108  -9.254   4.305   9.255
  823    HB2  GLU 108           2HB      GLU 108 -10.658   5.202  11.028
  824    HB3  GLU 108           1HB      GLU 108 -12.102   4.606  10.220
  825    HG2  GLU 108           2HG      GLU 108 -11.415   2.327  10.574
  826    HG3  GLU 108           1HG      GLU 108  -9.885   2.864  11.266
  827    H    MET 109           HN       MET 109  -8.997   2.404   8.340
  828    HA   MET 109           HA       MET 109 -11.122   1.348   6.606
  829    HB2  MET 109           2HB      MET 109  -8.971   1.782   5.505
  830    HB3  MET 109           1HB      MET 109  -8.151   0.758   6.676
  831    HG2  MET 109           2HG      MET 109  -9.394  -1.176   5.854
  832    HG3  MET 109           1HG      MET 109 -10.213  -0.148   4.679
  833    HE1  MET 109           3HE      MET 109  -7.805  -2.269   2.427
  834    HE2  MET 109           1HE      MET 109  -9.471  -1.757   2.695
  835    HE3  MET 109           2HE      MET 109  -8.674  -2.809   3.865
  836    H    ILE 110           HN       ILE 110 -12.299  -0.214   7.487
  837    HA   ILE 110           HA       ILE 110 -11.310  -1.761   9.729
  838    HB   ILE 110           HB       ILE 110 -13.560  -2.776   9.756
  839   HG12  ILE 110          2HG1      ILE 110 -14.115  -0.920   7.424
  840   HG13  ILE 110          1HG1      ILE 110 -14.007  -2.675   7.330
  841   HG21  ILE 110          1HG2      ILE 110 -13.162  -0.784  11.050
  842   HG22  ILE 110          2HG2      ILE 110 -14.790  -0.729  10.380
  843   HG23  ILE 110          3HG2      ILE 110 -13.504   0.237   9.654
  844   HD11  ILE 110          3HD1      ILE 110 -16.071  -1.113   8.864
  845   HD12  ILE 110          1HD1      ILE 110 -15.961  -2.871   8.783
  846   HD13  ILE 110          2HD1      ILE 110 -16.316  -1.941   7.327
  847    H    ASN 111           HN       ASN 111 -11.861  -4.196   9.671
  848    HA   ASN 111           HA       ASN 111 -10.720  -5.280   7.193
  849    HB2  ASN 111           2HB      ASN 111 -10.975  -6.500   9.951
  850    HB3  ASN 111           1HB      ASN 111 -10.305  -7.332   8.556
  851   HD21  ASN 111          1HD2      ASN 111  -8.289  -6.724   7.770
  852   HD22  ASN 111          2HD2      ASN 111  -7.199  -5.749   8.689
  853    H    LEU 112           HN       LEU 112 -12.356  -5.639   5.797
  854    HA   LEU 112           HA       LEU 112 -14.753  -7.021   6.788
  855    HB2  LEU 112           2HB      LEU 112 -14.695  -4.825   5.311
  856    HB3  LEU 112           1HB      LEU 112 -14.494  -5.970   4.002
  857    HG   LEU 112           HG       LEU 112 -16.837  -5.264   4.290
  858   HD11  LEU 112          1HD1      LEU 112 -16.359  -8.168   4.941
  859   HD12  LEU 112          2HD1      LEU 112 -16.390  -7.453   3.329
  860   HD13  LEU 112          3HD1      LEU 112 -17.858  -7.488   4.307
  861   HD21  LEU 112          3HD2      LEU 112 -18.100  -6.005   6.253
  862   HD22  LEU 112          1HD2      LEU 112 -16.815  -4.880   6.691
  863   HD23  LEU 112          2HD2      LEU 112 -16.610  -6.607   6.978
  864    H    GLU 113           HN       GLU 113 -12.670  -7.035   3.894
  865    HA   GLU 113           HA       GLU 113 -11.679  -8.709   2.731
  866    HB2  GLU 113           2HB      GLU 113 -10.876  -9.684   4.750
  867    HB3  GLU 113           1HB      GLU 113 -12.458 -10.347   5.140
  868    HG2  GLU 113           2HG      GLU 113 -12.273 -11.822   3.160
  869    HG3  GLU 113           1HG      GLU 113 -10.640 -11.208   2.902
  870    H    HIS 114           HN       HIS 114 -12.379  -9.582   0.933
  871    HA   HIS 114           HA       HIS 114 -14.848 -11.188   0.972
  872    HB2  HIS 114           2HB      HIS 114 -13.935  -9.386  -1.287
  873    HB3  HIS 114           1HB      HIS 114 -15.356 -10.422  -1.304
  874    HD1  HIS 114           1HD      HIS 114 -14.420  -7.031  -0.786
  875    HD2  HIS 114           2HD      HIS 114 -17.232  -9.581   0.921
  876    HE1  HIS 114           1HE      HIS 114 -16.106  -5.536   0.334
  877    HE2  HIS 114           2HE      HIS 114 -17.879  -7.089   1.221
  878    H    HIS 115           HN       HIS 115 -13.869 -13.178   1.002
  879    HA   HIS 115           HA       HIS 115 -11.740 -13.647  -0.954
  880    HB2  HIS 115           2HB      HIS 115 -11.345 -15.798   0.256
  881    HB3  HIS 115           1HB      HIS 115 -11.072 -14.362   1.224
  882    HD1  HIS 115           1HD      HIS 115 -13.241 -17.377   0.964
  883    HD2  HIS 115           2HD      HIS 115 -12.829 -14.036   3.391
  884    HE1  HIS 115           1HE      HIS 115 -14.607 -17.863   3.013
  885    HE2  HIS 115           2HE      HIS 115 -14.511 -15.740   4.366
  886    H    HIS 116           HN       HIS 116 -13.005 -13.681  -2.750
  887    HA   HIS 116           HA       HIS 116 -15.094 -15.666  -3.059
  888    HB2  HIS 116           2HB      HIS 116 -15.055 -13.324  -4.115
  889    HB3  HIS 116           1HB      HIS 116 -13.847 -13.961  -5.223
  890    HD1  HIS 116           1HD      HIS 116 -15.055 -14.115  -7.376
  891    HD2  HIS 116           2HD      HIS 116 -17.275 -15.657  -4.217
  892    HE1  HIS 116           1HE      HIS 116 -17.141 -15.069  -8.412
  893    HE2  HIS 116           2HE      HIS 116 -18.569 -15.776  -6.452
  894    H    HIS 117           HN       HIS 117 -12.383 -14.942  -5.209
  895    HA   HIS 117           HA       HIS 117 -11.083 -17.454  -4.626
  896    HB2  HIS 117           2HB      HIS 117 -12.354 -16.876  -7.277
  897    HB3  HIS 117           1HB      HIS 117 -10.806 -17.717  -7.254
  898    HD1  HIS 117           1HD      HIS 117 -14.103 -18.608  -7.677
  899    HD2  HIS 117           2HD      HIS 117 -11.196 -19.902  -4.996
  900    HE1  HIS 117           1HE      HIS 117 -14.862 -20.874  -6.885
  901    HE2  HIS 117           2HE      HIS 117 -13.161 -21.574  -5.162
  902    H    HIS 118           HN       HIS 118  -8.848 -17.408  -5.292
  903    HA   HIS 118           HA       HIS 118  -7.770 -14.988  -6.386
  904    HB2  HIS 118           2HB      HIS 118  -8.416 -14.219  -4.122
  905    HB3  HIS 118           1HB      HIS 118  -7.425 -15.489  -3.419
  906    HD1  HIS 118           1HD      HIS 118  -7.162 -12.214  -5.239
  907    HD2  HIS 118           2HD      HIS 118  -4.724 -14.954  -3.294
  908    HE1  HIS 118           1HE      HIS 118  -4.954 -11.059  -4.946
  909    HE2  HIS 118           2HE      HIS 118  -3.595 -12.635  -3.514
  910    H    HIS 119           HN       HIS 119  -6.159 -15.752  -7.538
  911    HA   HIS 119           HA       HIS 119  -3.992 -17.133  -6.238
  912    HB2  HIS 119           2HB      HIS 119  -5.491 -19.018  -6.905
  913    HB3  HIS 119           1HB      HIS 119  -5.375 -18.480  -8.577
  914    HD1  HIS 119           1HD      HIS 119  -3.496 -19.396  -9.917
  915    HD2  HIS 119           2HD      HIS 119  -2.894 -19.878  -5.830
  916    HE1  HIS 119           1HE      HIS 119  -1.421 -20.803  -9.697
  917    HE2  HIS 119           2HE      HIS 119  -0.986 -20.946  -7.217