*HEADER    ANTIBIOTIC                              06-JUN-16   5L82              
*TITLE     NMR STRUCTURE OF ENTEROCIN K1 IN 50%/50% TFE/WATER                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ENTEROCOCCIN K1;                                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1                                                             
*KEYWDS    STRUCTURE FROM CYANA 2.1, UNKNOWN FUNCTION, ANTIBIOTIC, MEMBRANE      
*KEYWDS   2 INTERACTING, BACTERIOCIN, ENTK1                                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    K.OVCHINNIKOV,P.E.KRISTIANSEN,D.DIEP                                  
*REVDAT   1   17-MAY-17 5L82    0                                                
# Restraints file 1: final.upl
 24 LYS  H      24 LYS  HD2     5.50            #peak     5 #SUP  0.48  #QF  0.48
 19 GLU  H      20 ILE  QD1     4.51            #peak     8 #SUP  0.53  #QF  0.53
 20 ILE  H      20 ILE  QD1     3.63            #peak     9 #SUP  0.94  #QF  0.94
 20 ILE  QG2    24 LYS  H       5.38            #peak    11 #SUP  0.99  #QF  0.75
 24 LYS  H      24 LYS  HD3     5.09            #peak    13 #SUP  0.69  #QF  0.69
 12 VAL  QG2    15 LEU  H       5.50            #peak    14 #SUP  0.86  #QF  0.86
 20 ILE  H      20 ILE  QG2     3.82            #peak    15 #SUP  0.96  #QF  0.96
 20 ILE  H      20 ILE  HG13    3.13            #peak    16 #SUP  0.71  #QF  0.71
 12 VAL  QG1    13 LYS  H       3.52            #peak    20 #SUP  0.98  #QF  0.98
 12 VAL  H      12 VAL  QG2     3.48            #peak    21 #SUP  0.97  #QF  0.97
 11 ILE  QD1    12 VAL  H       3.59            #peak    22 #SUP  0.91  #QF  0.91
 12 VAL  QG2    13 LYS  H       5.09            #peak    23 #SUP  0.99  #QF  0.55
 11 ILE  H      11 ILE  HG13    4.23            #peak    26 #SUP  1.00  #QF  0.70
 26 LYS  HB2    27 HIS  H       2.97            #peak    29 #SUP  0.93  #QF  0.93
 16 THR  QG2    17 GLN  H       3.76            #peak    31 #SUP  0.92  #QF  0.92
 10 THR  QG2    14 LYS  H       3.93            #peak    32 #SUP  0.76  #QF  0.76
  9 GLY  H      12 VAL  QG2     4.60            #peak    33 #SUP  0.94  #QF  0.94
 16 THR  H      16 THR  QG2     3.87            #peak    35 #SUP  0.85  #QF  0.85
 21 ALA  H      21 ALA  QB      3.01            #peak    37 #SUP  0.96  #QF  0.96
 21 ALA  QB     25 ASN  H       4.89            #peak    38 #SUP  0.88  #QF  0.88
 13 LYS  HG3    14 LYS  H       3.48            #peak    41 #SUP  0.84  #QF  0.84
  4 LYS  QD      5 PHE  H       3.77            #peak    48 #SUP  0.98  #QF  0.98
 35 PRO  HB2    36 ARG  H       3.53            #peak    50 #SUP  0.99  #QF  0.98
 13 LYS  H      13 LYS  QB      3.71            #peak    51 #SUP  0.95  #QF  0.26
 35 PRO  HB3    36 ARG  H       3.53            #peak    55 #SUP  0.92  #QF  0.92
 12 VAL  H      12 VAL  HB      3.29            #peak    58 #SUP  0.96  #QF  0.96
 21 ALA  H      24 LYS  QB      5.02            #peak    61 #SUP  0.73  #QF  0.47
 24 LYS  QB     28 GLY  H       5.40            #peak    61 #SUP  0.73  #QF  0.47
 12 VAL  H      15 LEU  HB2     5.50            #peak    62 #SUP  0.98  #QF  0.77
 15 LEU  HB2    17 GLN  H       5.50            #peak    62 #SUP  0.98  #QF  0.77
 30 TYR  H      31 PRO  HG3     4.27            #peak    63 #SUP  0.27  #QF  0.27
 14 LYS  H      15 LEU  HB2     4.47            #peak    64 #SUP  0.79  #QF  0.79
 27 HIS  HB3    28 GLY  H       5.50            #peak    69 #SUP  0.60  #QF  0.60
  6 ASN  HB2     9 GLY  H       4.04            #peak    73 #SUP  0.84  #QF  0.84
 29 TYR  HB3    30 TYR  H       3.75            #peak    77 #SUP  0.70  #QF  0.70
 27 HIS  HB2    28 GLY  H       3.05            #peak    79 #SUP  0.32  #QF  0.32
  3 PHE  H       3 PHE  HB3     3.70            #peak    82 #SUP  0.91  #QF  0.91
  3 PHE  HB2     4 LYS  H       5.50            #peak    86 #SUP  0.74  #QF  0.74
  4 LYS  H       4 LYS  QE      4.60            #peak    87 #SUP  0.85  #QF  0.28
  4 LYS  H       5 PHE  QB      4.91            #peak    87 #SUP  0.85  #QF  0.28
 21 ALA  H      22 TRP  HB2     5.50            #peak    95 #SUP  0.85  #QF  0.85
 11 ILE  H      12 VAL  HA      5.50            #peak    98 #SUP  0.87  #QF  0.87
 11 ILE  HA     14 LYS  H       4.83            #peak   100 #SUP  0.97  #QF  0.76
  8 THR  HA     11 ILE  H       4.27            #peak   107 #SUP  0.99  #QF  0.69
 21 ALA  HA     25 ASN  H       5.17            #peak   114 #SUP  0.96  #QF  0.90
 22 TRP  HA     25 ASN  H       5.43            #peak   114 #SUP  0.96  #QF  0.90
 14 LYS  HA     17 GLN  H       3.55            #peak   116 #SUP  0.82  #QF  0.82
 14 LYS  H      14 LYS  HA      2.88            #peak   118 #SUP  0.91  #QF  0.91
 22 TRP  HA     26 LYS  H       5.50            #peak   120 #SUP  0.48  #QF  0.48
 24 LYS  HA     27 HIS  H       3.69            #peak   121 #SUP  0.57  #QF  0.57
 15 LEU  HA     18 TYR  H       5.50            #peak   122 #SUP  0.87  #QF  0.87
 14 LYS  H      15 LEU  HA      5.45            #peak   123 #SUP  0.81  #QF  0.81
 15 LEU  HA     17 GLN  H       5.42            #peak   133 #SUP  0.91  #QF  0.91
 16 THR  HA     20 ILE  H       5.10            #peak   134 #SUP  1.00  #QF  0.96
 17 GLN  HA     20 ILE  H       5.50            #peak   134 #SUP  1.00  #QF  0.96
 15 LEU  HA     19 GLU  H       5.50            #peak   138 #SUP  0.81  #QF  0.81
 23 PHE  QE     24 LYS  HA      5.50            #peak   155 #SUP  0.95  #QF  0.55
 32 TRP  HB2    34 ILE  H       5.33            #peak   161 #SUP  0.83  #QF  0.83
 22 TRP  HB2    22 TRP  HZ3     5.50            #peak   168 #SUP  0.87  #QF  0.63
 22 TRP  HB2    25 ASN  HD21    5.50            #peak   168 #SUP  0.87  #QF  0.63
 29 TYR  QE     31 PRO  HD2     5.50            #peak   186 #SUP  0.74  #QF  0.74
 22 TRP  HB3    25 ASN  HD21    5.50            #peak   190 #SUP  0.98  #QF  0.98
 32 TRP  H      32 TRP  HE3     5.33            #peak   193 #SUP  0.99  #QF  0.99
 32 TRP  H      32 TRP  HZ3     4.16            #peak   194 #SUP  0.68  #QF  0.68
 33 GLU  H      34 ILE  H       3.28            #peak   241 #SUP  0.71  #QF  0.71
 32 TRP  H      33 GLU  H       5.41            #peak   243 #SUP  0.78  #QF  0.78
 26 LYS  H      27 HIS  H       2.40            #peak   253 #SUP  0.94  #QF  0.94
 16 THR  H      17 GLN  H       2.70            #peak   268 #SUP  0.84  #QF  0.84
 18 TYR  H      19 GLU  H       2.51            #peak   272 #SUP  0.77  #QF  0.77
 24 LYS  H      25 ASN  H       2.70            #peak   274 #SUP  0.88  #QF  0.88
 15 LEU  H      16 THR  H       2.92            #peak   275 #SUP  0.66  #QF  0.57
 21 ALA  H      22 TRP  H       4.41            #peak   277 #SUP  0.88  #QF  0.88
 14 LYS  H      15 LEU  H       2.73            #peak   279 #SUP  0.74  #QF  0.74
  5 PHE  H       6 ASN  H       2.40            #peak   286 #SUP  0.91  #QF  0.91
  9 GLY  H      10 THR  H       3.00            #peak   287 #SUP  0.96  #QF  0.96
 25 ASN  H      26 LYS  H       2.78            #peak   288 #SUP  0.98  #QF  0.98
 11 ILE  H      12 VAL  H       3.00            #peak   289 #SUP  0.78  #QF  0.78
 29 TYR  H      29 TYR  QD      3.00            #peak   310 #SUP  0.97  #QF  0.97
  5 PHE  H       5 PHE  QD      3.28            #peak   314 #SUP  0.83  #QF  0.83
  3 PHE  QD      6 ASN  H       3.28            #peak   315 #SUP  0.74  #QF  0.74
 28 GLY  H      29 TYR  H       2.40            #peak   317 #SUP  0.66  #QF  0.66
 18 TYR  H      18 TYR  QD      2.40            #peak   318 #SUP  0.55  #QF  0.55
 23 PHE  QD     27 HIS  HE1     3.62            #peak   323 #SUP  0.58  #QF  0.58
 22 TRP  H      22 TRP  HE3     5.50            #peak   325 #SUP  0.90  #QF  0.90
 24 LYS  H      26 LYS  H       4.31            #peak   326 #SUP  0.93  #QF  0.93
 19 GLU  H      20 ILE  H       2.55            #peak   330 #SUP  0.99  #QF  0.99
 20 ILE  H      21 ALA  H       2.90            #peak   339 #SUP  0.75  #QF  0.75
 15 LEU  H      17 GLN  H       4.42            #peak   343 #SUP  0.84  #QF  0.84
 22 TRP  H      23 PHE  H       3.04            #peak   349 #SUP  0.77  #QF  0.77
 24 LYS  H      25 ASN  HA      5.24            #peak   386 #SUP  0.89  #QF  0.89
 21 ALA  HA     24 LYS  H       4.82            #peak   389 #SUP  0.99  #QF  0.66
 20 ILE  HA     23 PHE  H       5.50            #peak   393 #SUP  0.99  #QF  0.91
 11 ILE  HA     15 LEU  H       4.31            #peak   394 #SUP  0.74  #QF  0.74
 12 VAL  HA     15 LEU  H       4.63            #peak   395 #SUP  0.89  #QF  0.89
 18 TYR  HA     19 GLU  H       3.56            #peak   396 #SUP  0.90  #QF  0.90
 16 THR  HA     19 GLU  H       3.16            #peak   400 #SUP  0.78  #QF  0.78
  1 MET  HA      2 LYS  H       2.92            #peak   402 #SUP  0.54  #QF  0.54
 16 THR  H      16 THR  HA      2.84            #peak   404 #SUP  0.76  #QF  0.76
 21 ALA  H      21 ALA  HA      2.85            #peak   406 #SUP  0.63  #QF  0.63
 16 THR  H      16 THR  HB      3.03            #peak   411 #SUP  0.85  #QF  0.85
  2 LYS  HA      3 PHE  H       2.55            #peak   412 #SUP  0.53  #QF  0.53
 36 ARG  HA     37 CYS  H       3.48            #peak   415 #SUP  0.83  #QF  0.60
 35 PRO  HA     36 ARG  H       2.70            #peak   417 #SUP  0.85  #QF  0.85
  8 THR  H       8 THR  HB      2.40            #peak   421 #SUP  0.78  #QF  0.78
 17 GLN  H      17 GLN  HA      2.85            #peak   423 #SUP  0.82  #QF  0.82
  8 THR  H       8 THR  HA      2.85            #peak   425 #SUP  0.87  #QF  0.87
  3 PHE  HA      4 LYS  H       3.21            #peak   427 #SUP  0.80  #QF  0.80
  3 PHE  HA      5 PHE  H       4.27            #peak   429 #SUP  0.98  #QF  0.98
 10 THR  H      10 THR  HB      2.68            #peak   434 #SUP  0.49  #QF  0.49
 22 TRP  HA     22 TRP  HE3     4.38            #peak   436 #SUP  0.95  #QF  0.95
  9 GLY  HA3    10 THR  H       2.95            #peak   440 #SUP  0.77  #QF  0.77
  7 PRO  HD2     8 THR  H       2.70            #peak   443 #SUP  0.78  #QF  0.78
 28 GLY  H      28 GLY  HA2     2.46            #peak   447 #SUP  0.26  #QF  0.26
  9 GLY  H       9 GLY  HA3     2.40            #peak   451 #SUP  0.67  #QF  0.67
  9 GLY  H       9 GLY  HA2     2.85            #peak   452 #SUP  0.80  #QF  0.80
 24 LYS  HA     28 GLY  H       2.64            #peak   454 #SUP  0.28  #QF  0.28
 12 VAL  HA     16 THR  H       4.80            #peak   455 #SUP  0.86  #QF  0.86
 23 PHE  QE     27 HIS  HE1     3.72            #peak   459 #SUP  0.72  #QF  0.53
 23 PHE  QE     30 TYR  H       4.26            #peak   459 #SUP  0.72  #QF  0.53
 29 TYR  QD     30 TYR  H       3.75            #peak   460 #SUP  0.81  #QF  0.81
 28 GLY  H      29 TYR  QD      4.33            #peak   462 #SUP  0.72  #QF  0.72
 25 ASN  H      25 ASN  HD21    4.70            #peak   463 #SUP  0.80  #QF  0.80
 23 PHE  H      25 ASN  HD21    5.50            #peak   466 #SUP  1.00  #QF  0.88
 24 LYS  H      29 TYR  H       5.50            #peak   466 #SUP  1.00  #QF  0.88
 22 TRP  HB3    23 PHE  H       5.09            #peak   469 #SUP  1.00  #QF  0.62
 18 TYR  QB     19 GLU  H       5.45            #peak   474 #SUP  0.96  #QF  0.96
 24 LYS  QB     25 ASN  H       2.90            #peak   480 #SUP  0.71  #QF  0.71
 15 LEU  HB2    16 THR  H       3.38            #peak   481 #SUP  0.85  #QF  0.77
 11 ILE  QG2    15 LEU  H       5.50            #peak   492 #SUP  0.99  #QF  0.93
 15 LEU  H      15 LEU  QD2     5.50            #peak   493 #SUP  0.94  #QF  0.92
 17 GLN  H      18 TYR  QB      5.12            #peak   495 #SUP  0.84  #QF  0.84
  3 PHE  H       3 PHE  HB2     2.49            #peak   496 #SUP  0.40  #QF  0.40
  5 PHE  QB      6 ASN  H       2.74            #peak   497 #SUP  0.66  #QF  0.66
  3 PHE  HB3     4 LYS  H       2.86            #peak   499 #SUP  0.88  #QF  0.78
  6 ASN  HB3     8 THR  H       3.26            #peak   499 #SUP  0.88  #QF  0.78
  3 PHE  HB3     6 ASN  H       2.66            #peak   500 #SUP  0.75  #QF  0.75
 28 GLY  H      29 TYR  HB2     4.49            #peak   507 #SUP  0.72  #QF  0.72
  5 PHE  H       5 PHE  QB      3.82            #peak   509 #SUP  0.99  #QF  0.99
 37 CYS  H      37 CYS  QB      2.72            #peak   510 #SUP  0.53  #QF  0.53
  3 PHE  HB3     5 PHE  H       2.95            #peak   512 #SUP  0.91  #QF  0.91
  3 PHE  HB2     5 PHE  H       4.44            #peak   513 #SUP  1.00
 17 GLN  H      17 GLN  HB3     3.29            #peak   517 #SUP  0.90  #QF  0.90
 17 GLN  HB3    18 TYR  H       3.89            #peak   518 #SUP  0.91  #QF  0.91
 19 GLU  HB3    21 ALA  H       5.43            #peak   519 #SUP  0.77  #QF  0.77
 17 GLN  HB2    18 TYR  H       3.89            #peak   523 #SUP  0.93  #QF  0.93
 17 GLN  H      17 GLN  HB2     3.29            #peak   524 #SUP  0.86  #QF  0.86
  7 PRO  HB2     8 THR  H       3.30            #peak   525 #SUP  0.90  #QF  0.90
 12 VAL  HB     13 LYS  H       2.88            #peak   526 #SUP  0.91  #QF  0.91
 11 ILE  H      11 ILE  HB      2.68            #peak   529 #SUP  0.79  #QF  0.79
 14 LYS  H      14 LYS  HB2     2.55            #peak   532 #SUP  0.51  #QF  0.51
 11 ILE  HB     12 VAL  H       2.93            #peak   535 #SUP  0.95  #QF  0.95
 20 ILE  HB     21 ALA  H       3.07            #peak   536 #SUP  0.74  #QF  0.74
  4 LYS  H       4 LYS  QD      2.48            #peak   538 #SUP  0.78  #QF  0.78
  4 LYS  H       4 LYS  HB2     2.85            #peak   539 #SUP  0.90  #QF  0.90
 36 ARG  H      36 ARG  QG      2.72            #peak   541 #SUP  0.59  #QF  0.59
  4 LYS  HB3     5 PHE  H       5.15            #peak   542 #SUP  1.00  #QF  0.99
 11 ILE  H      11 ILE  HG12    3.92            #peak   543 #SUP  0.72  #QF  0.72
  4 LYS  HB2     5 PHE  H       3.22            #peak   544 #SUP  0.97  #QF  0.97
 14 LYS  H      14 LYS  QD      3.44            #peak   546 #SUP  0.78  #QF  0.78
 14 LYS  H      14 LYS  HG2     2.51            #peak   548 #SUP  0.57  #QF  0.57
 13 LYS  HG2    14 LYS  H       2.45            #peak   549 #SUP  0.42  #QF  0.42
  4 LYS  H       4 LYS  HG3     3.20            #peak   556 #SUP  0.91  #QF  0.91
  8 THR  H       8 THR  QG2     2.73            #peak   557 #SUP  0.83  #QF  0.83
  8 THR  QG2     9 GLY  H       3.10            #peak   560 #SUP  0.79  #QF  0.79
 25 ASN  H      26 LYS  HB2     4.88            #peak   561 #SUP  0.76  #QF  0.76
 26 LYS  HB2    27 HIS  HE1     3.37            #peak   563 #SUP  0.32  #QF  0.32
 14 LYS  HB3    16 THR  H       5.39            #peak   564 #SUP  0.72  #QF  0.72
 30 TYR  H      31 PRO  HG2     3.42            #peak   567 #SUP  0.75  #QF  0.75
 33 GLU  H      33 GLU  HG2     3.75            #peak   573 #SUP  0.81  #QF  0.81
 31 PRO  HB2    32 TRP  HE3     3.40            #peak   575 #SUP  0.79  #QF  0.79
 31 PRO  HB3    32 TRP  HE3     4.03            #peak   576 #SUP  0.83  #QF  0.83
 31 PRO  HB2    33 GLU  H       3.50            #peak   578 #SUP  0.39  #QF  0.39
 22 TRP  HZ2    26 LYS  QD      5.50            #peak   579 #SUP  0.98  #QF  0.98
 34 ILE  H      34 ILE  HG12    5.10            #peak   580 #SUP  0.98  #QF  0.85
 34 ILE  H      34 ILE  HB      3.72            #peak   582 #SUP  0.94  #QF  0.94
 23 PHE  QD     24 LYS  QB      3.90            #peak   583 #SUP  0.87  #QF  0.87
 20 ILE  HB     23 PHE  QD      5.50            #peak   586 #SUP  0.63  #QF  0.63
 20 ILE  HG12   23 PHE  QD      5.50            #peak   587 #SUP  0.98  #QF  0.49
 33 GLU  HG2    34 ILE  H       5.50            #peak   587 #SUP  0.98  #QF  0.49
 24 LYS  QB     25 ASN  HD21    4.91            #peak   588 #SUP  0.88  #QF  0.21
 24 LYS  QB     29 TYR  H       5.21            #peak   588 #SUP  0.88  #QF  0.21
 29 TYR  QD     33 GLU  HB2     4.42            #peak   591 #SUP  0.96  #QF  0.71
 15 LEU  HB3    18 TYR  QD      5.23            #peak   592 #SUP  0.70  #QF  0.70
 23 PHE  QE     34 ILE  HG12    3.87            #peak   595 #SUP  0.36  #QF  0.36
 29 TYR  QD     34 ILE  HG12    5.48            #peak   596 #SUP  0.86  #QF  0.86
 29 TYR  QD     31 PRO  HG2     3.43            #peak   597 #SUP  0.53  #QF  0.53
 30 TYR  QD     31 PRO  HG3     4.03            #peak   605 #SUP  0.58  #QF  0.58
 24 LYS  QB     30 TYR  QE      5.50            #peak   606 #SUP  0.92  #QF  0.92
 20 ILE  HG12   30 TYR  QD      4.07            #peak   607 #SUP  0.62  #QF  0.62
 20 ILE  HB     30 TYR  QD      3.84            #peak   608 #SUP  0.85  #QF  0.85
 24 LYS  QE     30 TYR  QE      3.20            #peak   612 #SUP  0.88  #QF  0.88
 30 TYR  QE     31 PRO  HD2     4.59            #peak   619 #SUP  0.72  #QF  0.72
 30 TYR  QD     31 PRO  HD2     3.34            #peak   620 #SUP  0.78  #QF  0.78
 30 TYR  QD     31 PRO  HD3     5.50            #peak   621 #SUP  0.96  #QF  0.53
 32 TRP  HB3    32 TRP  HD1     3.82            #peak   624 #SUP  0.91  #QF  0.91
 23 PHE  HA     23 PHE  QD      4.39            #peak   640 #SUP  0.95  #QF  0.95
 23 PHE  QD     24 LYS  HA      4.31            #peak   642 #SUP  0.92  #QF  0.92
 23 PHE  QD     30 TYR  HA      3.61            #peak   644 #SUP  0.84  #QF  0.84
  5 PHE  HA      5 PHE  QD      2.95            #peak   648 #SUP  0.73  #QF  0.73
 32 TRP  HA     32 TRP  HD1     4.34            #peak   649 #SUP  0.92  #QF  0.92
 18 TYR  HA     18 TYR  QD      3.26            #peak   652 #SUP  0.80  #QF  0.80
 23 PHE  QE     30 TYR  HA      3.00            #peak   653 #SUP  0.50  #QF  0.50
 29 TYR  HA     29 TYR  QD      3.07            #peak   656 #SUP  0.86  #QF  0.86
 29 TYR  HA     30 TYR  QD      3.14            #peak   657 #SUP  0.77  #QF  0.77
 30 TYR  HA     30 TYR  QD      3.60            #peak   658 #SUP  0.89  #QF  0.89
 29 TYR  HA     30 TYR  QE      3.59            #peak   661 #SUP  0.86  #QF  0.86
 27 HIS  HA     29 TYR  QE      5.50            #peak   662 #SUP  0.91  #QF  0.65
 29 TYR  QE     33 GLU  HA      5.50            #peak   662 #SUP  0.91  #QF  0.65
 18 TYR  HA     18 TYR  QE      4.83            #peak   663 #SUP  0.89  #QF  0.89
 15 LEU  HA     18 TYR  QE      5.07            #peak   664 #SUP  0.99  #QF  0.98
 29 TYR  QE     34 ILE  HA      5.32            #peak   664 #SUP  0.99  #QF  0.98
 29 TYR  HA     29 TYR  QE      4.81            #peak   665 #SUP  0.99  #QF  0.99
 32 TRP  HA     34 ILE  H       4.69            #peak   670 #SUP  0.83  #QF  0.83
  6 ASN  HA      8 THR  H       5.50            #peak   673 #SUP  0.93  #QF  0.93
 31 PRO  HD2    33 GLU  H       5.27            #peak   676 #SUP  0.94  #QF  0.83
 32 TRP  HB2    33 GLU  H       5.50            #peak   676 #SUP  0.94  #QF  0.83
 22 TRP  HB3    22 TRP  HE3     4.21            #peak   678 #SUP  0.96  #QF  0.96
 32 TRP  HB3    33 GLU  H       4.31            #peak   679 #SUP  0.70  #QF  0.70
 31 PRO  HG3    32 TRP  H       5.50            #peak   686 #SUP  0.81  #QF  0.81
 10 THR  H      10 THR  QG2     4.08            #peak   735 #SUP  0.95  #QF  0.93
 11 ILE  H      11 ILE  QG2     3.83            #peak   738 #SUP  0.84  #QF  0.84
 11 ILE  H      11 ILE  QD1     5.50            #peak   740 #SUP  0.99  #QF  0.50
 26 LYS  H      26 LYS  HG2     5.50            #peak   740 #SUP  0.99  #QF  0.50
 11 ILE  QG2    12 VAL  H       3.26            #peak   742 #SUP  0.98  #QF  0.98
 15 LEU  HB3    16 THR  H       3.69            #peak   749 #SUP  0.73  #QF  0.73
 22 TRP  HE1    26 LYS  HE3     5.50            #peak   750 #SUP  0.82  #QF  0.82
 22 TRP  HE1    26 LYS  HE2     5.50            #peak   751 #SUP  0.78  #QF  0.78
 32 TRP  HE1    33 GLU  HG2     5.50            #peak   753 #SUP  0.97  #QF  0.97
 32 TRP  HE1    33 GLU  HG3     5.50            #peak   754 #SUP  0.53  #QF  0.53
 34 ILE  H      34 ILE  QG2     5.29            #peak   756 #SUP  0.99  #QF  0.36
 15 LEU  QD2    18 TYR  QD      4.36            #peak   761 #SUP  0.90  #QF  0.90
 23 PHE  QE     34 ILE  QD1     3.56            #peak   762 #SUP  0.54  #QF  0.54
 20 ILE  QG2    30 TYR  QD      2.60            #peak   765 #SUP  0.79  #QF  0.79
 20 ILE  QG2    30 TYR  QE      2.95            #peak   768 #SUP  0.89  #QF  0.89
 24 LYS  HD3    30 TYR  QE      3.07            #peak   769 #SUP  0.61  #QF  0.61
 29 TYR  QE     34 ILE  HG13    5.50            #peak   770 #SUP  0.93  #QF  0.93
 29 TYR  QD     34 ILE  QG2     3.47            #peak   772 #SUP  0.76  #QF  0.76
 15 LEU  QD2    18 TYR  QE      4.41            #peak   775 #SUP  0.76  #QF  0.76
 29 TYR  QE     34 ILE  QG2     4.71            #peak   776 #SUP  0.90  #QF  0.90
 24 LYS  HD2    30 TYR  QE      3.79            #peak   777 #SUP  0.37  #QF  0.37
 29 TYR  QD     34 ILE  HG13    3.54            #peak   778 #SUP  0.78  #QF  0.78
 35 PRO  HA     36 ARG  QD      3.67            #peak   781 #SUP  0.40  #QF  0.40
 31 PRO  HA     32 TRP  HB3     4.64            #peak   785 #SUP  0.37  #QF  0.37
 14 LYS  HG2    14 LYS  QD      2.40            #peak   819 #SUP  0.73  #QF  0.73
 13 LYS  HG2    13 LYS  QD      2.90            #peak   820 #SUP  0.96  #QF  0.92
 19 GLU  HB2    19 GLU  HG3     2.93            #peak   838 #SUP  0.80  #QF  0.80
 20 ILE  HA     22 TRP  HB3     5.13            #peak   846 #SUP  0.91  #QF  0.29
 13 LYS  HA     16 THR  HB      5.50            #peak   858 #SUP  0.93  #QF  0.46
 18 TYR  QD     19 GLU  H       4.08            #peak   859 #SUP  0.99  #QF  0.99
 22 TRP  H      22 TRP  HD1     5.50            #peak   861 #SUP  0.99  #QF  0.99
 22 TRP  HD1    23 PHE  H       4.30            #peak   862 #SUP  0.85  #QF  0.85
 15 LEU  H      18 TYR  QD      5.50            #peak   863 #SUP  1.00  #QF  0.32
 24 LYS  H      25 ASN  HD21    5.50            #peak   863 #SUP  1.00  #QF  0.32
 23 PHE  H      23 PHE  QD      5.50            #peak   864 #SUP  0.99  #QF  0.82
 23 PHE  QD     24 LYS  H       5.50            #peak   864 #SUP  0.99  #QF  0.82
 30 TYR  H      30 TYR  QD      2.77            #peak   866 #SUP  0.68  #QF  0.68
 18 TYR  H      18 TYR  QE      4.68            #peak   870 #SUP  0.43  #QF  0.43
 11 ILE  HA     11 ILE  HG12    3.55            #peak   882 #SUP  0.88  #QF  0.88
 12 VAL  HA     15 LEU  HB3     4.57            #peak   883 #SUP  0.91  #QF  0.91
 14 LYS  HA     14 LYS  HB3     2.90            #peak   894 #SUP  0.96  #QF  0.96
 21 ALA  HA     24 LYS  QB      3.79            #peak   896 #SUP  0.89  #QF  0.89
 33 GLU  HA     33 GLU  HG2     3.56            #peak   914 #SUP  0.99  #QF  0.99
 36 ARG  HA     36 ARG  QG      3.48            #peak   918 #SUP  1.00
 14 LYS  HA     14 LYS  QD      2.66            #peak   926 #SUP  0.77  #QF  0.77
 13 LYS  HA     13 LYS  HG3     3.42            #peak   928 #SUP  0.97  #QF  0.97
 10 THR  HA     10 THR  QG2     3.17            #peak   931 #SUP  0.98  #QF  0.90
 16 THR  HA     16 THR  QG2     3.38            #peak   931 #SUP  0.98  #QF  0.90
 21 ALA  HA     24 LYS  QG      3.55            #peak   933 #SUP  0.59  #QF  0.59
  8 THR  HB     12 VAL  QG2     4.15            #peak   934 #SUP  0.96  #QF  0.96
 24 LYS  HA     24 LYS  QG      2.74            #peak   936 #SUP  0.52  #QF  0.52
 34 ILE  HA     34 ILE  HG13    2.97            #peak   938 #SUP  0.85  #QF  0.85
 27 HIS  HA     34 ILE  QG2     4.99            #peak   942 #SUP  0.52  #QF  0.28
 34 ILE  QG2    36 ARG  HA      5.40            #peak   942 #SUP  0.52  #QF  0.28
 16 THR  HB     20 ILE  QD1     3.56            #peak   943 #SUP  0.76  #QF  0.76
 15 LEU  HA     15 LEU  QD1     3.70            #peak   944 #SUP  0.94  #QF  0.50
 34 ILE  HA     34 ILE  QG2     3.90            #peak   944 #SUP  0.94  #QF  0.50
 15 LEU  HA     15 LEU  QD2     3.73            #peak   945 #SUP  0.81  #QF  0.81
 10 THR  HB     11 ILE  QD1     4.34            #peak   946 #SUP  0.59  #QF  0.59
 24 LYS  HA     24 LYS  HD2     3.00            #peak   950 #SUP  0.85  #QF  0.85
  8 THR  HA     11 ILE  QD1     4.51            #peak   951 #SUP  0.99  #QF  0.92
 23 PHE  HA     26 LYS  HG3     5.50            #peak   952 #SUP  0.98  #QF  0.29
 23 PHE  HA     26 LYS  HG2     4.13            #peak   953 #SUP  0.55  #QF  0.55
 11 ILE  HA     11 ILE  QD1     4.09            #peak   955 #SUP  0.98  #QF  0.91
 11 ILE  HA     15 LEU  QD2     4.27            #peak   955 #SUP  0.98  #QF  0.91
 24 LYS  HD2    28 GLY  HA2     2.95            #peak   957 #SUP  0.43  #QF  0.43
 12 VAL  HA     12 VAL  QG1     2.98            #peak   959 #SUP  0.90  #QF  0.90
 12 VAL  HA     12 VAL  QG2     3.80            #peak   960 #SUP  0.95  #QF  0.95
  8 THR  HA     12 VAL  QG2     3.58            #peak   963 #SUP  0.95  #QF  0.95
 26 LYS  HA     26 LYS  HB3     2.40            #peak   964 #SUP  0.55  #QF  0.55
 20 ILE  HA     20 ILE  QG2     2.76            #peak   965 #SUP  0.82  #QF  0.82
  4 LYS  HA      4 LYS  HG3     2.65            #peak   967 #SUP  0.82  #QF  0.82
 10 THR  QG2    14 LYS  HA      5.25            #peak   968 #SUP  0.95  #QF  0.95
 11 ILE  HA     11 ILE  HG13    3.53            #peak   970 #SUP  0.98  #QF  0.98
 21 ALA  QB     22 TRP  HB3     4.73            #peak   983 #SUP  0.97  #QF  0.97
 18 TYR  QB     21 ALA  QB      4.83            #peak   984 #SUP  0.97  #QF  0.97
 14 LYS  HB2    14 LYS  QE      5.43            #peak   990 #SUP  0.43  #QF  0.43
 13 LYS  QB     13 LYS  QE      5.50            #peak   991 #SUP  1.00  #QF  0.79
 16 THR  QG2    19 GLU  HB3     5.16            #peak   997 #SUP  0.93  #QF  0.93
 11 ILE  QG2    15 LEU  HG      2.62            #peak  1003 #SUP  0.66  #QF  0.66
 11 ILE  HB     12 VAL  QG2     3.38            #peak  1013 #SUP  0.82  #QF  0.82
  8 THR  QG2    12 VAL  QG2     2.41            #peak  1014 #SUP  0.79  #QF  0.79
 14 LYS  HB3    14 LYS  QD      2.72            #peak  1044 #SUP  0.81  #QF  0.35
 14 LYS  HB2    14 LYS  HG2     2.86            #peak  1048 #SUP  0.64  #QF  0.64
 24 LYS  QB     24 LYS  QG      2.47            #peak  1058 #SUP  0.92  #QF  0.89
 34 ILE  HB     34 ILE  HG13    2.70            #peak  1059 #SUP  0.91  #QF  0.91
  7 PRO  HB2    11 ILE  QD1     4.06            #peak  1063 #SUP  0.78  #QF  0.78
 11 ILE  HB     11 ILE  QD1     2.46            #peak  1064 #SUP  0.77  #QF  0.77
 11 ILE  QG2    11 ILE  HG12    2.77            #peak  1068 #SUP  0.88  #QF  0.88
 15 LEU  HB3    15 LEU  QD1     3.24            #peak  1070 #SUP  0.79  #QF  0.25
 34 ILE  QG2    34 ILE  HG12    3.05            #peak  1071 #SUP  0.91  #QF  0.91
 27 HIS  HB2    29 TYR  QD      3.70            #peak  1086 #SUP  0.80  #QF  0.80
 29 TYR  HB3    30 TYR  QD      4.15            #peak  1087 #SUP  0.89  #QF  0.89
 27 HIS  HB2    29 TYR  H       3.67            #peak  1089 #SUP  0.68  #QF  0.68
 27 HIS  HB3    29 TYR  QD      3.88            #peak  1091 #SUP  0.60  #QF  0.60
 29 TYR  QD     33 GLU  HG3     5.30            #peak  1092 #SUP  0.92  #QF  0.92
 22 TRP  HD1    23 PHE  HA      3.49            #peak  1094 #SUP  0.58  #QF  0.58
 22 TRP  HA     22 TRP  HD1     4.23            #peak  1096 #SUP  0.96  #QF  0.96
 22 TRP  HA     25 ASN  HD21    3.22            #peak  1097 #SUP  0.50  #QF  0.50
 15 LEU  HA     18 TYR  QD      3.04            #peak  1098 #SUP  0.62  #QF  0.62
 28 GLY  HA3    29 TYR  QD      3.50            #peak  1099 #SUP  0.70  #QF  0.70
 24 LYS  HA     29 TYR  H       4.07            #peak  1100 #SUP  0.88  #QF  0.88
 29 TYR  QE     34 ILE  HG12    5.50            #peak  1113 #SUP  0.63  #QF  0.63
 24 LYS  HD2    29 TYR  H       3.84            #peak  1116 #SUP  0.71  #QF  0.71
 22 TRP  HZ2    26 LYS  HE3     5.50            #peak  1117 #SUP  0.99  #QF  0.99
 22 TRP  HZ2    26 LYS  HE2     5.50            #peak  1118 #SUP  0.86  #QF  0.86
 34 ILE  HA     34 ILE  HG12    3.42            #peak  1131 #SUP  0.66  #QF  0.66
 10 THR  HA     13 LYS  QD      3.22            #peak  1133 #SUP  0.80  #QF  0.80
 24 LYS  HA     24 LYS  QB      3.02            #peak  1134 #SUP  0.94  #QF  0.94
 13 LYS  HA     13 LYS  QB      2.67            #peak  1135 #SUP  0.85  #QF  0.85
 17 GLN  HA     17 GLN  HG2     3.62            #peak  1138 #SUP  0.99  #QF  0.94
 15 LEU  HA     18 TYR  QB      5.50            #peak  1147 #SUP  0.95  #QF  0.78
 26 LYS  HB2    27 HIS  HD2     5.50            #peak  1155 #SUP  0.89  #QF  0.89
 32 TRP  H      34 ILE  HG13    5.50            #peak  1157 #SUP  0.44  #QF  0.44
  7 PRO  HD3     8 THR  H       5.28            #peak  1158 #SUP  0.84  #QF  0.84
  6 ASN  H       7 PRO  HD3     5.06            #peak  1159 #SUP  0.78  #QF  0.78
 21 ALA  H      22 TRP  HB3     5.11            #peak  1161 #SUP  0.92  #QF  0.92
 18 TYR  H      19 GLU  HG2     3.76            #peak  1164 #SUP  0.40  #QF  0.40
 26 LYS  HG2    26 LYS  HE3     4.12            #peak  1167 #SUP  0.85  #QF  0.85
 26 LYS  HG2    26 LYS  HE2     4.12            #peak  1168 #SUP  0.91  #QF  0.91
 33 GLU  HG3    34 ILE  HG13    5.50            #peak  1171 #SUP  0.37  #QF  0.37
 16 THR  QG2    20 ILE  HG12    2.96            #peak  1174 #SUP  0.73  #QF  0.73
 16 THR  QG2    20 ILE  HB      4.28            #peak  1175 #SUP  0.67  #QF  0.67
 10 THR  QG2    13 LYS  QB      4.13            #peak  1176 #SUP  0.68  #QF  0.68
 13 LYS  QB     13 LYS  HG2     2.50            #peak  1179 #SUP  0.92  #QF  0.92
 10 THR  QG2    14 LYS  HG2     2.40            #peak  1180 #SUP  0.27  #QF  0.27
 10 THR  QG2    13 LYS  HG2     3.11            #peak  1181 #SUP  0.54  #QF  0.54
 34 ILE  H      34 ILE  QD1     5.50            #peak  1183 #SUP  1.00  #QF  0.83
 20 ILE  QG2    23 PHE  QD      5.50            #peak  1185 #SUP  1.00  #QF  0.94
 34 ILE  H      34 ILE  HG13    5.50            #peak  1185 #SUP  1.00  #QF  0.94
 23 PHE  QD     26 LYS  HB2     5.50            #peak  1186 #SUP  0.97  #QF  0.84
 20 ILE  QG2    29 TYR  H       5.50            #peak  1187 #SUP  0.77  #QF  0.30
 24 LYS  QG     29 TYR  H       5.50            #peak  1187 #SUP  0.77  #QF  0.30
 24 LYS  HD3    29 TYR  H       5.50            #peak  1188 #SUP  0.44  #QF  0.44
 18 TYR  QD     20 ILE  QD1     5.50            #peak  1189 #SUP  0.64  #QF  0.64
 22 TRP  HD1    26 LYS  HG2     5.50            #peak  1192 #SUP  0.83  #QF  0.53
 29 TYR  QD     34 ILE  QD1     5.50            #peak  1192 #SUP  0.83  #QF  0.53
 20 ILE  QD1    30 TYR  QD      5.50            #peak  1194 #SUP  0.91  #QF  0.91
 24 LYS  HD3    30 TYR  QD      5.50            #peak  1197 #SUP  0.83  #QF  0.62
 30 TYR  QD     31 PRO  HG2     5.50            #peak  1200 #SUP  0.97  #QF  0.97
 21 ALA  QB     25 ASN  HD21    5.50            #peak  1203 #SUP  1.00  #QF  0.98
 29 TYR  H      34 ILE  HG12    5.50            #peak  1203 #SUP  1.00  #QF  0.98
 11 ILE  H      12 VAL  HB      5.14            #peak  1207 #SUP  0.68  #QF  0.68
 33 GLU  H      33 GLU  HG3     5.50            #peak  1209 #SUP  0.55  #QF  0.55
 33 GLU  HB2    34 ILE  H       5.50            #peak  1210 #SUP  1.00  #QF  0.83
 33 GLU  HB3    34 ILE  H       5.50            #peak  1210 #SUP  1.00  #QF  0.83
 31 PRO  HG2    34 ILE  H       5.50            #peak  1212 #SUP  0.81  #QF  0.81
 25 ASN  HB3    26 LYS  H       5.50            #peak  1213 #SUP  0.98  #QF  0.97
 25 ASN  HB2    26 LYS  H       5.50            #peak  1214 #SUP  0.91  #QF  0.76
 21 ALA  QB     25 ASN  HD22    5.50            #peak  1222 #SUP  1.00
 11 ILE  H      12 VAL  QG2     4.56            #peak  1228 #SUP  0.94  #QF  0.94
 14 LYS  H      15 LEU  QD2     3.85            #peak  1229 #SUP  0.68  #QF  0.68
  9 GLY  H      11 ILE  QD1     4.18            #peak  1230 #SUP  0.93  #QF  0.93
 25 ASN  H      26 LYS  HG2     5.50            #peak  1233 #SUP  0.92  #QF  0.87
 15 LEU  QD2    16 THR  H       4.15            #peak  1234 #SUP  0.49  #QF  0.49
 20 ILE  QG2    21 ALA  H       3.89            #peak  1235 #SUP  0.93  #QF  0.93
 26 LYS  HG2    27 HIS  H       4.25            #peak  1237 #SUP  0.72  #QF  0.72
 20 ILE  HA     20 ILE  HG12    3.75            #peak  1258 #SUP  0.90  #QF  0.90
 11 ILE  HA     14 LYS  HB2     3.91            #peak  1260 #SUP  0.87  #QF  0.82
 12 VAL  HA     15 LEU  HB2     3.31            #peak  1262 #SUP  0.83  #QF  0.83
 10 THR  QG2    11 ILE  HA      3.99            #peak  1263 #SUP  0.79  #QF  0.79
 20 ILE  QG2    30 TYR  QB      5.50            #peak  1265 #SUP  0.98  #QF  0.90
 11 ILE  HA     11 ILE  QG2     3.73            #peak  1269 #SUP  0.86  #QF  0.86
 24 LYS  QG     28 GLY  HA2     3.80            #peak  1275 #SUP  0.86  #QF  0.32
  8 THR  QG2     9 GLY  HA2     4.85            #peak  1276 #SUP  0.92  #QF  0.42
 16 THR  QG2    20 ILE  HA      4.05            #peak  1277 #SUP  0.68  #QF  0.68
 10 THR  HA     13 LYS  HG2     3.11            #peak  1281 #SUP  0.79  #QF  0.79
 17 GLN  HA     20 ILE  QD1     2.70            #peak  1282 #SUP  0.76  #QF  0.76
 12 VAL  QG1    13 LYS  HA      3.49            #peak  1283 #SUP  0.98  #QF  0.98
 10 THR  HA     11 ILE  QD1     4.99            #peak  1284 #SUP  0.84  #QF  0.84
  8 THR  HA     11 ILE  QG2     4.08            #peak  1286 #SUP  0.94  #QF  0.94
 20 ILE  QG2    21 ALA  HA      5.30            #peak  1288 #SUP  1.00  #QF  0.97
  8 THR  HB     11 ILE  QD1     4.09            #peak  1290 #SUP  0.95  #QF  0.95
 10 THR  HB     11 ILE  HG13    3.69            #peak  1295 #SUP  0.79  #QF  0.79
 24 LYS  HA     24 LYS  HD3     3.80            #peak  1298 #SUP  0.85  #QF  0.85
  9 GLY  HA2    12 VAL  QG1     5.50            #peak  1301 #SUP  0.81  #QF  0.34
 20 ILE  HA     20 ILE  QD1     5.50            #peak  1301 #SUP  0.81  #QF  0.34
 14 LYS  HA     14 LYS  HG2     3.20            #peak  1304 #SUP  0.91  #QF  0.91
 10 THR  HB     11 ILE  QG2     5.39            #peak  1307 #SUP  0.87  #QF  0.87
 18 TYR  HA     21 ALA  QB      3.96            #peak  1310 #SUP  0.53  #QF  0.53
  4 LYS  HA      4 LYS  HG2     4.09            #peak  1323 #SUP  0.72  #QF  0.72
  9 GLY  HA2    11 ILE  QD1     5.44            #peak  1324 #SUP  0.44  #QF  0.44
 33 GLU  H      34 ILE  HG13    4.54            #peak  1328 #SUP  0.57  #QF  0.57
 31 PRO  HG2    32 TRP  HE3     5.14            #peak  1329 #SUP  0.93  #QF  0.93
 31 PRO  HG2    33 GLU  H       4.82            #peak  1330 #SUP  0.81  #QF  0.81
 29 TYR  QD     35 PRO  HG3     4.37            #peak  1331 #SUP  0.35  #QF  0.35
 31 PRO  HD2    34 ILE  HG13    5.50            #peak  1334 #SUP  0.35  #QF  0.35
 15 LEU  QD1    18 TYR  QB      5.50            #peak  1337 #SUP  0.92  #QF  0.85
 31 PRO  HD2    34 ILE  HG12    5.50            #peak  1339 #SUP  0.94  #QF  0.92
 21 ALA  QB     22 TRP  HB2     5.50            #peak  1340 #SUP  0.96  #QF  0.96
 15 LEU  QD1    19 GLU  HG3     5.50            #peak  1354 #SUP  0.65  #QF  0.65
 15 LEU  QD2    18 TYR  QB      5.50            #peak  1355 #SUP  0.89  #QF  0.78
 31 PRO  HD2    34 ILE  QD1     5.50            #peak  1355 #SUP  0.89  #QF  0.78
 27 HIS  HB3    29 TYR  QE      5.50            #peak  1357 #SUP  0.79  #QF  0.79
 14 LYS  HB3    15 LEU  H       5.50            #peak  1362 #SUP  0.98  #QF  0.35
 14 LYS  HB2    15 LEU  H       5.50            #peak  1363 #SUP  0.95  #QF  0.69
 21 ALA  QB     22 TRP  H       5.50            #peak  1364 #SUP  0.99  #QF  0.99
 21 ALA  QB     23 PHE  H       5.50            #peak  1365 #SUP  0.99  #QF  0.83
 21 ALA  QB     24 LYS  H       5.50            #peak  1365 #SUP  0.99  #QF  0.83
 19 GLU  HB2    20 ILE  H       5.50            #peak  1368 #SUP  0.94  #QF  0.94
 19 GLU  HB3    20 ILE  H       5.50            #peak  1370 #SUP  0.98  #QF  0.61
 19 GLU  H      19 GLU  HG3     5.50            #peak  1371 #SUP  0.88  #QF  0.88
 19 GLU  H      19 GLU  HG2     5.50            #peak  1372 #SUP  0.87  #QF  0.87
 22 TRP  HB2    23 PHE  H       5.50            #peak  1375 #SUP  0.93  #QF  0.91
 13 LYS  QB     16 THR  H       5.50            #peak  1380 #SUP  0.71  #QF  0.22
 18 TYR  QB     20 ILE  H       5.50            #peak  1384 #SUP  0.67  #QF  0.67
 10 THR  QG2    11 ILE  H       3.83            #peak  1385 #SUP  0.91  #QF  0.77
 26 LYS  H      26 LYS  QD      4.15            #peak  1385 #SUP  0.91  #QF  0.77
  8 THR  HA     11 ILE  HB      3.51            #peak  1387 #SUP  0.91  #QF  0.91
 16 THR  QG2    20 ILE  QD1     2.92            #peak  1389 #SUP  0.83  #QF  0.83
  6 ASN  HA      7 PRO  QG      5.50            #peak  1392 #SUP  0.71  #QF  0.71
 24 LYS  HD3    29 TYR  HA      5.22            #peak  1394 #SUP  0.88  #QF  0.88
 20 ILE  QG2    30 TYR  HA      3.20            #peak  1395 #SUP  0.79  #QF  0.79
 33 GLU  HA     34 ILE  HG13    4.70            #peak  1397 #SUP  0.75  #QF  0.75
 16 THR  HB     20 ILE  HG13    4.38            #peak  1398 #SUP  0.92  #QF  0.92
  7 PRO  HA     11 ILE  QD1     5.50            #peak  1399 #SUP  0.96  #QF  0.80
 20 ILE  HA     20 ILE  HG13    2.78            #peak  1401 #SUP  0.73  #QF  0.73
 26 LYS  HA     26 LYS  QD      2.64            #peak  1403 #SUP  0.78  #QF  0.78
  4 LYS  HA      4 LYS  HB3     2.55            #peak  1408 #SUP  0.74  #QF  0.74
 31 PRO  HB2    32 TRP  HA      5.50            #peak  1409 #SUP  0.87  #QF  0.87
 17 GLN  HA     20 ILE  HB      4.08            #peak  1412 #SUP  0.84  #QF  0.84
 16 THR  HA     19 GLU  HB3     3.86            #peak  1413 #SUP  0.91  #QF  0.91
 16 THR  HA     19 GLU  HG3     3.57            #peak  1416 #SUP  0.77  #QF  0.77
 25 ASN  HB3    26 LYS  HA      5.50            #peak  1417 #SUP  0.94  #QF  0.75
 26 LYS  HA     26 LYS  HE2     5.50            #peak  1417 #SUP  0.94  #QF  0.75
 24 LYS  QE     29 TYR  HA      5.50            #peak  1423 #SUP  0.98  #QF  0.96
  5 PHE  HA      6 ASN  HB2     5.50            #peak  1424 #SUP  0.33  #QF  0.33
  4 LYS  HA      5 PHE  QB      5.50            #peak  1426 #SUP  0.94  #QF  0.94
 10 THR  HA     13 LYS  QE      5.50            #peak  1427 #SUP  0.99  #QF  0.85
 10 THR  HA     14 LYS  QE      5.50            #peak  1427 #SUP  0.99  #QF  0.85
 13 LYS  HA     13 LYS  QE      5.50            #peak  1427 #SUP  0.99  #QF  0.85
  6 ASN  HB3     8 THR  HA      5.46            #peak  1428 #SUP  0.42  #QF  0.42
  6 ASN  HB3     7 PRO  HD2     5.50            #peak  1429 #SUP  0.96  #QF  0.96
 18 TYR  QB     19 GLU  HA      4.09            #peak  1432 #SUP  0.74  #QF  0.74
 36 ARG  HA     36 ARG  QD      4.41            #peak  1433 #SUP  0.89  #QF  0.89
 32 TRP  HD1    33 GLU  HG2     5.50            #peak  1443 #SUP  1.00  #QF  0.96
 32 TRP  HZ3    33 GLU  HG2     5.50            #peak  1443 #SUP  1.00  #QF  0.96
 24 LYS  QB     30 TYR  QD      5.50            #peak  1444 #SUP  0.99  #QF  0.97
 31 PRO  HG3    32 TRP  HE3     5.50            #peak  1445 #SUP  0.77  #QF  0.77
 29 TYR  H      29 TYR  HB2     3.47            #peak  1447 #SUP  0.87  #QF  0.87
 23 PHE  QE     29 TYR  HB2     5.50            #peak  1448 #SUP  0.36  #QF  0.36
  6 ASN  HB2     7 PRO  HD3     5.50            #peak  1449 #SUP  0.68  #QF  0.68
 17 GLN  HA     17 GLN  HG3     3.62            #peak  1450 #SUP  0.85  #QF  0.85
 16 THR  HA     19 GLU  HG2     4.27            #peak  1451 #SUP  0.61  #QF  0.61
 25 ASN  HB2    26 LYS  HA      5.50            #peak  1452 #SUP  0.54  #QF  0.54
 26 LYS  HA     26 LYS  HE3     5.50            #peak  1453 #SUP  0.77  #QF  0.77
 21 ALA  QB     25 ASN  HB2     5.50            #peak  1457 #SUP  0.90  #QF  0.90
 20 ILE  QG2    20 ILE  QD1     2.70            #peak  1460 #SUP  0.85  #QF  0.85
 24 LYS  QE     29 TYR  QE      5.50            #peak  1470 #SUP  0.97  #QF  0.69
 27 HIS  HB2    29 TYR  QE      5.50            #peak  1470 #SUP  0.97  #QF  0.69
 26 LYS  H      26 LYS  HG3     5.50            #peak  1471 #SUP  0.98  #QF  0.98
 16 THR  QG2    18 TYR  H       4.61            #peak  1483 #SUP  0.66  #QF  0.66
 13 LYS  HG2    14 LYS  QE      5.50            #peak  1484 #SUP  0.96  #QF  0.89
 10 THR  QG2    14 LYS  QE      5.50            #peak  1485 #SUP  0.99  #QF  0.25
 13 LYS  QB     13 LYS  HG3     2.66            #peak  1489 #SUP  0.94  #QF  0.38
 14 LYS  HB3    14 LYS  HG3     2.87            #peak  1489 #SUP  0.94  #QF  0.38
 24 LYS  QG     25 ASN  H       3.84            #peak  1494 #SUP  0.64  #QF  0.64
 14 LYS  QD     16 THR  H       5.50            #peak  1498 #SUP  0.57  #QF  0.57
 20 ILE  HA     23 PHE  QD      5.50            #peak  1511 #SUP  0.90  #QF  0.90
 16 THR  QG2    20 ILE  H       4.23            #peak  1513 #SUP  0.96  #QF  0.96
 16 THR  QG2    19 GLU  H       5.50            #peak  1514 #SUP  0.97  #QF  0.97
  5 PHE  QB      6 ASN  HA      5.50            #peak  1518 #SUP  0.85  #QF  0.85
 31 PRO  HA     32 TRP  HA      5.50            #peak  1523 #SUP  0.37  #QF  0.37
 11 ILE  HG13   12 VAL  H       5.02            #peak  1535 #SUP  0.99  #QF  0.98
 26 LYS  HB2    28 GLY  H       5.38            #peak  1535 #SUP  0.99  #QF  0.98
  8 THR  QG2    12 VAL  H       4.06            #peak  1536 #SUP  0.83  #QF  0.83
 29 TYR  QE     33 GLU  HB2     5.50            #peak  1542 #SUP  0.99  #QF  0.71
 29 TYR  QE     33 GLU  HB3     5.50            #peak  1542 #SUP  0.99  #QF  0.71
 29 TYR  QE     35 PRO  HG3     5.50            #peak  1543 #SUP  0.87  #QF  0.87
 32 TRP  HZ2    33 GLU  HG2     5.50            #peak  1544 #SUP  0.34  #QF  0.34
 20 ILE  HB     30 TYR  QE      4.48            #peak  1545 #SUP  0.93  #QF  0.93
 25 ASN  HB2    26 LYS  HG2     4.21            #peak  1547 #SUP  0.72  #QF  0.24
 29 TYR  HB3    34 ILE  QD1     4.64            #peak  1547 #SUP  0.72  #QF  0.24
 29 TYR  HB2    34 ILE  QD1     5.50            #peak  1548 #SUP  0.85  #QF  0.85
 15 LEU  QD1    19 GLU  HG2     4.49            #peak  1550 #SUP  0.33  #QF  0.33
 27 HIS  H      28 GLY  H       2.40            #peak  1553 #SUP  0.78  #QF  0.78
 22 TRP  HE1    26 LYS  HG3     5.50            #peak  1560 #SUP  0.84  #QF  0.84
 22 TRP  HE1    26 LYS  QD      5.50            #peak  1561 #SUP  0.89  #QF  0.89
  2 LYS  H       3 PHE  H       3.15            #peak  1562 #SUP  0.67  #QF  0.67
 20 ILE  QG2    20 ILE  HG12    2.40            #peak  1566 #SUP  0.71  #QF  0.71
  7 PRO  HB3    11 ILE  QD1     4.34            #peak  1568 #SUP  0.95  #QF  0.95
 16 THR  QG2    20 ILE  HG13    3.05            #peak  1572 #SUP  0.67  #QF  0.43
 13 LYS  QB     13 LYS  QD      2.46            #peak  1573 #SUP  0.47  #QF  0.47
 14 LYS  HB2    14 LYS  HG3     2.58            #peak  1574 #SUP  0.48  #QF  0.48
 11 ILE  QG2    15 LEU  QD2     2.49            #peak  1575 #SUP  0.92  #QF  0.55
 34 ILE  QG2    34 ILE  QD1     2.81            #peak  1575 #SUP  0.92  #QF  0.55
 34 ILE  HB     34 ILE  QD1     2.40            #peak  1577 #SUP  0.86  #QF  0.86
 16 THR  HA     19 GLU  HB2     2.88            #peak  1582 #SUP  0.77  #QF  0.77
 10 THR  QG2    13 LYS  QD      2.97            #peak  1592 #SUP  0.80  #QF  0.80
 33 GLU  HB3    33 GLU  HG2     2.54            #peak  1594 #SUP  0.78  #QF  0.78
 24 LYS  QB     24 LYS  HD3     2.93            #peak  1597 #SUP  0.90  #QF  0.90
  3 PHE  HA      3 PHE  QD      5.12            #peak  1604 #SUP  0.98  #QF  0.98
  7 PRO  QG      8 THR  H       2.40            #peak  1607 #SUP  0.71  #QF  0.71
 16 THR  HB     17 GLN  H       3.00            #peak  1613 #SUP  0.75  #QF  0.75
  4 LYS  H       5 PHE  H       2.40            #peak  1614 #SUP  0.93  #QF  0.93
 17 GLN  H      18 TYR  H       2.85            #peak  1622 #SUP  0.67  #QF  0.67
 12 VAL  H      13 LYS  H       2.85            #peak  1623 #SUP  0.92  #QF  0.92
 12 VAL  QG1    16 THR  H       5.15            #peak  1631 #SUP  0.78  #QF  0.78
 20 ILE  H      21 ALA  QB      5.20            #peak  1633 #SUP  0.99  #QF  0.99
  8 THR  H      11 ILE  QD1     3.75            #peak  1634 #SUP  0.48  #QF  0.48
 23 PHE  HA     26 LYS  HB2     3.15            #peak  1642 #SUP  0.47  #QF  0.47
 24 LYS  H      26 LYS  HB2     5.50            #peak  1643 #SUP  0.99  #QF  0.87
 29 TYR  HB3    33 GLU  HB2     4.76            #peak  1645 #SUP  0.58  #QF  0.58
 36 ARG  QD     36 ARG  HE      2.54            #peak  1646 #SUP  0.78  #QF  0.78
 35 PRO  HG2    36 ARG  H       3.98            #peak  1648 #SUP  0.94  #QF  0.94
 13 LYS  HA     14 LYS  HA      5.21            #peak  1652 #SUP  0.94  #QF  0.75
 21 ALA  HA     24 LYS  HA      5.50            #peak  1652 #SUP  0.94  #QF  0.75
  6 ASN  HB2     8 THR  HB      5.50            #peak  1654 #SUP  0.82  #QF  0.70
 12 VAL  HA     15 LEU  QD2     4.36            #peak  1655 #SUP  0.89  #QF  0.89
  1 MET  QG      2 LYS  H       5.34            #peak  1370
  2 LYS  QG      2 LYS  QD      2.31            #peak  1569
  6 ASN  HB2     6 ASN  QD2     3.52            #peak   613
 14 LYS  HA     17 GLN  QB      3.34            #peak   901
 14 LYS  HA     17 GLN  QG      5.34            #peak  1654
 14 LYS  QD     17 GLN  QE2     5.34            #peak  1332
 14 LYS  QE     17 GLN  QE2     5.34            #peak   694
 16 THR  H      17 GLN  QB      5.34            #peak    70
 16 THR  QG2    17 GLN  QG      5.34            #peak  1170
 17 GLN  H      17 GLN  QB      2.72            #peak   524
 17 GLN  H      17 GLN  QG      5.15            #peak   504
 17 GLN  HA     17 GLN  QB      2.54            #peak  1137
 17 GLN  HA     17 GLN  QG      3.04            #peak  1138
 17 GLN  HA     17 GLN  QE2     5.34            #peak   155
 17 GLN  QB     17 GLN  QE2     4.33            #peak  1083
 17 GLN  QB     18 TYR  H       3.29            #peak   518
 17 GLN  QB     18 TYR  QB      5.34            #peak  1454
 17 GLN  QB     18 TYR  QD      4.70            #peak  1082
 17 GLN  QG     17 GLN  QE2     3.13            #peak  1090
 17 GLN  QG     20 ILE  QD1     5.04            #peak  1172
 20 ILE  HA     23 PHE  QB      4.17            #peak   786
 20 ILE  QG2    23 PHE  QB      5.34            #peak  1265
 23 PHE  QB     26 LYS  HB2     5.34            #peak  1264
 26 LYS  H      26 LYS  QE      5.34            #peak  1213
 26 LYS  HB2    26 LYS  QE      5.03            #peak   996
 26 LYS  HB3    26 LYS  QE      5.21            #peak   996
 26 LYS  HG2    26 LYS  QE      3.57            #peak  1167
 34 ILE  H      35 PRO  QD      4.88            #peak  1559
 34 ILE  QG2    35 PRO  QD      3.81            #peak  1268
 34 ILE  HG12   35 PRO  QD      5.00            #peak   992
 35 PRO  QB     36 ARG  H       2.71            #peak    55
 36 ARG  H      36 ARG  QB      3.51            #peak    50
 36 ARG  QB     37 CYS  H       2.58            #peak   540
# Restraints file 2: Ent-K1-talosN.aco
   6 ASN   PHI    -103.7   -49.3
   6 ASN   PSI     101.7   169.4
   8 THR   PHI     -79.4   -58.0
   8 THR   PSI     -52.4   -19.8
   9 GLY   PHI     -72.8   -52.8
   9 GLY   PSI     -53.6   -33.6
  10 THR   PHI     -75.4   -55.4
  10 THR   PSI     -50.7   -30.7
  11 ILE   PHI     -74.3   -54.3
  11 ILE   PSI     -55.7   -35.7
  12 VAL   PHI     -74.0   -54.0
  12 VAL   PSI     -50.2   -30.2
  13 LYS   PHI     -76.4   -56.4
  13 LYS   PSI     -47.5   -27.5
  14 LYS   PHI     -78.8   -58.8
  14 LYS   PSI     -47.9   -27.9
  15 LEU   PHI     -73.4   -53.4
  15 LEU   PSI     -52.9   -32.9
  16 THR   PHI     -74.7   -54.7
  16 THR   PSI     -50.6   -29.6
  17 GLN   PHI     -76.0   -56.0
  17 GLN   PSI     -46.2   -21.2
  18 TYR   PHI    -118.1   -39.9
  18 TYR   PSI     -71.7    25.3
  19 GLU   PHI     -72.9   -52.9
  19 GLU   PSI     -49.1   -29.1
  20 ILE   PHI     -73.6   -53.6
  20 ILE   PSI     -54.9   -34.9
  21 ALA   PHI     -74.3   -54.3
  21 ALA   PSI     -50.3   -30.3
  22 TRP   PHI     -72.0   -52.0
  22 TRP   PSI     -55.4   -35.4
  23 PHE   PHI     -75.9   -55.9
  23 PHE   PSI     -50.2   -30.2
  24 LYS   PHI     -75.1   -55.1
  24 LYS   PSI     -48.8   -28.8
  25 ASN   PHI     -79.5   -56.7
  25 ASN   PSI     -48.1    -9.7
  26 LYS   PHI    -109.7   -55.9
  26 LYS   PSI     -30.7    12.3
  28 GLY   PHI      75.4    98.7
  28 GLY   PSI     -15.2    26.9
  29 TYR   PHI    -124.9   -59.3
  29 TYR   PSI      54.8   184.1
  32 TRP   PHI     -88.2   -57.6
  32 TRP   PSI     -35.6     3.5
  34 ILE   PHI    -100.6   -58.6
  34 ILE   PSI     105.5   148.1
# Restraints file 3: test-CHI.aco
#
2	LYS CHI1	-89	-38.2
3	PHE CHI1	-83.8	-49
5	PHE CHI1	-83.8	-50.2
10	THR CHI1	-81.9	-47.1
11	ILE CHI1	-77.2	-55.6
12	VAL CHI1	161.6	190
15	LEU CHI1	-81.8	-54.2
16	THR CHI1	-77.2	-44.8
18	TYR CHI1	-97.3	-48.1
20	ILE CHI1	-77.6	-58.4
22	TRP CHI1	-199.8	-155.4
25	ASN CHI1	-82.1	-59.3
26	LYS CHI1	-83.7	-44.5
27	HIS CHI1	-79.5	-52.3
29	TYR CHI1	-80.9	-49.7
30	TYR CHI1	 -76.1	-41.3
33	GLU CHI1	-76	-47.2
34	ILE CHI1	-72.2	-42.2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    MET   1           H        MET   1   1.808  -0.000   0.855
    2    HA   MET   1           HA       MET   1   2.833  -0.783  -1.175
    3    HB2  MET   1          2HB       MET   1   1.752  -0.230  -3.341
    4    HB3  MET   1          3HB       MET   1   0.773  -1.285  -2.330
    5    HG2  MET   1          2HG       MET   1  -0.003   1.317  -1.672
    6    HG3  MET   1          3HG       MET   1   0.152   1.292  -3.427
    7    HE1  MET   1          1HE       MET   1  -2.666   1.368  -1.198
    8    HE2  MET   1          2HE       MET   1  -2.407   2.076  -2.792
    9    HE3  MET   1          3HE       MET   1  -3.708   0.910  -2.545
   10    H    LYS   2           H        LYS   2   4.458   0.394  -2.059
   11    HA   LYS   2           HA       LYS   2   4.169   3.263  -2.415
   12    HB2  LYS   2          2HB       LYS   2   6.247   2.100  -0.550
   13    HB3  LYS   2          3HB       LYS   2   6.143   3.786  -1.040
   14    HG2  LYS   2          2HG       LYS   2   3.791   3.740  -0.033
   15    HG3  LYS   2          3HG       LYS   2   4.295   2.233   0.734
   16    HD2  LYS   2          2HD       LYS   2   6.299   3.523   1.612
   17    HD3  LYS   2          3HD       LYS   2   5.461   4.985   1.087
   18    HE2  LYS   2          2HE       LYS   2   3.582   4.453   2.528
   19    HE3  LYS   2          3HE       LYS   2   4.347   2.938   3.003
   20    HZ1  LYS   2          1HZ       LYS   2   5.406   4.012   4.601
   21    HZ2  LYS   2          2HZ       LYS   2   4.667   5.465   4.150
   22    HZ3  LYS   2          3HZ       LYS   2   6.153   5.026   3.471
   23    H    PHE   3           H        PHE   3   4.380   1.989  -4.563
   24    HA   PHE   3           HA       PHE   3   7.227   1.687  -5.247
   25    HB2  PHE   3          2HB       PHE   3   4.736   0.397  -6.302
   26    HB3  PHE   3          3HB       PHE   3   6.153   0.529  -7.338
   27    HD1  PHE   3           HD1      PHE   3   7.320  -1.432  -7.476
   28    HD2  PHE   3           HD2      PHE   3   5.578  -0.335  -3.750
   29    HE1  PHE   3           HE1      PHE   3   8.262  -3.457  -6.443
   30    HE2  PHE   3           HE2      PHE   3   6.519  -2.358  -2.711
   31    HZ   PHE   3           HZ       PHE   3   7.863  -3.921  -4.058
   32    H    LYS   4           H        LYS   4   7.768   2.297  -7.533
   33    HA   LYS   4           HA       LYS   4   6.367   4.788  -8.249
   34    HB2  LYS   4          2HB       LYS   4   9.230   4.092  -8.906
   35    HB3  LYS   4          3HB       LYS   4   8.442   5.656  -9.075
   36    HG2  LYS   4          2HG       LYS   4   9.444   6.105  -7.125
   37    HG3  LYS   4          3HG       LYS   4   8.095   5.202  -6.431
   38    HD2  LYS   4          2HD       LYS   4   9.843   4.110  -5.440
   39    HD3  LYS   4          3HD       LYS   4   9.689   3.147  -6.911
   40    HE2  LYS   4          2HE       LYS   4  11.618   3.956  -7.806
   41    HE3  LYS   4          3HE       LYS   4  11.447   5.530  -7.029
   42    HZ1  LYS   4          1HZ       LYS   4  12.700   4.879  -5.332
   43    HZ2  LYS   4          2HZ       LYS   4  13.122   3.523  -6.249
   44    HZ3  LYS   4          3HZ       LYS   4  11.851   3.428  -5.136
   45    H    PHE   5           H        PHE   5   7.584   1.737  -9.385
   46    HA   PHE   5           HA       PHE   5   7.057   2.373 -12.169
   47    HB2  PHE   5          2HB       PHE   5   8.201   0.005 -10.725
   48    HB3  PHE   5          3HB       PHE   5   7.654  -0.157 -12.391
   49    HD1  PHE   5           HD1      PHE   5   9.608   2.369 -10.451
   50    HD2  PHE   5           HD2      PHE   5   9.355  -0.090 -13.916
   51    HE1  PHE   5           HE1      PHE   5  11.761   3.262 -11.238
   52    HE2  PHE   5           HE2      PHE   5  11.508   0.798 -14.708
   53    HZ   PHE   5           HZ       PHE   5  12.715   2.476 -13.368
   54    H    ASN   6           H        ASN   6   5.650   0.505  -9.549
   55    HA   ASN   6           HA       ASN   6   3.800  -1.031 -10.903
   56    HB2  ASN   6          2HB       ASN   6   4.055   0.051  -8.182
   57    HB3  ASN   6          3HB       ASN   6   2.398  -0.297  -8.666
   58   HD21  ASN   6          1HD2      ASN   6   5.512  -1.868  -9.311
   59   HD22  ASN   6          2HD2      ASN   6   5.034  -3.429  -8.747
   60    HA   PRO   7           HA       PRO   7   0.743   1.611 -12.611
   61    HB2  PRO   7          2HB       PRO   7  -1.556   0.261 -12.095
   62    HB3  PRO   7          3HB       PRO   7  -0.374  -0.277 -13.295
   63    HG2  PRO   7          2HG       PRO   7  -0.779  -1.215 -10.481
   64    HG3  PRO   7          3HG       PRO   7  -0.471  -2.168 -11.945
   65    HD2  PRO   7          2HD       PRO   7   1.471  -1.585 -10.151
   66    HD3  PRO   7          3HD       PRO   7   1.796  -1.756 -11.888
   67    H    THR   8           H        THR   8   0.167   0.552  -9.294
   68    HA   THR   8           HA       THR   8  -1.887   2.317  -8.612
   69    HB   THR   8           HB       THR   8  -0.992   0.375  -7.227
   70    HG1  THR   8           HG1      THR   8  -1.335   1.764  -5.207
   71   HG21  THR   8          1HG2      THR   8   0.928   2.491  -6.248
   72   HG22  THR   8          2HG2      THR   8   1.375   1.113  -7.253
   73   HG23  THR   8          3HG2      THR   8   0.756   0.851  -5.623
   74    H    GLY   9           H        GLY   9   1.428   2.919  -9.242
   75    HA2  GLY   9          2HA       GLY   9   2.038   5.096  -7.656
   76    HA3  GLY   9          3HA       GLY   9   2.626   4.879  -9.298
   77    H    THR  10           H        THR  10   0.184   5.053 -10.673
   78    HA   THR  10           HA       THR  10  -0.118   7.901 -10.757
   79    HB   THR  10           HB       THR  10  -1.692   5.783 -12.234
   80    HG1  THR  10           HG1      THR  10  -0.127   6.699 -13.941
   81   HG21  THR  10          1HG2      THR  10  -2.832   7.429 -13.221
   82   HG22  THR  10          2HG2      THR  10  -1.354   8.327 -13.565
   83   HG23  THR  10          3HG2      THR  10  -2.164   8.522 -12.011
   84    H    ILE  11           H        ILE  11  -2.330   5.207 -10.020
   85    HA   ILE  11           HA       ILE  11  -4.596   6.684  -9.416
   86    HB   ILE  11           HB       ILE  11  -3.680   4.106  -8.137
   87   HG12  ILE  11          2HG1      ILE  11  -5.727   3.539  -9.895
   88   HG13  ILE  11          3HG1      ILE  11  -4.830   4.794 -10.743
   89   HG21  ILE  11          1HG2      ILE  11  -6.056   3.763  -7.606
   90   HG22  ILE  11          2HG2      ILE  11  -5.389   5.176  -6.789
   91   HG23  ILE  11          3HG2      ILE  11  -6.412   5.381  -8.211
   92   HD11  ILE  11          1HD1      ILE  11  -2.770   3.309 -10.094
   93   HD12  ILE  11          2HD1      ILE  11  -3.997   2.047  -9.986
   94   HD13  ILE  11          3HD1      ILE  11  -3.767   2.925 -11.497
   95    H    VAL  12           H        VAL  12  -2.137   5.485  -7.126
   96    HA   VAL  12           HA       VAL  12  -3.144   6.632  -4.815
   97    HB   VAL  12           HB       VAL  12  -0.254   6.179  -5.567
   98   HG11  VAL  12          1HG1      VAL  12  -1.498   6.732  -2.876
   99   HG12  VAL  12          2HG1      VAL  12   0.168   6.209  -3.133
  100   HG13  VAL  12          3HG1      VAL  12  -0.374   7.770  -3.752
  101   HG21  VAL  12          1HG2      VAL  12  -1.698   4.446  -3.651
  102   HG22  VAL  12          2HG2      VAL  12  -2.130   4.290  -5.353
  103   HG23  VAL  12          3HG2      VAL  12  -0.462   4.038  -4.841
  104    H    LYS  13           H        LYS  13  -1.328   8.089  -7.418
  105    HA   LYS  13           HA       LYS  13  -0.730  10.513  -6.004
  106    HB2  LYS  13          2HB       LYS  13   0.646  10.860  -7.729
  107    HB3  LYS  13          3HB       LYS  13   0.117   9.316  -8.385
  108    HG2  LYS  13          2HG       LYS  13  -1.655  10.451  -9.628
  109    HG3  LYS  13          3HG       LYS  13  -1.119  12.000  -8.972
  110    HD2  LYS  13          2HD       LYS  13   0.863  10.279 -10.383
  111    HD3  LYS  13          3HD       LYS  13  -0.321  11.169 -11.343
  112    HE2  LYS  13          2HE       LYS  13   0.904  12.800  -9.268
  113    HE3  LYS  13          3HE       LYS  13   2.085  12.140 -10.397
  114    HZ1  LYS  13          1HZ       LYS  13   1.269  13.352 -12.104
  115    HZ2  LYS  13          2HZ       LYS  13   0.781  14.382 -10.855
  116    HZ3  LYS  13          3HZ       LYS  13  -0.327  13.306 -11.545
  117    H    LYS  14           H        LYS  14  -3.269   9.389  -8.145
  118    HA   LYS  14           HA       LYS  14  -4.454  11.981  -8.494
  119    HB2  LYS  14          2HB       LYS  14  -5.492   9.201  -9.065
  120    HB3  LYS  14          3HB       LYS  14  -6.346  10.679  -9.488
  121    HG2  LYS  14          2HG       LYS  14  -3.674   9.774 -10.537
  122    HG3  LYS  14          3HG       LYS  14  -5.201   9.838 -11.421
  123    HD2  LYS  14          2HD       LYS  14  -5.240  12.292 -11.088
  124    HD3  LYS  14          3HD       LYS  14  -3.658  12.183 -10.314
  125    HE2  LYS  14          2HE       LYS  14  -2.907  12.598 -12.399
  126    HE3  LYS  14          3HE       LYS  14  -3.158  10.866 -12.610
  127    HZ1  LYS  14          1HZ       LYS  14  -5.336  11.325 -13.539
  128    HZ2  LYS  14          2HZ       LYS  14  -4.139  12.136 -14.417
  129    HZ3  LYS  14          3HZ       LYS  14  -5.109  12.988 -13.324
  130    H    LEU  15           H        LEU  15  -5.291   9.073  -6.624
  131    HA   LEU  15           HA       LEU  15  -7.617  10.026  -5.430
  132    HB2  LEU  15          2HB       LEU  15  -5.579   7.982  -4.682
  133    HB3  LEU  15          3HB       LEU  15  -6.816   8.428  -3.508
  134    HG   LEU  15           HG       LEU  15  -7.224   6.364  -4.964
  135   HD11  LEU  15          1HD1      LEU  15  -9.436   6.594  -4.572
  136   HD12  LEU  15          2HD1      LEU  15  -9.515   8.192  -5.312
  137   HD13  LEU  15          3HD1      LEU  15  -8.894   8.011  -3.672
  138   HD21  LEU  15          1HD2      LEU  15  -7.889   8.508  -6.979
  139   HD22  LEU  15          2HD2      LEU  15  -8.195   6.780  -7.153
  140   HD23  LEU  15          3HD2      LEU  15  -6.538   7.380  -7.089
  141    H    THR  16           H        THR  16  -4.260  10.601  -4.642
  142    HA   THR  16           HA       THR  16  -4.756  11.765  -2.078
  143    HB   THR  16           HB       THR  16  -2.335  11.986  -3.877
  144    HG1  THR  16           HG1      THR  16  -3.026  10.259  -1.726
  145   HG21  THR  16          1HG2      THR  16  -1.533  12.335  -1.250
  146   HG22  THR  16          2HG2      THR  16  -3.018  13.280  -1.364
  147   HG23  THR  16          3HG2      THR  16  -1.682  13.599  -2.470
  148    H    GLN  17           H        GLN  17  -4.656  12.937  -5.357
  149    HA   GLN  17           HA       GLN  17  -4.234  15.650  -4.960
  150    HB2  GLN  17          2HB       GLN  17  -4.672  14.159  -7.133
  151    HB3  GLN  17          3HB       GLN  17  -6.281  14.846  -6.961
  152    HG2  GLN  17          2HG       GLN  17  -5.607  16.722  -7.907
  153    HG3  GLN  17          3HG       GLN  17  -4.377  16.934  -6.663
  154   HE21  GLN  17          1HE2      GLN  17  -4.831  14.663  -9.355
  155   HE22  GLN  17          2HE2      GLN  17  -3.274  14.921 -10.058
  156    H    TYR  18           H        TYR  18  -7.003  13.706  -4.229
  157    HA   TYR  18           HA       TYR  18  -8.685  16.057  -3.796
  158    HB2  TYR  18          2HB       TYR  18  -9.326  13.107  -3.598
  159    HB3  TYR  18          3HB       TYR  18 -10.487  14.412  -3.379
  160    HD1  TYR  18           HD1      TYR  18  -8.131  12.962  -5.870
  161    HD2  TYR  18           HD2      TYR  18 -11.641  15.276  -5.216
  162    HE1  TYR  18           HE1      TYR  18  -8.574  12.964  -8.290
  163    HE2  TYR  18           HE2      TYR  18 -12.094  15.283  -7.633
  164    HH   TYR  18           HH       TYR  18  -9.838  13.805  -9.930
  165    H    GLU  19           H        GLU  19  -6.889  13.638  -2.063
  166    HA   GLU  19           HA       GLU  19  -8.124  14.066   0.476
  167    HB2  GLU  19          2HB       GLU  19  -5.439  12.860  -0.215
  168    HB3  GLU  19          3HB       GLU  19  -6.198  12.798   1.369
  169    HG2  GLU  19          2HG       GLU  19  -7.494  11.674  -1.094
  170    HG3  GLU  19          3HG       GLU  19  -6.410  10.736  -0.068
  171    H    ILE  20           H        ILE  20  -5.307  15.378  -1.177
  172    HA   ILE  20           HA       ILE  20  -4.053  16.699   0.906
  173    HB   ILE  20           HB       ILE  20  -4.344  17.672  -1.938
  174   HG12  ILE  20          2HG1      ILE  20  -1.850  16.385  -1.007
  175   HG13  ILE  20          3HG1      ILE  20  -3.244  15.319  -1.155
  176   HG21  ILE  20          1HG2      ILE  20  -1.872  18.429  -0.843
  177   HG22  ILE  20          2HG2      ILE  20  -3.223  19.472  -1.283
  178   HG23  ILE  20          3HG2      ILE  20  -3.095  18.842   0.359
  179   HD11  ILE  20          1HD1      ILE  20  -1.555  16.441  -3.201
  180   HD12  ILE  20          2HD1      ILE  20  -2.735  15.134  -3.301
  181   HD13  ILE  20          3HD1      ILE  20  -3.255  16.808  -3.495
  182    H    ALA  21           H        ALA  21  -6.949  17.565  -0.857
  183    HA   ALA  21           HA       ALA  21  -7.223  20.241  -0.253
  184    HB1  ALA  21          1HB       ALA  21  -8.892  18.173  -1.224
  185    HB2  ALA  21          2HB       ALA  21  -9.776  19.020   0.047
  186    HB3  ALA  21          3HB       ALA  21  -9.134  19.917  -1.329
  187    H    TRP  22           H        TRP  22  -8.130  17.449   1.743
  188    HA   TRP  22           HA       TRP  22  -9.372  18.744   3.840
  189    HB2  TRP  22          2HB       TRP  22  -9.346  16.339   3.737
  190    HB3  TRP  22          3HB       TRP  22  -7.591  16.302   3.874
  191    HD1  TRP  22           HD1      TRP  22  -6.553  16.934   6.319
  192    HE1  TRP  22           HE1      TRP  22  -7.558  16.664   8.673
  193    HE3  TRP  22           HE3      TRP  22 -11.474  16.397   5.042
  194    HZ2  TRP  22           HZ2      TRP  22 -10.101  16.273   9.834
  195    HZ3  TRP  22           HZ3      TRP  22 -13.129  16.079   6.835
  196    HH2  TRP  22           HH2      TRP  22 -12.455  16.018   9.180
  197    H    PHE  23           H        PHE  23  -5.906  18.183   3.346
  198    HA   PHE  23           HA       PHE  23  -5.158  19.473   5.794
  199    HB2  PHE  23          2HB       PHE  23  -3.607  17.870   5.089
  200    HB3  PHE  23          3HB       PHE  23  -3.656  18.420   3.417
  201    HD1  PHE  23           HD1      PHE  23  -2.153  20.043   2.627
  202    HD2  PHE  23           HD2      PHE  23  -2.448  19.277   6.803
  203    HE1  PHE  23           HE1      PHE  23  -0.141  21.404   3.015
  204    HE2  PHE  23           HE2      PHE  23  -0.437  20.638   7.198
  205    HZ   PHE  23           HZ       PHE  23   0.719  21.704   5.303
  206    H    LYS  24           H        LYS  24  -5.627  20.448   2.485
  207    HA   LYS  24           HA       LYS  24  -4.191  22.860   2.502
  208    HB2  LYS  24          2HB       LYS  24  -5.039  21.828   0.446
  209    HB3  LYS  24          3HB       LYS  24  -6.692  22.137   0.962
  210    HG2  LYS  24          2HG       LYS  24  -6.415  23.913  -0.414
  211    HG3  LYS  24          3HG       LYS  24  -5.791  24.628   1.075
  212    HD2  LYS  24          2HD       LYS  24  -3.501  23.808   0.318
  213    HD3  LYS  24          3HD       LYS  24  -4.247  23.516  -1.255
  214    HE2  LYS  24          2HE       LYS  24  -4.349  26.174   0.157
  215    HE3  LYS  24          3HE       LYS  24  -3.079  25.736  -0.984
  216    HZ1  LYS  24          1HZ       LYS  24  -4.668  26.896  -2.224
  217    HZ2  LYS  24          2HZ       LYS  24  -5.969  26.082  -1.513
  218    HZ3  LYS  24          3HZ       LYS  24  -4.953  25.270  -2.594
  219    H    ASN  25           H        ASN  25  -7.320  22.006   3.775
  220    HA   ASN  25           HA       ASN  25  -8.183  24.724   4.155
  221    HB2  ASN  25          2HB       ASN  25  -9.258  22.068   5.106
  222    HB3  ASN  25          3HB       ASN  25  -9.997  23.605   5.542
  223   HD21  ASN  25          1HD2      ASN  25 -10.145  21.100   3.447
  224   HD22  ASN  25          2HD2      ASN  25 -10.954  21.866   2.127
  225    H    LYS  26           H        LYS  26  -6.040  22.682   5.743
  226    HA   LYS  26           HA       LYS  26  -6.476  23.866   8.376
  227    HB2  LYS  26          2HB       LYS  26  -4.323  21.895   7.626
  228    HB3  LYS  26          3HB       LYS  26  -4.975  22.233   9.224
  229    HG2  LYS  26          2HG       LYS  26  -6.527  20.962   6.979
  230    HG3  LYS  26          3HG       LYS  26  -5.731  20.079   8.285
  231    HD2  LYS  26          2HD       LYS  26  -7.137  21.163   9.926
  232    HD3  LYS  26          3HD       LYS  26  -7.868  22.174   8.677
  233    HE2  LYS  26          2HE       LYS  26  -8.133  19.485   7.847
  234    HE3  LYS  26          3HE       LYS  26  -8.615  19.557   9.542
  235    HZ1  LYS  26          1HZ       LYS  26 -10.123  20.284   7.352
  236    HZ2  LYS  26          2HZ       LYS  26  -9.699  21.742   8.097
  237    HZ3  LYS  26          3HZ       LYS  26 -10.502  20.544   8.980
  238    H    HIS  27           H        HIS  27  -4.256  23.979   5.684
  239    HA   HIS  27           HA       HIS  27  -2.920  26.262   6.939
  240    HB2  HIS  27          2HB       HIS  27  -1.422  24.012   5.583
  241    HB3  HIS  27          3HB       HIS  27  -0.714  25.462   6.288
  242    HD1  HIS  27           HD1      HIS  27  -2.445  22.263   7.287
  243    HD2  HIS  27           HD2      HIS  27  -0.227  25.334   8.993
  244    HE1  HIS  27           HE1      HIS  27  -1.945  21.508   9.633
  245    H    GLY  28           H        GLY  28  -3.283  24.319   3.984
  246    HA2  GLY  28          2HA       GLY  28  -4.063  25.249   1.934
  247    HA3  GLY  28          3HA       GLY  28  -3.493  26.824   2.466
  248    H    TYR  29           H        TYR  29  -1.504  23.982   2.782
  249    HA   TYR  29           HA       TYR  29   0.133  24.908   0.515
  250    HB2  TYR  29          2HB       TYR  29   0.987  24.124   3.291
  251    HB3  TYR  29          3HB       TYR  29   2.103  24.023   1.933
  252    HD1  TYR  29           HD1      TYR  29  -0.226  26.443   3.567
  253    HD2  TYR  29           HD2      TYR  29   3.401  25.868   1.420
  254    HE1  TYR  29           HE1      TYR  29   0.301  28.831   3.831
  255    HE2  TYR  29           HE2      TYR  29   3.939  28.254   1.679
  256    HH   TYR  29           HH       TYR  29   1.715  30.470   3.342
  257    H    TYR  30           H        TYR  30   2.005  23.001   0.365
  258    HA   TYR  30           HA       TYR  30   0.721  20.387   0.436
  259    HB2  TYR  30          2HB       TYR  30   1.976  21.236  -2.152
  260    HB3  TYR  30          3HB       TYR  30   0.817  19.947  -1.850
  261    HD1  TYR  30           HD1      TYR  30  -1.524  20.349  -1.956
  262    HD2  TYR  30           HD2      TYR  30   1.204  23.608  -2.165
  263    HE1  TYR  30           HE1      TYR  30  -3.361  21.835  -2.640
  264    HE2  TYR  30           HE2      TYR  30  -0.626  25.103  -2.848
  265    HH   TYR  30           HH       TYR  30  -2.997  24.665  -4.079
  266    HA   PRO  31           HA       PRO  31   5.428  19.879  -0.537
  267    HB2  PRO  31          2HB       PRO  31   6.897  22.147  -0.789
  268    HB3  PRO  31          3HB       PRO  31   6.089  21.369  -2.155
  269    HG2  PRO  31          2HG       PRO  31   5.215  23.725  -0.529
  270    HG3  PRO  31          3HG       PRO  31   5.151  23.493  -2.286
  271    HD2  PRO  31          2HD       PRO  31   2.985  23.166  -0.694
  272    HD3  PRO  31          3HD       PRO  31   3.234  22.219  -2.175
  273    H    TRP  32           H        TRP  32   7.631  20.915   0.583
  274    HA   TRP  32           HA       TRP  32   7.015  20.796   3.402
  275    HB2  TRP  32          2HB       TRP  32   9.286  20.389   3.749
  276    HB3  TRP  32          3HB       TRP  32   9.003  19.681   2.161
  277    HD1  TRP  32           HD1      TRP  32  10.973  22.388   3.910
  278    HE1  TRP  32           HE1      TRP  32  12.550  23.520   2.221
  279    HE3  TRP  32           HE3      TRP  32   9.155  20.331  -0.403
  280    HZ2  TRP  32           HZ2      TRP  32  12.968  23.540  -0.571
  281    HZ3  TRP  32           HZ3      TRP  32  10.199  20.960  -2.541
  282    HH2  TRP  32           HH2      TRP  32  12.066  22.531  -2.621
  283    H    GLU  33           H        GLU  33   6.840  23.240   1.308
  284    HA   GLU  33           HA       GLU  33   8.225  25.264   2.857
  285    HB2  GLU  33          2HB       GLU  33   6.359  25.719   0.532
  286    HB3  GLU  33          3HB       GLU  33   7.609  26.797   1.138
  287    HG2  GLU  33          2HG       GLU  33   9.336  25.331   0.357
  288    HG3  GLU  33          3HG       GLU  33   8.150  24.112  -0.104
  289    H    ILE  34           H        ILE  34   6.409  24.044   4.463
  290    HA   ILE  34           HA       ILE  34   4.021  25.729   4.526
  291    HB   ILE  34           HB       ILE  34   4.750  23.361   6.254
  292   HG12  ILE  34          2HG1      ILE  34   2.536  23.313   4.257
  293   HG13  ILE  34          3HG1      ILE  34   4.186  23.175   3.659
  294   HG21  ILE  34          1HG2      ILE  34   2.466  23.426   7.032
  295   HG22  ILE  34          2HG2      ILE  34   3.234  24.985   7.332
  296   HG23  ILE  34          3HG2      ILE  34   2.115  24.799   5.982
  297   HD11  ILE  34          1HD1      ILE  34   3.334  21.423   5.901
  298   HD12  ILE  34          2HD1      ILE  34   2.779  21.055   4.268
  299   HD13  ILE  34          3HD1      ILE  34   4.506  21.130   4.616
  300    HA   PRO  35           HA       PRO  35   5.809  28.398   7.565
  301    HB2  PRO  35          2HB       PRO  35   3.516  29.628   8.340
  302    HB3  PRO  35          3HB       PRO  35   4.325  29.982   6.809
  303    HG2  PRO  35          2HG       PRO  35   1.967  28.217   7.341
  304    HG3  PRO  35          3HG       PRO  35   2.222  29.377   6.024
  305    HD2  PRO  35          2HD       PRO  35   2.570  26.711   5.704
  306    HD3  PRO  35          3HD       PRO  35   3.531  27.913   4.818
  307    H    ARG  36           H        ARG  36   4.860  29.202   9.883
  308    HA   ARG  36           HA       ARG  36   3.706  27.001  11.380
  309    HB2  ARG  36          2HB       ARG  36   5.627  27.128  13.053
  310    HB3  ARG  36          3HB       ARG  36   5.947  26.288  11.542
  311    HG2  ARG  36          2HG       ARG  36   6.597  29.090  11.329
  312    HG3  ARG  36          3HG       ARG  36   7.446  28.330  12.677
  313    HD2  ARG  36          2HD       ARG  36   8.021  26.472  11.000
  314    HD3  ARG  36          3HD       ARG  36   7.531  27.627   9.761
  315    HE   ARG  36           HE       ARG  36   9.373  28.856  11.490
  316   HH11  ARG  36          1HH1      ARG  36   9.224  26.385   9.041
  317   HH12  ARG  36          2HH1      ARG  36  10.869  26.597   8.542
  318   HH21  ARG  36          1HH2      ARG  36  11.541  29.144  10.841
  319   HH22  ARG  36          2HH2      ARG  36  12.187  28.166   9.567
  320    H    CYS  37           H        CYS  37   3.272  27.601  13.647
  321    HA   CYS  37           HA       CYS  37   2.509  30.411  13.792
  322    HB2  CYS  37          2HB       CYS  37   1.055  29.764  15.602
  323    HB3  CYS  37          3HB       CYS  37   0.853  28.609  14.291
  324    HG   CYS  37           HG       CYS  37   0.788  26.855  16.248
  Start of MODEL    2
    1    H    MET   1           H        MET   1   3.298   1.021   1.723
    2    HA   MET   1           HA       MET   1   4.712  -0.261  -0.023
    3    HB2  MET   1          2HB       MET   1   1.902  -1.042  -0.811
    4    HB3  MET   1          3HB       MET   1   3.390  -1.485  -1.638
    5    HG2  MET   1          2HG       MET   1   3.885  -2.442   0.842
    6    HG3  MET   1          3HG       MET   1   2.136  -2.637   0.749
    7    HE1  MET   1          1HE       MET   1   2.064  -3.128  -2.669
    8    HE2  MET   1          2HE       MET   1   1.723  -4.844  -2.440
    9    HE3  MET   1          3HE       MET   1   0.981  -3.648  -1.377
   10    H    LYS   2           H        LYS   2   5.271   1.103  -1.610
   11    HA   LYS   2           HA       LYS   2   3.304   2.806  -2.884
   12    HB2  LYS   2          2HB       LYS   2   5.468   3.878  -1.087
   13    HB3  LYS   2          3HB       LYS   2   4.792   4.847  -2.390
   14    HG2  LYS   2          2HG       LYS   2   2.557   4.587  -1.397
   15    HG3  LYS   2          3HG       LYS   2   3.275   3.675  -0.067
   16    HD2  LYS   2          2HD       LYS   2   4.656   5.633   0.501
   17    HD3  LYS   2          3HD       LYS   2   3.883   6.540  -0.802
   18    HE2  LYS   2          2HE       LYS   2   2.699   7.195   1.092
   19    HE3  LYS   2          3HE       LYS   2   1.677   5.947   0.382
   20    HZ1  LYS   2          1HZ       LYS   2   2.733   6.026   2.954
   21    HZ2  LYS   2          2HZ       LYS   2   3.508   4.753   2.154
   22    HZ3  LYS   2          3HZ       LYS   2   1.819   4.790   2.247
   23    H    PHE   3           H        PHE   3   4.383   1.002  -4.320
   24    HA   PHE   3           HA       PHE   3   6.973   1.305  -5.310
   25    HB2  PHE   3          2HB       PHE   3   4.457   0.101  -6.398
   26    HB3  PHE   3          3HB       PHE   3   5.859   0.259  -7.450
   27    HD1  PHE   3           HD1      PHE   3   5.400  -0.711  -3.874
   28    HD2  PHE   3           HD2      PHE   3   6.929  -1.748  -7.709
   29    HE1  PHE   3           HE1      PHE   3   6.330  -2.787  -2.938
   30    HE2  PHE   3           HE2      PHE   3   7.860  -3.826  -6.779
   31    HZ   PHE   3           HZ       PHE   3   7.561  -4.349  -4.391
   32    H    LYS   4           H        LYS   4   7.528   1.986  -7.574
   33    HA   LYS   4           HA       LYS   4   6.192   4.538  -8.191
   34    HB2  LYS   4          2HB       LYS   4   9.033   3.784  -8.880
   35    HB3  LYS   4          3HB       LYS   4   8.290   5.373  -9.004
   36    HG2  LYS   4          2HG       LYS   4   9.229   5.774  -7.026
   37    HG3  LYS   4          3HG       LYS   4   7.940   4.770  -6.357
   38    HD2  LYS   4          2HD       LYS   4   9.909   3.869  -5.462
   39    HD3  LYS   4          3HD       LYS   4   9.503   2.792  -6.800
   40    HE2  LYS   4          2HE       LYS   4  11.586   3.118  -7.526
   41    HE3  LYS   4          3HE       LYS   4  11.069   4.741  -7.978
   42    HZ1  LYS   4          1HZ       LYS   4  11.998   4.196  -5.236
   43    HZ2  LYS   4          2HZ       LYS   4  11.999   5.655  -6.092
   44    HZ3  LYS   4          3HZ       LYS   4  13.123   4.450  -6.475
   45    H    PHE   5           H        PHE   5   7.348   1.509  -9.458
   46    HA   PHE   5           HA       PHE   5   6.811   2.264 -12.209
   47    HB2  PHE   5          2HB       PHE   5   7.725  -0.334 -10.961
   48    HB3  PHE   5          3HB       PHE   5   7.475  -0.109 -12.690
   49    HD1  PHE   5           HD1      PHE   5   9.757   0.209  -9.979
   50    HD2  PHE   5           HD2      PHE   5   8.832   1.714 -13.851
   51    HE1  PHE   5           HE1      PHE   5  12.057   1.057 -10.194
   52    HE2  PHE   5           HE2      PHE   5  11.130   2.564 -14.073
   53    HZ   PHE   5           HZ       PHE   5  12.746   2.235 -12.244
   54    H    ASN   6           H        ASN   6   5.350   0.387  -9.636
   55    HA   ASN   6           HA       ASN   6   3.474  -1.093 -11.016
   56    HB2  ASN   6          2HB       ASN   6   3.727  -0.029  -8.284
   57    HB3  ASN   6          3HB       ASN   6   2.070  -0.353  -8.786
   58   HD21  ASN   6          1HD2      ASN   6   5.156  -1.971  -9.444
   59   HD22  ASN   6          2HD2      ASN   6   4.656  -3.525  -8.879
   60    HA   PRO   7           HA       PRO   7   0.494   1.637 -12.724
   61    HB2  PRO   7          2HB       PRO   7  -1.840   0.340 -12.237
   62    HB3  PRO   7          3HB       PRO   7  -0.663  -0.218 -13.432
   63    HG2  PRO   7          2HG       PRO   7  -1.112  -1.168 -10.629
   64    HG3  PRO   7          3HG       PRO   7  -0.816  -2.116 -12.098
   65    HD2  PRO   7          2HD       PRO   7   1.127  -1.595 -10.285
   66    HD3  PRO   7          3HD       PRO   7   1.460  -1.761 -12.021
   67    H    THR   8           H        THR   8  -0.129   0.567  -9.420
   68    HA   THR   8           HA       THR   8  -2.145   2.374  -8.737
   69    HB   THR   8           HB       THR   8  -1.306   0.403  -7.362
   70    HG1  THR   8           HG1      THR   8  -2.188   1.324  -5.588
   71   HG21  THR   8          1HG2      THR   8   0.444   0.824  -5.744
   72   HG22  THR   8          2HG2      THR   8   0.657   2.465  -6.354
   73   HG23  THR   8          3HG2      THR   8   1.078   1.085  -7.368
   74    H    GLY   9           H        GLY   9   1.187   2.903  -9.342
   75    HA2  GLY   9          2HA       GLY   9   1.837   5.054  -7.736
   76    HA3  GLY   9          3HA       GLY   9   2.431   4.835  -9.375
   77    H    THR  10           H        THR  10   0.003   5.078 -10.765
   78    HA   THR  10           HA       THR  10  -0.232   7.932 -10.829
   79    HB   THR  10           HB       THR  10  -1.844   5.862 -12.333
   80    HG1  THR  10           HG1      THR  10   0.087   5.581 -13.206
   81   HG21  THR  10          1HG2      THR  10  -2.255   8.611 -12.091
   82   HG22  THR  10          2HG2      THR  10  -2.941   7.541 -13.314
   83   HG23  THR  10          3HG2      THR  10  -1.440   8.408 -13.641
   84    H    ILE  11           H        ILE  11  -2.511   5.284 -10.128
   85    HA   ILE  11           HA       ILE  11  -4.746   6.810  -9.527
   86    HB   ILE  11           HB       ILE  11  -3.900   4.201  -8.263
   87   HG12  ILE  11          2HG1      ILE  11  -5.947   3.695 -10.038
   88   HG13  ILE  11          3HG1      ILE  11  -5.018   4.937 -10.870
   89   HG21  ILE  11          1HG2      ILE  11  -6.600   5.540  -8.344
   90   HG22  ILE  11          2HG2      ILE  11  -6.286   3.911  -7.751
   91   HG23  ILE  11          3HG2      ILE  11  -5.592   5.301  -6.918
   92   HD11  ILE  11          1HD1      ILE  11  -3.990   3.053 -11.634
   93   HD12  ILE  11          2HD1      ILE  11  -2.996   3.399 -10.218
   94   HD13  ILE  11          3HD1      ILE  11  -4.253   2.165 -10.133
   95    H    VAL  12           H        VAL  12  -2.331   5.536  -7.230
   96    HA   VAL  12           HA       VAL  12  -3.327   6.688  -4.917
   97    HB   VAL  12           HB       VAL  12  -0.443   6.173  -5.653
   98   HG11  VAL  12          1HG1      VAL  12  -1.692   6.734  -2.966
   99   HG12  VAL  12          2HG1      VAL  12  -0.037   6.174  -3.217
  100   HG13  VAL  12          3HG1      VAL  12  -0.538   7.752  -3.826
  101   HG21  VAL  12          1HG2      VAL  12  -1.462   4.357  -3.731
  102   HG22  VAL  12          2HG2      VAL  12  -2.618   4.435  -5.061
  103   HG23  VAL  12          3HG2      VAL  12  -0.933   4.024  -5.380
  104    H    LYS  13           H        LYS  13  -1.460   8.122  -7.496
  105    HA   LYS  13           HA       LYS  13  -0.815  10.520  -6.059
  106    HB2  LYS  13          2HB       LYS  13   0.581  10.848  -7.772
  107    HB3  LYS  13          3HB       LYS  13   0.020   9.323  -8.444
  108    HG2  LYS  13          2HG       LYS  13  -1.717  10.508  -9.689
  109    HG3  LYS  13          3HG       LYS  13  -1.149  12.039  -9.017
  110    HD2  LYS  13          2HD       LYS  13   0.710  10.226 -10.517
  111    HD3  LYS  13          3HD       LYS  13  -0.352  11.346 -11.373
  112    HE2  LYS  13          2HE       LYS  13   0.696  13.003  -9.527
  113    HE3  LYS  13          3HE       LYS  13   2.035  11.873  -9.718
  114    HZ1  LYS  13          1HZ       LYS  13   2.589  12.991 -11.531
  115    HZ2  LYS  13          2HZ       LYS  13   1.195  13.945 -11.453
  116    HZ3  LYS  13          3HZ       LYS  13   1.160  12.464 -12.269
  117    H    LYS  14           H        LYS  14  -3.365   9.473  -8.225
  118    HA   LYS  14           HA       LYS  14  -4.487  12.095  -8.560
  119    HB2  LYS  14          2HB       LYS  14  -5.586   9.345  -9.162
  120    HB3  LYS  14          3HB       LYS  14  -6.402  10.846  -9.578
  121    HG2  LYS  14          2HG       LYS  14  -3.745   9.887 -10.617
  122    HG3  LYS  14          3HG       LYS  14  -5.263   9.994 -11.511
  123    HD2  LYS  14          2HD       LYS  14  -5.247  12.445 -11.157
  124    HD3  LYS  14          3HD       LYS  14  -3.673  12.293 -10.373
  125    HE2  LYS  14          2HE       LYS  14  -2.911  12.720 -12.455
  126    HE3  LYS  14          3HE       LYS  14  -3.171  10.989 -12.668
  127    HZ1  LYS  14          1HZ       LYS  14  -4.371  11.673 -14.420
  128    HZ2  LYS  14          2HZ       LYS  14  -4.615  13.229 -13.805
  129    HZ3  LYS  14          3HZ       LYS  14  -5.584  11.949 -13.273
  130    H    LEU  15           H        LEU  15  -5.403   9.192  -6.720
  131    HA   LEU  15           HA       LEU  15  -7.714  10.191  -5.533
  132    HB2  LEU  15          2HB       LEU  15  -5.732   8.091  -4.791
  133    HB3  LEU  15          3HB       LEU  15  -6.966   8.556  -3.622
  134    HG   LEU  15           HG       LEU  15  -7.416   6.516  -5.097
  135   HD11  LEU  15          1HD1      LEU  15  -9.215   8.769  -4.454
  136   HD12  LEU  15          2HD1      LEU  15  -9.287   7.079  -3.958
  137   HD13  LEU  15          3HD1      LEU  15  -9.834   7.550  -5.567
  138   HD21  LEU  15          1HD2      LEU  15  -8.359   6.974  -7.290
  139   HD22  LEU  15          2HD2      LEU  15  -6.685   7.526  -7.209
  140   HD23  LEU  15          3HD2      LEU  15  -8.005   8.691  -7.102
  141    H    THR  16           H        THR  16  -4.350  10.676  -4.719
  142    HA   THR  16           HA       THR  16  -4.837  11.831  -2.147
  143    HB   THR  16           HB       THR  16  -2.395  11.999  -3.924
  144    HG1  THR  16           HG1      THR  16  -1.917  10.109  -3.103
  145   HG21  THR  16          1HG2      THR  16  -1.734  13.600  -2.501
  146   HG22  THR  16          2HG2      THR  16  -1.588  12.313  -1.304
  147   HG23  THR  16          3HG2      THR  16  -3.064  13.275  -1.390
  148    H    GLN  17           H        GLN  17  -4.678  13.024  -5.416
  149    HA   GLN  17           HA       GLN  17  -4.186  15.722  -4.995
  150    HB2  GLN  17          2HB       GLN  17  -4.691  14.230  -7.178
  151    HB3  GLN  17          3HB       GLN  17  -6.242  15.044  -7.019
  152    HG2  GLN  17          2HG       GLN  17  -5.423  16.906  -7.881
  153    HG3  GLN  17          3HG       GLN  17  -4.104  16.929  -6.712
  154   HE21  GLN  17          1HE2      GLN  17  -2.640  17.682  -8.237
  155   HE22  GLN  17          2HE2      GLN  17  -2.016  16.673  -9.492
  156    H    TYR  18           H        TYR  18  -7.012  13.848  -4.302
  157    HA   TYR  18           HA       TYR  18  -8.633  16.241  -3.864
  158    HB2  TYR  18          2HB       TYR  18  -9.357  13.308  -3.692
  159    HB3  TYR  18          3HB       TYR  18 -10.483  14.644  -3.476
  160    HD1  TYR  18           HD1      TYR  18 -11.595  15.552  -5.318
  161    HD2  TYR  18           HD2      TYR  18  -8.148  13.141  -5.954
  162    HE1  TYR  18           HE1      TYR  18 -12.025  15.588  -7.739
  163    HE2  TYR  18           HE2      TYR  18  -8.567  13.170  -8.377
  164    HH   TYR  18           HH       TYR  18  -9.750  14.184 -10.029
  165    H    GLU  19           H        GLU  19  -6.918  13.762  -2.135
  166    HA   GLU  19           HA       GLU  19  -8.162  14.203   0.397
  167    HB2  GLU  19          2HB       GLU  19  -5.505  12.930  -0.282
  168    HB3  GLU  19          3HB       GLU  19  -6.278  12.876   1.296
  169    HG2  GLU  19          2HG       GLU  19  -7.586  11.808  -1.186
  170    HG3  GLU  19          3HG       GLU  19  -6.533  10.833  -0.162
  171    H    ILE  20           H        ILE  20  -5.297  15.452  -1.223
  172    HA   ILE  20           HA       ILE  20  -4.025  16.721   0.880
  173    HB   ILE  20           HB       ILE  20  -4.267  17.725  -1.958
  174   HG12  ILE  20          2HG1      ILE  20  -1.816  16.364  -1.020
  175   HG13  ILE  20          3HG1      ILE  20  -3.237  15.337  -1.186
  176   HG21  ILE  20          1HG2      ILE  20  -3.005  18.841   0.359
  177   HG22  ILE  20          2HG2      ILE  20  -1.785  18.405  -0.837
  178   HG23  ILE  20          3HG2      ILE  20  -3.104  19.489  -1.278
  179   HD11  ILE  20          1HD1      ILE  20  -1.508  16.442  -3.212
  180   HD12  ILE  20          2HD1      ILE  20  -2.704  15.151  -3.326
  181   HD13  ILE  20          3HD1      ILE  20  -3.201  16.833  -3.515
  182    H    ALA  21           H        ALA  21  -6.883  17.679  -0.898
  183    HA   ALA  21           HA       ALA  21  -7.089  20.356  -0.274
  184    HB1  ALA  21          1HB       ALA  21  -9.532  18.653  -0.116
  185    HB2  ALA  21          2HB       ALA  21  -9.300  20.221  -0.889
  186    HB3  ALA  21          3HB       ALA  21  -8.651  18.763  -1.640
  187    H    TRP  22           H        TRP  22  -8.087  17.574   1.692
  188    HA   TRP  22           HA       TRP  22  -9.310  18.886   3.790
  189    HB2  TRP  22          2HB       TRP  22  -9.345  16.480   3.662
  190    HB3  TRP  22          3HB       TRP  22  -7.593  16.398   3.823
  191    HD1  TRP  22           HD1      TRP  22  -6.572  16.961   6.286
  192    HE1  TRP  22           HE1      TRP  22  -7.618  16.707   8.624
  193    HE3  TRP  22           HE3      TRP  22 -11.492  16.615   4.940
  194    HZ2  TRP  22           HZ2      TRP  22 -10.189  16.400   9.748
  195    HZ3  TRP  22           HZ3      TRP  22 -13.182  16.342   6.707
  196    HH2  TRP  22           HH2      TRP  22 -12.542  16.236   9.061
  197    H    PHE  23           H        PHE  23  -5.857  18.235   3.318
  198    HA   PHE  23           HA       PHE  23  -5.093  19.484   5.782
  199    HB2  PHE  23          2HB       PHE  23  -3.581  17.845   5.075
  200    HB3  PHE  23          3HB       PHE  23  -3.601  18.410   3.408
  201    HD1  PHE  23           HD1      PHE  23  -2.050  20.000   2.643
  202    HD2  PHE  23           HD2      PHE  23  -2.397  19.204   6.810
  203    HE1  PHE  23           HE1      PHE  23  -0.005  21.303   3.059
  204    HE2  PHE  23           HE2      PHE  23  -0.353  20.507   7.232
  205    HZ   PHE  23           HZ       PHE  23   0.846  21.559   5.356
  206    H    LYS  24           H        LYS  24  -5.510  20.498   2.478
  207    HA   LYS  24           HA       LYS  24  -4.009  22.870   2.525
  208    HB2  LYS  24          2HB       LYS  24  -4.870  21.879   0.455
  209    HB3  LYS  24          3HB       LYS  24  -6.517  22.228   0.961
  210    HG2  LYS  24          2HG       LYS  24  -6.181  24.007  -0.398
  211    HG3  LYS  24          3HG       LYS  24  -5.550  24.693   1.101
  212    HD2  LYS  24          2HD       LYS  24  -3.277  23.817   0.356
  213    HD3  LYS  24          3HD       LYS  24  -4.018  23.559  -1.225
  214    HE2  LYS  24          2HE       LYS  24  -4.059  26.206   0.208
  215    HE3  LYS  24          3HE       LYS  24  -2.792  25.743  -0.927
  216    HZ1  LYS  24          1HZ       LYS  24  -4.626  27.083  -1.904
  217    HZ2  LYS  24          2HZ       LYS  24  -5.676  25.788  -1.618
  218    HZ3  LYS  24          3HZ       LYS  24  -4.370  25.599  -2.677
  219    H    ASN  25           H        ASN  25  -7.169  22.091   3.769
  220    HA   ASN  25           HA       ASN  25  -7.961  24.829   4.166
  221    HB2  ASN  25          2HB       ASN  25  -9.115  22.193   5.076
  222    HB3  ASN  25          3HB       ASN  25  -9.812  23.743   5.536
  223   HD21  ASN  25          1HD2      ASN  25  -9.814  21.297   3.276
  224   HD22  ASN  25          2HD2      ASN  25 -10.678  22.101   2.014
  225    H    LYS  26           H        LYS  26  -5.887  22.716   5.752
  226    HA   LYS  26           HA       LYS  26  -6.311  23.889   8.391
  227    HB2  LYS  26          2HB       LYS  26  -4.206  21.866   7.639
  228    HB3  LYS  26          3HB       LYS  26  -4.860  22.209   9.236
  229    HG2  LYS  26          2HG       LYS  26  -6.430  20.999   6.970
  230    HG3  LYS  26          3HG       LYS  26  -5.667  20.084   8.272
  231    HD2  LYS  26          2HD       LYS  26  -7.478  22.312   9.031
  232    HD3  LYS  26          3HD       LYS  26  -8.214  20.849   8.373
  233    HE2  LYS  26          2HE       LYS  26  -8.147  20.134  10.502
  234    HE3  LYS  26          3HE       LYS  26  -6.454  19.794  10.146
  235    HZ1  LYS  26          1HZ       LYS  26  -6.784  21.060  12.217
  236    HZ2  LYS  26          2HZ       LYS  26  -7.442  22.335  11.321
  237    HZ3  LYS  26          3HZ       LYS  26  -5.826  21.887  11.094
  238    H    HIS  27           H        HIS  27  -4.068  23.965   5.716
  239    HA   HIS  27           HA       HIS  27  -2.681  26.200   7.002
  240    HB2  HIS  27          2HB       HIS  27  -1.232  23.922   5.638
  241    HB3  HIS  27          3HB       HIS  27  -0.492  25.347   6.361
  242    HD1  HIS  27           HD1      HIS  27  -2.316  22.187   7.318
  243    HD2  HIS  27           HD2      HIS  27  -0.031  25.183   9.070
  244    HE1  HIS  27           HE1      HIS  27  -1.856  21.398   9.661
  245    H    GLY  28           H        GLY  28  -3.073  24.293   4.027
  246    HA2  GLY  28          2HA       GLY  28  -3.811  25.260   1.980
  247    HA3  GLY  28          3HA       GLY  28  -3.203  26.814   2.530
  248    H    TYR  29           H        TYR  29  -1.295  23.917   2.837
  249    HA   TYR  29           HA       TYR  29   0.385  24.816   0.590
  250    HB2  TYR  29          2HB       TYR  29   1.196  23.987   3.366
  251    HB3  TYR  29          3HB       TYR  29   2.318  23.866   2.016
  252    HD1  TYR  29           HD1      TYR  29   0.042  26.336   3.650
  253    HD2  TYR  29           HD2      TYR  29   3.672  25.680   1.530
  254    HE1  TYR  29           HE1      TYR  29   0.632  28.707   3.938
  255    HE2  TYR  29           HE2      TYR  29   4.273  28.048   1.813
  256    HH   TYR  29           HH       TYR  29   2.052  30.335   3.352
  257    H    TYR  30           H        TYR  30   2.205  22.860   0.439
  258    HA   TYR  30           HA       TYR  30   0.850  20.282   0.478
  259    HB2  TYR  30          2HB       TYR  30   2.148  21.117  -2.093
  260    HB3  TYR  30          3HB       TYR  30   0.952  19.857  -1.811
  261    HD1  TYR  30           HD1      TYR  30  -1.375  20.325  -1.932
  262    HD2  TYR  30           HD2      TYR  30   1.441  23.509  -2.093
  263    HE1  TYR  30           HE1      TYR  30  -3.166  21.865  -2.617
  264    HE2  TYR  30           HE2      TYR  30  -0.342  25.059  -2.777
  265    HH   TYR  30           HH       TYR  30  -3.074  24.272  -4.047
  266    HA   PRO  31           HA       PRO  31   5.549  19.653  -0.463
  267    HB2  PRO  31          2HB       PRO  31   7.082  21.883  -0.685
  268    HB3  PRO  31          3HB       PRO  31   6.264  21.138  -2.064
  269    HG2  PRO  31          2HG       PRO  31   5.441  23.504  -0.424
  270    HG3  PRO  31          3HG       PRO  31   5.385  23.288  -2.183
  271    HD2  PRO  31          2HD       PRO  31   3.198  23.007  -0.612
  272    HD3  PRO  31          3HD       PRO  31   3.433  22.065  -2.098
  273    H    TRP  32           H        TRP  32   7.771  20.619   0.683
  274    HA   TRP  32           HA       TRP  32   7.129  20.494   3.496
  275    HB2  TRP  32          2HB       TRP  32   9.386  20.022   3.857
  276    HB3  TRP  32          3HB       TRP  32   9.096  19.335   2.261
  277    HD1  TRP  32           HD1      TRP  32  11.125  21.972   4.047
  278    HE1  TRP  32           HE1      TRP  32  12.746  23.075   2.380
  279    HE3  TRP  32           HE3      TRP  32   9.285  20.002  -0.296
  280    HZ2  TRP  32           HZ2      TRP  32  13.187  23.106  -0.408
  281    HZ3  TRP  32           HZ3      TRP  32  10.363  20.619  -2.421
  282    HH2  TRP  32           HH2      TRP  32  12.273  22.139  -2.473
  283    H    GLU  33           H        GLU  33   7.037  22.959   1.421
  284    HA   GLU  33           HA       GLU  33   8.465  24.932   2.998
  285    HB2  GLU  33          2HB       GLU  33   6.631  25.456   0.662
  286    HB3  GLU  33          3HB       GLU  33   7.904  26.495   1.287
  287    HG2  GLU  33          2HG       GLU  33   9.598  24.988   0.506
  288    HG3  GLU  33          3HG       GLU  33   8.382  23.806   0.026
  289    H    ILE  34           H        ILE  34   6.602  23.747   4.578
  290    HA   ILE  34           HA       ILE  34   4.261  25.497   4.637
  291    HB   ILE  34           HB       ILE  34   4.912  23.097   6.352
  292   HG12  ILE  34          2HG1      ILE  34   2.714  23.125   4.336
  293   HG13  ILE  34          3HG1      ILE  34   4.365  22.946   3.750
  294   HG21  ILE  34          1HG2      ILE  34   3.430  24.754   7.429
  295   HG22  ILE  34          2HG2      ILE  34   2.319  24.608   6.068
  296   HG23  ILE  34          3HG2      ILE  34   2.624  23.219   7.112
  297   HD11  ILE  34          1HD1      ILE  34   3.372  21.199   5.953
  298   HD12  ILE  34          2HD1      ILE  34   2.950  20.847   4.277
  299   HD13  ILE  34          3HD1      ILE  34   4.643  20.901   4.767
  300    HA   PRO  35           HA       PRO  35   6.097  28.092   7.712
  301    HB2  PRO  35          2HB       PRO  35   3.833  29.378   8.479
  302    HB3  PRO  35          3HB       PRO  35   4.664  29.722   6.958
  303    HG2  PRO  35          2HG       PRO  35   2.254  28.018   7.456
  304    HG3  PRO  35          3HG       PRO  35   2.551  29.182   6.152
  305    HD2  PRO  35          2HD       PRO  35   2.829  26.510   5.812
  306    HD3  PRO  35          3HD       PRO  35   3.829  27.692   4.943
  307    H    ARG  36           H        ARG  36   5.134  28.907  10.027
  308    HA   ARG  36           HA       ARG  36   4.712  26.420  11.529
  309    HB2  ARG  36          2HB       ARG  36   5.481  27.790  13.492
  310    HB3  ARG  36          3HB       ARG  36   6.686  27.561  12.232
  311    HG2  ARG  36          2HG       ARG  36   5.020  29.992  12.041
  312    HG3  ARG  36          3HG       ARG  36   6.186  29.923  13.365
  313    HD2  ARG  36          2HD       ARG  36   7.899  30.271  11.984
  314    HD3  ARG  36          3HD       ARG  36   7.345  29.017  10.875
  315    HE   ARG  36           HE       ARG  36   5.774  31.361  10.610
  316   HH11  ARG  36          1HH1      ARG  36   8.892  30.029   9.819
  317   HH12  ARG  36          2HH1      ARG  36   9.105  31.022   8.415
  318   HH21  ARG  36          1HH2      ARG  36   6.043  32.674   8.764
  319   HH22  ARG  36          2HH2      ARG  36   7.485  32.527   7.817
  320    H    CYS  37           H        CYS  37   3.298  26.480  13.409
  321    HA   CYS  37           HA       CYS  37   0.802  27.751  12.785
  322    HB2  CYS  37          2HB       CYS  37   1.752  25.849  14.896
  323    HB3  CYS  37          3HB       CYS  37   0.212  26.675  15.106
  324    HG   CYS  37           HG       CYS  37   0.321  23.901  13.909
  Start of MODEL    3
    1    H    MET   1           H        MET   1   3.164  -1.834  -1.445
    2    HA   MET   1           HA       MET   1   4.056  -0.486   0.154
    3    HB2  MET   1          2HB       MET   1   6.688  -1.585  -0.848
    4    HB3  MET   1          3HB       MET   1   6.426  -0.776   0.691
    5    HG2  MET   1          2HG       MET   1   4.667  -3.062   0.250
    6    HG3  MET   1          3HG       MET   1   6.380  -3.471   0.281
    7    HE1  MET   1          1HE       MET   1   7.960  -2.988   2.037
    8    HE2  MET   1          2HE       MET   1   7.608  -1.361   2.620
    9    HE3  MET   1          3HE       MET   1   7.587  -2.724   3.740
   10    H    LYS   2           H        LYS   2   3.274   1.120  -1.607
   11    HA   LYS   2           HA       LYS   2   3.544   3.098  -2.702
   12    HB2  LYS   2          2HB       LYS   2   6.093   3.399  -1.120
   13    HB3  LYS   2          3HB       LYS   2   5.042   4.672  -1.726
   14    HG2  LYS   2          2HG       LYS   2   4.074   4.709   0.264
   15    HG3  LYS   2          3HG       LYS   2   3.413   3.111  -0.092
   16    HD2  LYS   2          2HD       LYS   2   4.530   2.929   1.992
   17    HD3  LYS   2          3HD       LYS   2   5.572   2.152   0.798
   18    HE2  LYS   2          2HE       LYS   2   7.152   3.422   1.807
   19    HE3  LYS   2          3HE       LYS   2   6.556   4.636   0.675
   20    HZ1  LYS   2          1HZ       LYS   2   5.023   5.378   2.470
   21    HZ2  LYS   2          2HZ       LYS   2   6.660   5.625   2.813
   22    HZ3  LYS   2          3HZ       LYS   2   5.830   4.340   3.535
   23    H    PHE   3           H        PHE   3   4.112   1.402  -4.480
   24    HA   PHE   3           HA       PHE   3   6.844   1.427  -5.384
   25    HB2  PHE   3          2HB       PHE   3   4.278   0.262  -6.394
   26    HB3  PHE   3          3HB       PHE   3   5.653   0.389  -7.486
   27    HD1  PHE   3           HD1      PHE   3   5.280  -0.548  -3.892
   28    HD2  PHE   3           HD2      PHE   3   6.675  -1.641  -7.761
   29    HE1  PHE   3           HE1      PHE   3   6.198  -2.635  -2.967
   30    HE2  PHE   3           HE2      PHE   3   7.595  -3.730  -6.844
   31    HZ   PHE   3           HZ       PHE   3   7.357  -4.230  -4.444
   32    H    LYS   4           H        LYS   4   7.333   2.068  -7.684
   33    HA   LYS   4           HA       LYS   4   6.019   4.635  -8.290
   34    HB2  LYS   4          2HB       LYS   4   8.836   3.888  -9.062
   35    HB3  LYS   4          3HB       LYS   4   8.096   5.483  -9.084
   36    HG2  LYS   4          2HG       LYS   4   9.114   5.789  -7.128
   37    HG3  LYS   4          3HG       LYS   4   7.845   4.762  -6.457
   38    HD2  LYS   4          2HD       LYS   4   9.714   3.684  -5.675
   39    HD3  LYS   4          3HD       LYS   4   9.466   2.829  -7.199
   40    HE2  LYS   4          2HE       LYS   4  11.753   3.332  -7.168
   41    HE3  LYS   4          3HE       LYS   4  11.045   4.555  -8.222
   42    HZ1  LYS   4          1HZ       LYS   4  12.386   4.867  -5.699
   43    HZ2  LYS   4          2HZ       LYS   4  10.922   5.710  -5.780
   44    HZ3  LYS   4          3HZ       LYS   4  12.127   5.996  -6.932
   45    H    PHE   5           H        PHE   5   7.113   1.579  -9.532
   46    HA   PHE   5           HA       PHE   5   6.548   2.316 -12.287
   47    HB2  PHE   5          2HB       PHE   5   7.374  -0.352 -11.122
   48    HB3  PHE   5          3HB       PHE   5   7.305   0.052 -12.834
   49    HD1  PHE   5           HD1      PHE   5   9.312   0.013  -9.899
   50    HD2  PHE   5           HD2      PHE   5   8.815   1.940 -13.662
   51    HE1  PHE   5           HE1      PHE   5  11.642   0.799  -9.801
   52    HE2  PHE   5           HE2      PHE   5  11.144   2.727 -13.570
   53    HZ   PHE   5           HZ       PHE   5  12.561   2.156 -11.639
   54    H    ASN   6           H        ASN   6   5.126   0.479  -9.669
   55    HA   ASN   6           HA       ASN   6   3.231  -1.023 -11.005
   56    HB2  ASN   6          2HB       ASN   6   3.525   0.071  -8.288
   57    HB3  ASN   6          3HB       ASN   6   1.863  -0.267  -8.762
   58   HD21  ASN   6          1HD2      ASN   6   4.911  -1.897  -9.531
   59   HD22  ASN   6          2HD2      ASN   6   4.442  -3.440  -8.910
   60    HA   PRO   7           HA       PRO   7   0.222   1.688 -12.691
   61    HB2  PRO   7          2HB       PRO   7  -2.103   0.394 -12.151
   62    HB3  PRO   7          3HB       PRO   7  -0.945  -0.174 -13.360
   63    HG2  PRO   7          2HG       PRO   7  -1.347  -1.097 -10.541
   64    HG3  PRO   7          3HG       PRO   7  -1.075  -2.060 -12.005
   65    HD2  PRO   7          2HD       PRO   7   0.897  -1.520 -10.231
   66    HD3  PRO   7          3HD       PRO   7   1.201  -1.702 -11.970
   67    H    THR   8           H        THR   8  -0.347   0.650  -9.366
   68    HA   THR   8           HA       THR   8  -2.352   2.463  -8.668
   69    HB   THR   8           HB       THR   8  -1.490   0.505  -7.288
   70    HG1  THR   8           HG1      THR   8  -2.648   1.422  -5.777
   71   HG21  THR   8          1HG2      THR   8   0.489   2.577  -6.332
   72   HG22  THR   8          2HG2      THR   8   0.893   1.187  -7.339
   73   HG23  THR   8          3HG2      THR   8   0.285   0.944  -5.702
   74    H    GLY   9           H        GLY   9   0.970   2.987  -9.332
   75    HA2  GLY   9          2HA       GLY   9   1.645   5.153  -7.758
   76    HA3  GLY   9          3HA       GLY   9   2.212   4.918  -9.405
   77    H    THR  10           H        THR  10  -0.238   5.147 -10.756
   78    HA   THR  10           HA       THR  10  -0.475   8.001 -10.844
   79    HB   THR  10           HB       THR  10  -2.112   5.917 -12.301
   80    HG1  THR  10           HG1      THR  10   0.370   7.157 -12.840
   81   HG21  THR  10          1HG2      THR  10  -2.519   8.667 -12.080
   82   HG22  THR  10          2HG2      THR  10  -3.219   7.588 -13.286
   83   HG23  THR  10          3HG2      THR  10  -1.723   8.452 -13.638
   84    H    ILE  11           H        ILE  11  -2.741   5.360 -10.081
   85    HA   ILE  11           HA       ILE  11  -4.967   6.891  -9.459
   86    HB   ILE  11           HB       ILE  11  -4.099   4.294  -8.183
   87   HG12  ILE  11          2HG1      ILE  11  -6.175   3.771  -9.920
   88   HG13  ILE  11          3HG1      ILE  11  -5.260   5.005 -10.778
   89   HG21  ILE  11          1HG2      ILE  11  -6.477   4.008  -7.629
   90   HG22  ILE  11          2HG2      ILE  11  -5.768   5.405  -6.821
   91   HG23  ILE  11          3HG2      ILE  11  -6.800   5.633  -8.232
   92   HD11  ILE  11          1HD1      ILE  11  -3.227   3.473 -10.145
   93   HD12  ILE  11          2HD1      ILE  11  -4.484   2.240 -10.033
   94   HD13  ILE  11          3HD1      ILE  11  -4.242   3.119 -11.543
   95    H    VAL  12           H        VAL  12  -2.514   5.639  -7.190
   96    HA   VAL  12           HA       VAL  12  -3.472   6.813  -4.871
   97    HB   VAL  12           HB       VAL  12  -0.601   6.293  -5.650
   98   HG11  VAL  12          1HG1      VAL  12  -0.667   7.888  -3.836
   99   HG12  VAL  12          2HG1      VAL  12  -1.805   6.874  -2.946
  100   HG13  VAL  12          3HG1      VAL  12  -0.154   6.317  -3.222
  101   HG21  VAL  12          1HG2      VAL  12  -0.866   4.154  -4.975
  102   HG22  VAL  12          2HG2      VAL  12  -2.009   4.583  -3.702
  103   HG23  VAL  12          3HG2      VAL  12  -2.556   4.461  -5.374
  104    H    LYS  13           H        LYS  13  -1.647   8.223  -7.493
  105    HA   LYS  13           HA       LYS  13  -0.981  10.635  -6.090
  106    HB2  LYS  13          2HB       LYS  13   0.387  10.948  -7.828
  107    HB3  LYS  13          3HB       LYS  13  -0.183   9.415  -8.476
  108    HG2  LYS  13          2HG       LYS  13  -1.941  10.587  -9.704
  109    HG3  LYS  13          3HG       LYS  13  -1.363  12.125  -9.057
  110    HD2  LYS  13          2HD       LYS  13   0.468  10.295 -10.573
  111    HD3  LYS  13          3HD       LYS  13  -0.603  11.416 -11.417
  112    HE2  LYS  13          2HE       LYS  13   0.473  13.286 -10.559
  113    HE3  LYS  13          3HE       LYS  13   1.170  12.388  -9.211
  114    HZ1  LYS  13          1HZ       LYS  13   1.983  12.242 -12.061
  115    HZ2  LYS  13          2HZ       LYS  13   2.569  11.208 -10.858
  116    HZ3  LYS  13          3HZ       LYS  13   2.886  12.867 -10.773
  117    H    LYS  14           H        LYS  14  -3.565   9.566  -8.205
  118    HA   LYS  14           HA       LYS  14  -4.693  12.184  -8.548
  119    HB2  LYS  14          2HB       LYS  14  -5.800   9.427  -9.102
  120    HB3  LYS  14          3HB       LYS  14  -6.625  10.923  -9.520
  121    HG2  LYS  14          2HG       LYS  14  -3.984   9.956 -10.594
  122    HG3  LYS  14          3HG       LYS  14  -5.518  10.051 -11.463
  123    HD2  LYS  14          2HD       LYS  14  -5.500  12.506 -11.135
  124    HD3  LYS  14          3HD       LYS  14  -3.912  12.365 -10.378
  125    HE2  LYS  14          2HE       LYS  14  -3.153  11.237 -12.519
  126    HE3  LYS  14          3HE       LYS  14  -4.676  11.772 -13.227
  127    HZ1  LYS  14          1HZ       LYS  14  -3.422  13.549 -13.766
  128    HZ2  LYS  14          2HZ       LYS  14  -2.322  13.319 -12.502
  129    HZ3  LYS  14          3HZ       LYS  14  -3.816  14.053 -12.200
  130    H    LEU  15           H        LEU  15  -5.578   9.300  -6.662
  131    HA   LEU  15           HA       LEU  15  -7.870  10.308  -5.449
  132    HB2  LEU  15          2HB       LEU  15  -5.869   8.225  -4.712
  133    HB3  LEU  15          3HB       LEU  15  -7.084   8.701  -3.528
  134    HG   LEU  15           HG       LEU  15  -7.548   6.640  -4.976
  135   HD11  LEU  15          1HD1      LEU  15  -9.178   8.447  -3.733
  136   HD12  LEU  15          2HD1      LEU  15  -9.695   6.907  -4.418
  137   HD13  LEU  15          3HD1      LEU  15  -9.855   8.389  -5.361
  138   HD21  LEU  15          1HD2      LEU  15  -8.202   8.795  -6.984
  139   HD22  LEU  15          2HD2      LEU  15  -8.539   7.072  -7.152
  140   HD23  LEU  15          3HD2      LEU  15  -6.871   7.646  -7.111
  141    H    THR  16           H        THR  16  -4.494  10.814  -4.695
  142    HA   THR  16           HA       THR  16  -4.939  11.997  -2.131
  143    HB   THR  16           HB       THR  16  -2.533  12.170  -3.956
  144    HG1  THR  16           HG1      THR  16  -2.071  10.266  -3.170
  145   HG21  THR  16          1HG2      THR  16  -3.161  13.445  -1.409
  146   HG22  THR  16          2HG2      THR  16  -1.865  13.787  -2.555
  147   HG23  THR  16          3HG2      THR  16  -1.671  12.504  -1.361
  148    H    GLN  17           H        GLN  17  -4.852  13.157  -5.415
  149    HA   GLN  17           HA       GLN  17  -4.372  15.862  -5.031
  150    HB2  GLN  17          2HB       GLN  17  -5.009  14.287  -7.175
  151    HB3  GLN  17          3HB       GLN  17  -6.462  15.264  -7.009
  152    HG2  GLN  17          2HG       GLN  17  -5.376  16.741  -8.272
  153    HG3  GLN  17          3HG       GLN  17  -4.515  17.147  -6.788
  154   HE21  GLN  17          1HE2      GLN  17  -4.245  16.033  -9.952
  155   HE22  GLN  17          2HE2      GLN  17  -2.580  15.575  -9.918
  156    H    TYR  18           H        TYR  18  -7.171  13.976  -4.265
  157    HA   TYR  18           HA       TYR  18  -8.800  16.361  -3.820
  158    HB2  TYR  18          2HB       TYR  18  -9.499  13.426  -3.608
  159    HB3  TYR  18          3HB       TYR  18 -10.631  14.754  -3.378
  160    HD1  TYR  18           HD1      TYR  18  -8.334  13.253  -5.894
  161    HD2  TYR  18           HD2      TYR  18 -11.788  15.639  -5.203
  162    HE1  TYR  18           HE1      TYR  18  -8.804  13.260  -8.308
  163    HE2  TYR  18           HE2      TYR  18 -12.269  15.651  -7.615
  164    HH   TYR  18           HH       TYR  18 -11.228  15.302  -9.701
  165    H    GLU  19           H        GLU  19  -7.034  13.912  -2.100
  166    HA   GLU  19           HA       GLU  19  -8.233  14.369   0.451
  167    HB2  GLU  19          2HB       GLU  19  -5.579  13.112  -0.266
  168    HB3  GLU  19          3HB       GLU  19  -6.322  13.066   1.326
  169    HG2  GLU  19          2HG       GLU  19  -7.669  11.965  -1.119
  170    HG3  GLU  19          3HG       GLU  19  -6.586  11.007  -0.110
  171    H    ILE  20           H        ILE  20  -5.412  15.627  -1.237
  172    HA   ILE  20           HA       ILE  20  -4.110  16.927   0.829
  173    HB   ILE  20           HB       ILE  20  -4.418  17.903  -2.013
  174   HG12  ILE  20          2HG1      ILE  20  -1.936  16.573  -1.113
  175   HG13  ILE  20          3HG1      ILE  20  -3.350  15.531  -1.239
  176   HG21  ILE  20          1HG2      ILE  20  -1.920  18.616  -0.949
  177   HG22  ILE  20          2HG2      ILE  20  -3.258  19.682  -1.374
  178   HG23  ILE  20          3HG2      ILE  20  -3.120  19.052   0.267
  179   HD11  ILE  20          1HD1      ILE  20  -2.838  15.324  -3.385
  180   HD12  ILE  20          2HD1      ILE  20  -3.389  16.988  -3.584
  181   HD13  ILE  20          3HD1      ILE  20  -1.679  16.651  -3.313
  182    H    ALA  21           H        ALA  21  -7.012  17.844  -0.899
  183    HA   ALA  21           HA       ALA  21  -7.230  20.524  -0.295
  184    HB1  ALA  21          1HB       ALA  21  -9.808  19.432   0.031
  185    HB2  ALA  21          2HB       ALA  21  -9.120  20.190  -1.405
  186    HB3  ALA  21          3HB       ALA  21  -8.980  18.447  -1.175
  187    H    TRP  22           H        TRP  22  -8.162  17.751   1.716
  188    HA   TRP  22           HA       TRP  22  -9.354  19.071   3.826
  189    HB2  TRP  22          2HB       TRP  22  -9.349  16.653   3.693
  190    HB3  TRP  22          3HB       TRP  22  -7.598  16.609   3.878
  191    HD1  TRP  22           HD1      TRP  22  -6.623  17.225   6.348
  192    HE1  TRP  22           HE1      TRP  22  -7.697  16.974   8.674
  193    HE3  TRP  22           HE3      TRP  22 -11.515  16.751   4.939
  194    HZ2  TRP  22           HZ2      TRP  22 -10.275  16.622   9.767
  195    HZ3  TRP  22           HZ3      TRP  22 -13.223  16.461   6.686
  196    HH2  TRP  22           HH2      TRP  22 -12.614  16.397   9.049
  197    H    PHE  23           H        PHE  23  -5.905  18.447   3.290
  198    HA   PHE  23           HA       PHE  23  -5.103  19.725   5.727
  199    HB2  PHE  23          2HB       PHE  23  -3.591  18.094   5.004
  200    HB3  PHE  23          3HB       PHE  23  -3.650  18.643   3.333
  201    HD1  PHE  23           HD1      PHE  23  -2.129  20.239   2.521
  202    HD2  PHE  23           HD2      PHE  23  -2.384  19.480   6.702
  203    HE1  PHE  23           HE1      PHE  23  -0.088  21.564   2.883
  204    HE2  PHE  23           HE2      PHE  23  -0.344  20.804   7.070
  205    HZ   PHE  23           HZ       PHE  23   0.806  21.849   5.160
  206    H    LYS  24           H        LYS  24  -5.597  20.705   2.423
  207    HA   LYS  24           HA       LYS  24  -4.117  23.091   2.418
  208    HB2  LYS  24          2HB       LYS  24  -5.010  22.073   0.375
  209    HB3  LYS  24          3HB       LYS  24  -6.650  22.412   0.911
  210    HG2  LYS  24          2HG       LYS  24  -6.358  24.182  -0.470
  211    HG3  LYS  24          3HG       LYS  24  -5.703  24.887   1.010
  212    HD2  LYS  24          2HD       LYS  24  -3.438  24.024   0.226
  213    HD3  LYS  24          3HD       LYS  24  -4.209  23.745  -1.337
  214    HE2  LYS  24          2HE       LYS  24  -4.244  26.405   0.073
  215    HE3  LYS  24          3HE       LYS  24  -2.997  25.943  -1.084
  216    HZ1  LYS  24          1HZ       LYS  24  -4.696  25.671  -2.768
  217    HZ2  LYS  24          2HZ       LYS  24  -4.763  27.233  -2.123
  218    HZ3  LYS  24          3HZ       LYS  24  -5.908  26.077  -1.660
  219    H    ASN  25           H        ASN  25  -7.244  22.295   3.733
  220    HA   ASN  25           HA       ASN  25  -8.053  25.029   4.121
  221    HB2  ASN  25          2HB       ASN  25  -9.164  22.396   5.097
  222    HB3  ASN  25          3HB       ASN  25  -9.873  23.951   5.525
  223   HD21  ASN  25          1HD2      ASN  25 -10.060  21.429   3.442
  224   HD22  ASN  25          2HD2      ASN  25 -10.876  22.196   2.126
  225    H    LYS  26           H        LYS  26  -5.928  22.950   5.683
  226    HA   LYS  26           HA       LYS  26  -6.309  24.143   8.320
  227    HB2  LYS  26          2HB       LYS  26  -4.201  22.133   7.544
  228    HB3  LYS  26          3HB       LYS  26  -4.826  22.484   9.151
  229    HG2  LYS  26          2HG       LYS  26  -6.429  21.240   6.927
  230    HG3  LYS  26          3HG       LYS  26  -5.632  20.343   8.223
  231    HD2  LYS  26          2HD       LYS  26  -7.015  21.362   9.879
  232    HD3  LYS  26          3HD       LYS  26  -7.671  22.509   8.709
  233    HE2  LYS  26          2HE       LYS  26  -8.492  20.413   7.452
  234    HE3  LYS  26          3HE       LYS  26  -8.197  19.569   8.971
  235    HZ1  LYS  26          1HZ       LYS  26  -9.981  20.495   9.921
  236    HZ2  LYS  26          2HZ       LYS  26 -10.490  20.812   8.340
  237    HZ3  LYS  26          3HZ       LYS  26  -9.707  22.016   9.233
  238    H    HIS  27           H        HIS  27  -4.121  24.215   5.600
  239    HA   HIS  27           HA       HIS  27  -2.729  26.474   6.837
  240    HB2  HIS  27          2HB       HIS  27  -1.288  24.197   5.463
  241    HB3  HIS  27          3HB       HIS  27  -0.546  25.635   6.159
  242    HD1  HIS  27           HD1      HIS  27  -2.321  22.468   7.181
  243    HD2  HIS  27           HD2      HIS  27  -0.028  25.500   8.858
  244    HE1  HIS  27           HE1      HIS  27  -1.805  21.705   9.521
  245    H    GLY  28           H        GLY  28  -3.164  24.536   3.888
  246    HA2  GLY  28          2HA       GLY  28  -3.953  25.478   1.848
  247    HA3  GLY  28          3HA       GLY  28  -3.348  27.043   2.371
  248    H    TYR  29           H        TYR  29  -1.407  24.166   2.664
  249    HA   TYR  29           HA       TYR  29   0.218  25.060   0.376
  250    HB2  TYR  29          2HB       TYR  29   1.093  24.265   3.142
  251    HB3  TYR  29          3HB       TYR  29   2.189  24.142   1.770
  252    HD1  TYR  29           HD1      TYR  29  -0.076  26.606   3.429
  253    HD2  TYR  29           HD2      TYR  29   3.514  25.963   1.238
  254    HE1  TYR  29           HE1      TYR  29   0.498  28.984   3.683
  255    HE2  TYR  29           HE2      TYR  29   4.098  28.339   1.487
  256    HH   TYR  29           HH       TYR  29   3.159  30.259   3.548
  257    H    TYR  30           H        TYR  30   2.053  23.120   0.205
  258    HA   TYR  30           HA       TYR  30   0.724  20.529   0.295
  259    HB2  TYR  30          2HB       TYR  30   1.961  21.353  -2.309
  260    HB3  TYR  30          3HB       TYR  30   0.783  20.085  -1.991
  261    HD1  TYR  30           HD1      TYR  30  -1.551  20.529  -2.068
  262    HD2  TYR  30           HD2      TYR  30   1.231  23.738  -2.317
  263    HE1  TYR  30           HE1      TYR  30  -3.370  22.047  -2.730
  264    HE2  TYR  30           HE2      TYR  30  -0.580  25.265  -2.979
  265    HH   TYR  30           HH       TYR  30  -3.123  24.670  -4.223
  266    HA   PRO  31           HA       PRO  31   5.408  19.936  -0.736
  267    HB2  PRO  31          2HB       PRO  31   6.915  22.178  -1.010
  268    HB3  PRO  31          3HB       PRO  31   6.076  21.413  -2.365
  269    HG2  PRO  31          2HG       PRO  31   5.264  23.785  -0.730
  270    HG3  PRO  31          3HG       PRO  31   5.174  23.553  -2.486
  271    HD2  PRO  31          2HD       PRO  31   3.023  23.266  -0.867
  272    HD3  PRO  31          3HD       PRO  31   3.236  22.313  -2.349
  273    H    TRP  32           H        TRP  32   7.644  20.934   0.355
  274    HA   TRP  32           HA       TRP  32   7.061  20.829   3.181
  275    HB2  TRP  32          2HB       TRP  32   9.329  20.382   3.501
  276    HB3  TRP  32          3HB       TRP  32   9.012  19.676   1.919
  277    HD1  TRP  32           HD1      TRP  32  11.053  22.351   3.635
  278    HE1  TRP  32           HE1      TRP  32  12.629  23.451   1.922
  279    HE3  TRP  32           HE3      TRP  32   9.142  20.318  -0.649
  280    HZ2  TRP  32           HZ2      TRP  32  13.010  23.457  -0.875
  281    HZ3  TRP  32           HZ3      TRP  32  10.170  20.922  -2.802
  282    HH2  TRP  32           HH2      TRP  32  12.063  22.460  -2.910
  283    H    GLU  33           H        GLU  33   6.904  23.273   1.086
  284    HA   GLU  33           HA       GLU  33   8.344  25.274   2.616
  285    HB2  GLU  33          2HB       GLU  33   6.458  25.760   0.313
  286    HB3  GLU  33          3HB       GLU  33   7.734  26.815   0.902
  287    HG2  GLU  33          2HG       GLU  33   9.425  25.318   0.101
  288    HG3  GLU  33          3HG       GLU  33   8.211  24.119  -0.343
  289    H    ILE  34           H        ILE  34   6.526  24.088   4.245
  290    HA   ILE  34           HA       ILE  34   4.170  25.816   4.335
  291    HB   ILE  34           HB       ILE  34   4.878  23.438   6.058
  292   HG12  ILE  34          2HG1      ILE  34   2.639  23.427   4.088
  293   HG13  ILE  34          3HG1      ILE  34   4.278  23.258   3.470
  294   HG21  ILE  34          1HG2      ILE  34   2.605  23.545   6.864
  295   HG22  ILE  34          2HG2      ILE  34   3.404  25.089   7.152
  296   HG23  ILE  34          3HG2      ILE  34   2.265  24.922   5.816
  297   HD11  ILE  34          1HD1      ILE  34   3.313  21.520   5.698
  298   HD12  ILE  34          2HD1      ILE  34   2.922  21.145   4.020
  299   HD13  ILE  34          3HD1      ILE  34   4.606  21.233   4.534
  300    HA   PRO  35           HA       PRO  35   6.043  28.457   7.348
  301    HB2  PRO  35          2HB       PRO  35   3.783  29.729   8.149
  302    HB3  PRO  35          3HB       PRO  35   4.580  30.066   6.608
  303    HG2  PRO  35          2HG       PRO  35   2.197  28.344   7.172
  304    HG3  PRO  35          3HG       PRO  35   2.456  29.499   5.851
  305    HD2  PRO  35          2HD       PRO  35   2.752  26.826   5.530
  306    HD3  PRO  35          3HD       PRO  35   3.723  28.010   4.630
  307    H    ARG  36           H        ARG  36   5.132  29.282   9.676
  308    HA   ARG  36           HA       ARG  36   4.769  26.807  11.209
  309    HB2  ARG  36          2HB       ARG  36   5.583  29.493  12.309
  310    HB3  ARG  36          3HB       ARG  36   5.777  27.912  13.055
  311    HG2  ARG  36          2HG       ARG  36   7.233  28.917  10.618
  312    HG3  ARG  36          3HG       ARG  36   7.900  28.750  12.244
  313    HD2  ARG  36          2HD       ARG  36   6.987  26.567  10.383
  314    HD3  ARG  36          3HD       ARG  36   8.616  26.860  10.991
  315    HE   ARG  36           HE       ARG  36   7.186  26.434  13.245
  316   HH11  ARG  36          1HH1      ARG  36   7.538  24.664  10.268
  317   HH12  ARG  36          2HH1      ARG  36   7.283  23.117  11.006
  318   HH21  ARG  36          1HH2      ARG  36   6.850  24.403  14.228
  319   HH22  ARG  36          2HH2      ARG  36   6.891  22.970  13.259
  320    H    CYS  37           H        CYS  37   3.421  26.911  13.162
  321    HA   CYS  37           HA       CYS  37   0.957  28.373  12.600
  322    HB2  CYS  37          2HB       CYS  37   1.221  25.811  13.211
  323    HB3  CYS  37          3HB       CYS  37   1.198  26.431  14.857
  324    HG   CYS  37           HG       CYS  37  -1.357  25.473  14.115
  Start of MODEL    4
    1    H    MET   1           H        MET   1   1.244  -0.720   0.696
    2    HA   MET   1           HA       MET   1   3.483  -0.378   0.311
    3    HB2  MET   1          2HB       MET   1   4.174  -1.119  -1.924
    4    HB3  MET   1          3HB       MET   1   2.921  -2.160  -1.263
    5    HG2  MET   1          2HG       MET   1   1.250  -0.975  -2.619
    6    HG3  MET   1          3HG       MET   1   2.536   0.010  -3.311
    7    HE1  MET   1          1HE       MET   1   1.546  -4.182  -3.295
    8    HE2  MET   1          2HE       MET   1   0.449  -2.802  -3.272
    9    HE3  MET   1          3HE       MET   1   0.782  -3.639  -4.789
   10    H    LYS   2           H        LYS   2   5.031   0.640  -1.588
   11    HA   LYS   2           HA       LYS   2   4.013   3.247  -2.396
   12    HB2  LYS   2          2HB       LYS   2   6.146   2.810  -0.341
   13    HB3  LYS   2          3HB       LYS   2   6.247   4.207  -1.405
   14    HG2  LYS   2          2HG       LYS   2   4.212   5.091  -0.594
   15    HG3  LYS   2          3HG       LYS   2   3.807   3.587   0.235
   16    HD2  LYS   2          2HD       LYS   2   6.353   4.900   0.991
   17    HD3  LYS   2          3HD       LYS   2   4.860   5.696   1.494
   18    HE2  LYS   2          2HE       LYS   2   4.734   4.278   3.198
   19    HE3  LYS   2          3HE       LYS   2   4.515   2.964   2.043
   20    HZ1  LYS   2          1HZ       LYS   2   6.493   2.170   2.586
   21    HZ2  LYS   2          2HZ       LYS   2   6.658   3.374   3.762
   22    HZ3  LYS   2          3HZ       LYS   2   7.247   3.634   2.198
   23    H    PHE   3           H        PHE   3   4.385   1.636  -4.307
   24    HA   PHE   3           HA       PHE   3   7.151   1.548  -5.196
   25    HB2  PHE   3          2HB       PHE   3   4.575   0.375  -6.188
   26    HB3  PHE   3          3HB       PHE   3   5.971   0.458  -7.257
   27    HD1  PHE   3           HD1      PHE   3   5.416  -0.444  -3.675
   28    HD2  PHE   3           HD2      PHE   3   7.078  -1.532  -7.440
   29    HE1  PHE   3           HE1      PHE   3   6.292  -2.519  -2.685
   30    HE2  PHE   3           HE2      PHE   3   7.955  -3.610  -6.456
   31    HZ   PHE   3           HZ       PHE   3   7.562  -4.106  -4.076
   32    H    LYS   4           H        LYS   4   7.646   2.204  -7.466
   33    HA   LYS   4           HA       LYS   4   6.267   4.726  -8.113
   34    HB2  LYS   4          2HB       LYS   4   9.122   4.025  -8.799
   35    HB3  LYS   4          3HB       LYS   4   8.343   5.596  -8.940
   36    HG2  LYS   4          2HG       LYS   4   9.246   6.058  -6.964
   37    HG3  LYS   4          3HG       LYS   4   8.028   4.980  -6.277
   38    HD2  LYS   4          2HD       LYS   4  10.000   4.132  -5.402
   39    HD3  LYS   4          3HD       LYS   4   9.742   3.109  -6.818
   40    HE2  LYS   4          2HE       LYS   4  11.181   5.023  -7.973
   41    HE3  LYS   4          3HE       LYS   4  11.782   5.211  -6.326
   42    HZ1  LYS   4          1HZ       LYS   4  13.074   3.459  -6.631
   43    HZ2  LYS   4          2HZ       LYS   4  12.510   3.289  -8.217
   44    HZ3  LYS   4          3HZ       LYS   4  11.732   2.480  -6.952
   45    H    PHE   5           H        PHE   5   7.417   1.678  -9.301
   46    HA   PHE   5           HA       PHE   5   6.883   2.374 -12.074
   47    HB2  PHE   5          2HB       PHE   5   7.892  -0.147 -10.753
   48    HB3  PHE   5          3HB       PHE   5   7.563  -0.031 -12.479
   49    HD1  PHE   5           HD1      PHE   5   9.946   0.509  -9.893
   50    HD2  PHE   5           HD2      PHE   5   8.813   1.760 -13.800
   51    HE1  PHE   5           HE1      PHE   5  12.207   1.409 -10.256
   52    HE2  PHE   5           HE2      PHE   5  11.072   2.661 -14.170
   53    HZ   PHE   5           HZ       PHE   5  12.773   2.486 -12.398
   54    H    ASN   6           H        ASN   6   5.475   0.513  -9.459
   55    HA   ASN   6           HA       ASN   6   3.620  -1.026 -10.803
   56    HB2  ASN   6          2HB       ASN   6   3.870   0.083  -8.090
   57    HB3  ASN   6          3HB       ASN   6   2.217  -0.278  -8.576
   58   HD21  ASN   6          1HD2      ASN   6   5.262  -1.889  -9.375
   59   HD22  ASN   6          2HD2      ASN   6   4.819  -3.428  -8.727
   60    HA   PRO   7           HA       PRO   7   0.575   1.615 -12.534
   61    HB2  PRO   7          2HB       PRO   7  -1.729   0.279 -12.009
   62    HB3  PRO   7          3HB       PRO   7  -0.549  -0.273 -13.203
   63    HG2  PRO   7          2HG       PRO   7  -0.960  -1.188 -10.383
   64    HG3  PRO   7          3HG       PRO   7  -0.655  -2.153 -11.839
   65    HD2  PRO   7          2HD       PRO   7   1.288  -1.564 -10.048
   66    HD3  PRO   7          3HD       PRO   7   1.613  -1.751 -11.783
   67    H    THR   8           H        THR   8  -0.005   0.586  -9.209
   68    HA   THR   8           HA       THR   8  -2.053   2.363  -8.541
   69    HB   THR   8           HB       THR   8  -1.164   0.431  -7.140
   70    HG1  THR   8           HG1      THR   8  -2.579   1.462  -5.935
   71   HG21  THR   8          1HG2      THR   8   0.587   0.915  -5.541
   72   HG22  THR   8          2HG2      THR   8   0.763   2.549  -6.180
   73   HG23  THR   8          3HG2      THR   8   1.205   1.161  -7.173
   74    H    GLY   9           H        GLY   9   1.264   2.950  -9.177
   75    HA2  GLY   9          2HA       GLY   9   1.881   5.139  -7.611
   76    HA3  GLY   9          3HA       GLY   9   2.468   4.905  -9.251
   77    H    THR  10           H        THR  10   0.026   5.076 -10.626
   78    HA   THR  10           HA       THR  10  -0.267   7.924 -10.734
   79    HB   THR  10           HB       THR  10  -1.848   5.798 -12.193
   80    HG1  THR  10           HG1      THR  10  -0.305   6.605 -13.919
   81   HG21  THR  10          1HG2      THR  10  -1.503   8.331 -13.545
   82   HG22  THR  10          2HG2      THR  10  -2.312   8.541 -11.992
   83   HG23  THR  10          3HG2      THR  10  -2.983   7.439 -13.194
   84    H    ILE  11           H        ILE  11  -2.487   5.243  -9.975
   85    HA   ILE  11           HA       ILE  11  -4.748   6.732  -9.383
   86    HB   ILE  11           HB       ILE  11  -3.841   4.161  -8.082
   87   HG12  ILE  11          2HG1      ILE  11  -5.890   3.586  -9.835
   88   HG13  ILE  11          3HG1      ILE  11  -4.989   4.832 -10.693
   89   HG21  ILE  11          1HG2      ILE  11  -6.217   3.830  -7.548
   90   HG22  ILE  11          2HG2      ILE  11  -5.545   5.248  -6.743
   91   HG23  ILE  11          3HG2      ILE  11  -6.568   5.444  -8.166
   92   HD11  ILE  11          1HD1      ILE  11  -2.934   3.346 -10.033
   93   HD12  ILE  11          2HD1      ILE  11  -4.165   2.088  -9.916
   94   HD13  ILE  11          3HD1      ILE  11  -3.931   2.956 -11.434
   95    H    VAL  12           H        VAL  12  -2.293   5.544  -7.083
   96    HA   VAL  12           HA       VAL  12  -3.296   6.713  -4.781
   97    HB   VAL  12           HB       VAL  12  -0.408   6.244  -5.530
   98   HG11  VAL  12          1HG1      VAL  12   0.015   6.293  -3.097
   99   HG12  VAL  12          2HG1      VAL  12  -0.521   7.851  -3.728
  100   HG13  VAL  12          3HG1      VAL  12  -1.647   6.822  -2.842
  101   HG21  VAL  12          1HG2      VAL  12  -2.251   4.351  -5.334
  102   HG22  VAL  12          2HG2      VAL  12  -0.610   4.115  -4.733
  103   HG23  VAL  12          3HG2      VAL  12  -1.906   4.538  -3.615
  104    H    LYS  13           H        LYS  13  -1.476   8.142  -7.396
  105    HA   LYS  13           HA       LYS  13  -0.870  10.576  -6.003
  106    HB2  LYS  13          2HB       LYS  13   0.507  10.905  -7.731
  107    HB3  LYS  13          3HB       LYS  13  -0.028   9.357  -8.374
  108    HG2  LYS  13          2HG       LYS  13  -1.797  10.488  -9.625
  109    HG3  LYS  13          3HG       LYS  13  -1.256  12.040  -8.982
  110    HD2  LYS  13          2HD       LYS  13   0.521  10.195 -10.568
  111    HD3  LYS  13          3HD       LYS  13  -0.444  11.479 -11.301
  112    HE2  LYS  13          2HE       LYS  13   0.700  13.112  -9.833
  113    HE3  LYS  13          3HE       LYS  13   1.716  11.808  -9.221
  114    HZ1  LYS  13          1HZ       LYS  13   2.393  13.357 -11.269
  115    HZ2  LYS  13          2HZ       LYS  13   1.630  12.103 -12.109
  116    HZ3  LYS  13          3HZ       LYS  13   2.940  11.765 -11.093
  117    H    LYS  14           H        LYS  14  -3.414   9.443  -8.133
  118    HA   LYS  14           HA       LYS  14  -4.591  12.036  -8.501
  119    HB2  LYS  14          2HB       LYS  14  -5.638   9.255  -9.052
  120    HB3  LYS  14          3HB       LYS  14  -6.486  10.733  -9.487
  121    HG2  LYS  14          2HG       LYS  14  -3.817   9.811 -10.528
  122    HG3  LYS  14          3HG       LYS  14  -5.343   9.873 -11.413
  123    HD2  LYS  14          2HD       LYS  14  -5.374  12.330 -11.099
  124    HD3  LYS  14          3HD       LYS  14  -3.793  12.222 -10.322
  125    HE2  LYS  14          2HE       LYS  14  -3.104  10.994 -12.510
  126    HE3  LYS  14          3HE       LYS  14  -4.538  11.767 -13.183
  127    HZ1  LYS  14          1HZ       LYS  14  -1.994  12.884 -12.699
  128    HZ2  LYS  14          2HZ       LYS  14  -3.148  13.722 -11.790
  129    HZ3  LYS  14          3HZ       LYS  14  -3.330  13.584 -13.466
  130    H    LEU  15           H        LEU  15  -5.436   9.144  -6.610
  131    HA   LEU  15           HA       LEU  15  -7.759  10.114  -5.423
  132    HB2  LEU  15          2HB       LEU  15  -5.729   8.067  -4.662
  133    HB3  LEU  15          3HB       LEU  15  -6.964   8.525  -3.491
  134    HG   LEU  15           HG       LEU  15  -7.384   6.454  -4.930
  135   HD11  LEU  15          1HD1      LEU  15  -9.052   7.873  -3.576
  136   HD12  LEU  15          2HD1      LEU  15  -9.681   6.760  -4.790
  137   HD13  LEU  15          3HD1      LEU  15  -9.574   8.484  -5.146
  138   HD21  LEU  15          1HD2      LEU  15  -8.023   8.584  -6.968
  139   HD22  LEU  15          2HD2      LEU  15  -8.349   6.857  -7.126
  140   HD23  LEU  15          3HD2      LEU  15  -6.684   7.440  -7.063
  141    H    THR  16           H        THR  16  -4.399  10.680  -4.639
  142    HA   THR  16           HA       THR  16  -4.893  11.865  -2.083
  143    HB   THR  16           HB       THR  16  -2.467  12.054  -3.878
  144    HG1  THR  16           HG1      THR  16  -1.718  10.344  -2.725
  145   HG21  THR  16          1HG2      THR  16  -1.671  12.421  -1.250
  146   HG22  THR  16          2HG2      THR  16  -3.147  13.379  -1.382
  147   HG23  THR  16          3HG2      THR  16  -1.802  13.673  -2.485
  148    H    GLN  17           H        GLN  17  -4.779  13.010  -5.371
  149    HA   GLN  17           HA       GLN  17  -4.339  15.723  -4.994
  150    HB2  GLN  17          2HB       GLN  17  -4.628  14.358  -7.176
  151    HB3  GLN  17          3HB       GLN  17  -6.340  14.713  -6.994
  152    HG2  GLN  17          2HG       GLN  17  -6.035  16.990  -7.313
  153    HG3  GLN  17          3HG       GLN  17  -4.315  16.910  -6.934
  154   HE21  GLN  17          1HE2      GLN  17  -2.895  15.978  -8.489
  155   HE22  GLN  17          2HE2      GLN  17  -3.312  15.977 -10.166
  156    H    TYR  18           H        TYR  18  -7.121  13.804  -4.252
  157    HA   TYR  18           HA       TYR  18  -8.788  16.170  -3.840
  158    HB2  TYR  18          2HB       TYR  18  -9.451  13.227  -3.619
  159    HB3  TYR  18          3HB       TYR  18 -10.603  14.542  -3.415
  160    HD1  TYR  18           HD1      TYR  18  -8.254  13.049  -5.886
  161    HD2  TYR  18           HD2      TYR  18 -11.743  15.404  -5.263
  162    HE1  TYR  18           HE1      TYR  18  -8.691  13.032  -8.307
  163    HE2  TYR  18           HE2      TYR  18 -12.190  15.393  -7.681
  164    HH   TYR  18           HH       TYR  18 -11.382  14.862  -9.700
  165    H    GLU  19           H        GLU  19  -7.012  13.753  -2.085
  166    HA   GLU  19           HA       GLU  19  -8.248  14.209   0.448
  167    HB2  GLU  19          2HB       GLU  19  -5.572  12.978  -0.231
  168    HB3  GLU  19          3HB       GLU  19  -6.331  12.935   1.354
  169    HG2  GLU  19          2HG       GLU  19  -7.632  11.798  -1.101
  170    HG3  GLU  19          3HG       GLU  19  -6.559  10.862  -0.062
  171    H    ILE  20           H        ILE  20  -5.420  15.490  -1.211
  172    HA   ILE  20           HA       ILE  20  -4.160  16.817   0.864
  173    HB   ILE  20           HB       ILE  20  -4.442  17.771  -1.988
  174   HG12  ILE  20          2HG1      ILE  20  -1.957  16.475  -1.047
  175   HG13  ILE  20          3HG1      ILE  20  -3.357  15.417  -1.187
  176   HG21  ILE  20          1HG2      ILE  20  -1.965  18.519  -0.896
  177   HG22  ILE  20          2HG2      ILE  20  -3.309  19.568  -1.346
  178   HG23  ILE  20          3HG2      ILE  20  -3.187  18.950   0.301
  179   HD11  ILE  20          1HD1      ILE  20  -2.851  15.211  -3.330
  180   HD12  ILE  20          2HD1      ILE  20  -3.354  16.889  -3.538
  181   HD13  ILE  20          3HD1      ILE  20  -1.658  16.507  -3.239
  182    H    ALA  21           H        ALA  21  -7.049  17.690  -0.908
  183    HA   ALA  21           HA       ALA  21  -7.305  20.371  -0.323
  184    HB1  ALA  21          1HB       ALA  21  -9.874  19.245  -0.023
  185    HB2  ALA  21          2HB       ALA  21  -9.180  20.013  -1.452
  186    HB3  ALA  21          3HB       ALA  21  -9.017  18.272  -1.219
  187    H    TRP  22           H        TRP  22  -8.231  17.600   1.692
  188    HA   TRP  22           HA       TRP  22  -9.466  18.919   3.779
  189    HB2  TRP  22          2HB       TRP  22  -9.441  16.505   3.672
  190    HB3  TRP  22          3HB       TRP  22  -7.689  16.473   3.856
  191    HD1  TRP  22           HD1      TRP  22  -6.709  17.049   6.317
  192    HE1  TRP  22           HE1      TRP  22  -7.779  16.827   8.648
  193    HE3  TRP  22           HE3      TRP  22 -11.614  16.680   4.926
  194    HZ2  TRP  22           HZ2      TRP  22 -10.361  16.534   9.750
  195    HZ3  TRP  22           HZ3      TRP  22 -13.322  16.431   6.680
  196    HH2  TRP  22           HH2      TRP  22 -12.706  16.359   9.041
  197    H    PHE  23           H        PHE  23  -6.004  18.332   3.291
  198    HA   PHE  23           HA       PHE  23  -5.248  19.634   5.730
  199    HB2  PHE  23          2HB       PHE  23  -3.708  18.015   5.037
  200    HB3  PHE  23          3HB       PHE  23  -3.752  18.553   3.361
  201    HD1  PHE  23           HD1      PHE  23  -2.238  20.161   2.560
  202    HD2  PHE  23           HD2      PHE  23  -2.540  19.425   6.742
  203    HE1  PHE  23           HE1      PHE  23  -0.216  21.511   2.940
  204    HE2  PHE  23           HE2      PHE  23  -0.519  20.775   7.128
  205    HZ   PHE  23           HZ       PHE  23   0.645  21.821   5.227
  206    H    LYS  24           H        LYS  24  -5.709  20.588   2.414
  207    HA   LYS  24           HA       LYS  24  -4.257  22.990   2.413
  208    HB2  LYS  24          2HB       LYS  24  -5.112  21.950   0.365
  209    HB3  LYS  24          3HB       LYS  24  -6.763  22.273   0.879
  210    HG2  LYS  24          2HG       LYS  24  -6.472  24.037  -0.510
  211    HG3  LYS  24          3HG       LYS  24  -5.846  24.759   0.974
  212    HD2  LYS  24          2HD       LYS  24  -3.560  23.918   0.225
  213    HD3  LYS  24          3HD       LYS  24  -4.307  23.620  -1.347
  214    HE2  LYS  24          2HE       LYS  24  -4.391  26.288   0.047
  215    HE3  LYS  24          3HE       LYS  24  -3.124  25.834  -1.091
  216    HZ1  LYS  24          1HZ       LYS  24  -5.319  25.253  -2.495
  217    HZ2  LYS  24          2HZ       LYS  24  -4.517  26.739  -2.577
  218    HZ3  LYS  24          3HZ       LYS  24  -5.880  26.568  -1.590
  219    H    ASN  25           H        ASN  25  -7.391  22.167   3.693
  220    HA   ASN  25           HA       ASN  25  -8.235  24.894   4.054
  221    HB2  ASN  25          2HB       ASN  25  -9.328  22.248   5.007
  222    HB3  ASN  25          3HB       ASN  25 -10.051  23.789   5.460
  223   HD21  ASN  25          1HD2      ASN  25 -10.111  21.308   3.273
  224   HD22  ASN  25          2HD2      ASN  25 -10.971  22.087   1.993
  225    H    LYS  26           H        LYS  26  -6.107  22.848   5.656
  226    HA   LYS  26           HA       LYS  26  -6.535  24.052   8.281
  227    HB2  LYS  26          2HB       LYS  26  -4.395  22.062   7.544
  228    HB3  LYS  26          3HB       LYS  26  -5.044  22.415   9.140
  229    HG2  LYS  26          2HG       LYS  26  -6.605  21.140   6.903
  230    HG3  LYS  26          3HG       LYS  26  -5.814  20.260   8.214
  231    HD2  LYS  26          2HD       LYS  26  -7.429  22.357   9.307
  232    HD3  LYS  26          3HD       LYS  26  -8.397  21.391   8.191
  233    HE2  LYS  26          2HE       LYS  26  -7.876  19.380   9.377
  234    HE3  LYS  26          3HE       LYS  26  -6.691  20.216  10.380
  235    HZ1  LYS  26          1HZ       LYS  26  -8.532  21.560  11.282
  236    HZ2  LYS  26          2HZ       LYS  26  -8.697  19.911  11.622
  237    HZ3  LYS  26          3HZ       LYS  26  -9.632  20.621  10.403
  238    H    HIS  27           H        HIS  27  -4.314  24.134   5.588
  239    HA   HIS  27           HA       HIS  27  -2.964  26.416   6.829
  240    HB2  HIS  27          2HB       HIS  27  -1.479  24.147   5.489
  241    HB3  HIS  27          3HB       HIS  27  -0.763  25.598   6.185
  242    HD1  HIS  27           HD1      HIS  27  -2.515  22.417   7.204
  243    HD2  HIS  27           HD2      HIS  27  -0.279  25.484   8.892
  244    HE1  HIS  27           HE1      HIS  27  -2.021  21.673   9.555
  245    H    GLY  28           H        GLY  28  -3.339  24.455   3.887
  246    HA2  GLY  28          2HA       GLY  28  -4.111  25.375   1.831
  247    HA3  GLY  28          3HA       GLY  28  -3.531  26.950   2.352
  248    H    TYR  29           H        TYR  29  -1.562  24.097   2.689
  249    HA   TYR  29           HA       TYR  29   0.083  24.995   0.416
  250    HB2  TYR  29          2HB       TYR  29   0.931  24.226   3.197
  251    HB3  TYR  29          3HB       TYR  29   2.046  24.107   1.841
  252    HD1  TYR  29           HD1      TYR  29  -0.269  26.556   3.454
  253    HD2  TYR  29           HD2      TYR  29   3.358  25.940   1.317
  254    HE1  TYR  29           HE1      TYR  29   0.274  28.942   3.701
  255    HE2  TYR  29           HE2      TYR  29   3.913  28.324   1.560
  256    HH   TYR  29           HH       TYR  29   1.669  30.641   2.544
  257    H    TYR  30           H        TYR  30   1.941  23.074   0.280
  258    HA   TYR  30           HA       TYR  30   0.639  20.470   0.369
  259    HB2  TYR  30          2HB       TYR  30   1.901  21.292  -2.224
  260    HB3  TYR  30          3HB       TYR  30   0.733  20.012  -1.913
  261    HD1  TYR  30           HD1      TYR  30  -1.604  20.430  -2.023
  262    HD2  TYR  30           HD2      TYR  30   1.145  23.669  -2.256
  263    HE1  TYR  30           HE1      TYR  30  -3.431  21.923  -2.717
  264    HE2  TYR  30           HE2      TYR  30  -0.675  25.171  -2.950
  265    HH   TYR  30           HH       TYR  30  -2.903  24.986  -4.028
  266    HA   PRO  31           HA       PRO  31   5.343  19.922  -0.598
  267    HB2  PRO  31          2HB       PRO  31   6.828  22.179  -0.866
  268    HB3  PRO  31          3HB       PRO  31   6.015  21.397  -2.227
  269    HG2  PRO  31          2HG       PRO  31   5.156  23.770  -0.617
  270    HG3  PRO  31          3HG       PRO  31   5.092  23.526  -2.372
  271    HD2  PRO  31          2HD       PRO  31   2.923  23.225  -0.780
  272    HD3  PRO  31          3HD       PRO  31   3.166  22.266  -2.254
  273    H    TRP  32           H        TRP  32   7.553  20.951   0.516
  274    HA   TRP  32           HA       TRP  32   6.935  20.857   3.335
  275    HB2  TRP  32          2HB       TRP  32   9.203  20.436   3.686
  276    HB3  TRP  32          3HB       TRP  32   8.915  19.719   2.104
  277    HD1  TRP  32           HD1      TRP  32  10.903  22.425   3.833
  278    HE1  TRP  32           HE1      TRP  32  12.489  23.534   2.135
  279    HE3  TRP  32           HE3      TRP  32   9.072  20.349  -0.466
  280    HZ2  TRP  32           HZ2      TRP  32  12.908  23.529  -0.656
  281    HZ3  TRP  32           HZ3      TRP  32  10.122  20.954  -2.607
  282    HH2  TRP  32           HH2      TRP  32  11.999  22.512  -2.699
  283    H    GLU  33           H        GLU  33   6.778  23.287   1.224
  284    HA   GLU  33           HA       GLU  33   8.176  25.312   2.759
  285    HB2  GLU  33          2HB       GLU  33   6.315  25.763   0.430
  286    HB3  GLU  33          3HB       GLU  33   7.571  26.837   1.029
  287    HG2  GLU  33          2HG       GLU  33   9.289  25.353   0.258
  288    HG3  GLU  33          3HG       GLU  33   8.094  24.139  -0.194
  289    H    ILE  34           H        ILE  34   6.349  24.115   4.371
  290    HA   ILE  34           HA       ILE  34   3.973  25.817   4.421
  291    HB   ILE  34           HB       ILE  34   4.685  23.457   6.167
  292   HG12  ILE  34          2HG1      ILE  34   2.474  23.410   4.168
  293   HG13  ILE  34          3HG1      ILE  34   4.123  23.255   3.573
  294   HG21  ILE  34          1HG2      ILE  34   3.178  25.101   7.231
  295   HG22  ILE  34          2HG2      ILE  34   2.060  24.911   5.881
  296   HG23  ILE  34          3HG2      ILE  34   2.401  23.544   6.942
  297   HD11  ILE  34          1HD1      ILE  34   2.841  21.119   4.069
  298   HD12  ILE  34          2HD1      ILE  34   4.469  21.257   4.732
  299   HD13  ILE  34          3HD1      ILE  34   3.069  21.516   5.772
  300    HA   PRO  35           HA       PRO  35   5.779  28.496   7.442
  301    HB2  PRO  35          2HB       PRO  35   3.494  29.748   8.207
  302    HB3  PRO  35          3HB       PRO  35   4.308  30.085   6.674
  303    HG2  PRO  35          2HG       PRO  35   1.936  28.340   7.217
  304    HG3  PRO  35          3HG       PRO  35   2.200  29.490   5.892
  305    HD2  PRO  35          2HD       PRO  35   2.530  26.819   5.591
  306    HD3  PRO  35          3HD       PRO  35   3.499  28.007   4.697
  307    H    ARG  36           H        ARG  36   4.820  29.326   9.752
  308    HA   ARG  36           HA       ARG  36   3.602  27.195  11.274
  309    HB2  ARG  36          2HB       ARG  36   5.507  27.035  12.875
  310    HB3  ARG  36          3HB       ARG  36   5.868  26.387  11.280
  311    HG2  ARG  36          2HG       ARG  36   6.626  29.085  11.207
  312    HG3  ARG  36          3HG       ARG  36   7.203  28.449  12.749
  313    HD2  ARG  36          2HD       ARG  36   7.634  26.906  10.223
  314    HD3  ARG  36          3HD       ARG  36   8.698  28.252  10.631
  315    HE   ARG  36           HE       ARG  36   8.512  26.579  12.861
  316   HH11  ARG  36          1HH1      ARG  36   9.766  26.526   9.614
  317   HH12  ARG  36          2HH1      ARG  36  11.031  25.401   9.981
  318   HH21  ARG  36          1HH2      ARG  36  10.175  25.099  13.358
  319   HH22  ARG  36          2HH2      ARG  36  11.263  24.589  12.111
  320    H    CYS  37           H        CYS  37   3.231  27.818  13.536
  321    HA   CYS  37           HA       CYS  37   3.228  30.742  13.894
  322    HB2  CYS  37          2HB       CYS  37   1.038  28.746  14.236
  323    HB3  CYS  37          3HB       CYS  37   1.097  30.107  15.351
  324    HG   CYS  37           HG       CYS  37   0.050  30.001  12.214
  Start of MODEL    5
    1    H    MET   1           H        MET   1   5.124  -2.104  -1.309
    2    HA   MET   1           HA       MET   1   4.405  -0.326  -0.089
    3    HB2  MET   1          2HB       MET   1   7.363  -0.213   0.451
    4    HB3  MET   1          3HB       MET   1   6.257   0.961   1.152
    5    HG2  MET   1          2HG       MET   1   6.409  -0.600   2.824
    6    HG3  MET   1          3HG       MET   1   4.963  -1.131   1.970
    7    HE1  MET   1          1HE       MET   1   5.822  -3.502   3.649
    8    HE2  MET   1          2HE       MET   1   4.643  -3.424   2.340
    9    HE3  MET   1          3HE       MET   1   5.852  -4.709   2.362
   10    H    LYS   2           H        LYS   2   3.502   1.020  -1.562
   11    HA   LYS   2           HA       LYS   2   3.247   2.764  -3.006
   12    HB2  LYS   2          2HB       LYS   2   5.365   3.715  -1.110
   13    HB3  LYS   2          3HB       LYS   2   4.893   4.726  -2.470
   14    HG2  LYS   2          2HG       LYS   2   2.477   4.010  -1.390
   15    HG3  LYS   2          3HG       LYS   2   3.508   4.188   0.032
   16    HD2  LYS   2          2HD       LYS   2   4.219   6.386  -1.372
   17    HD3  LYS   2          3HD       LYS   2   2.535   6.215  -1.873
   18    HE2  LYS   2          2HE       LYS   2   1.913   6.076   0.541
   19    HE3  LYS   2          3HE       LYS   2   3.589   6.449   0.942
   20    HZ1  LYS   2          1HZ       LYS   2   2.197   8.250  -0.893
   21    HZ2  LYS   2          2HZ       LYS   2   3.369   8.594   0.277
   22    HZ3  LYS   2          3HZ       LYS   2   1.767   8.316   0.742
   23    H    PHE   3           H        PHE   3   4.272   0.962  -4.474
   24    HA   PHE   3           HA       PHE   3   6.878   1.226  -5.452
   25    HB2  PHE   3          2HB       PHE   3   4.349   0.051  -6.538
   26    HB3  PHE   3          3HB       PHE   3   5.747   0.204  -7.596
   27    HD1  PHE   3           HD1      PHE   3   6.842  -1.786  -7.861
   28    HD2  PHE   3           HD2      PHE   3   5.254  -0.807  -4.035
   29    HE1  PHE   3           HE1      PHE   3   7.762  -3.878  -6.948
   30    HE2  PHE   3           HE2      PHE   3   6.172  -2.897  -3.116
   31    HZ   PHE   3           HZ       PHE   3   7.428  -4.435  -4.572
   32    H    LYS   4           H        LYS   4   7.412   1.886  -7.743
   33    HA   LYS   4           HA       LYS   4   6.117   4.466  -8.335
   34    HB2  LYS   4          2HB       LYS   4   8.930   3.697  -9.100
   35    HB3  LYS   4          3HB       LYS   4   8.207   5.300  -9.113
   36    HG2  LYS   4          2HG       LYS   4   9.186   5.592  -7.139
   37    HG3  LYS   4          3HG       LYS   4   7.938   4.526  -6.490
   38    HD2  LYS   4          2HD       LYS   4   9.407   2.596  -6.859
   39    HD3  LYS   4          3HD       LYS   4  10.655   3.672  -7.493
   40    HE2  LYS   4          2HE       LYS   4  11.326   4.252  -5.444
   41    HE3  LYS   4          3HE       LYS   4   9.673   4.519  -4.893
   42    HZ1  LYS   4          1HZ       LYS   4   9.573   2.500  -3.967
   43    HZ2  LYS   4          2HZ       LYS   4  11.262   2.540  -4.029
   44    HZ3  LYS   4          3HZ       LYS   4  10.391   1.743  -5.240
   45    H    PHE   5           H        PHE   5   7.220   1.424  -9.619
   46    HA   PHE   5           HA       PHE   5   6.662   2.195 -12.363
   47    HB2  PHE   5          2HB       PHE   5   7.538  -0.440 -11.163
   48    HB3  PHE   5          3HB       PHE   5   7.336  -0.144 -12.887
   49    HD1  PHE   5           HD1      PHE   5   8.851   1.397 -14.064
   50    HD2  PHE   5           HD2      PHE   5   9.454   0.332  -9.988
   51    HE1  PHE   5           HE1      PHE   5  11.167   2.217 -14.196
   52    HE2  PHE   5           HE2      PHE   5  11.770   1.151 -10.113
   53    HZ   PHE   5           HZ       PHE   5  12.630   2.095 -12.218
   54    H    ASN   6           H        ASN   6   5.217   0.326  -9.779
   55    HA   ASN   6           HA       ASN   6   3.318  -1.143 -11.140
   56    HB2  ASN   6          2HB       ASN   6   3.600  -0.078  -8.410
   57    HB3  ASN   6          3HB       ASN   6   1.939  -0.401  -8.898
   58   HD21  ASN   6          1HD2      ASN   6   1.269  -2.325  -8.328
   59   HD22  ASN   6          2HD2      ASN   6   2.227  -3.760  -8.240
   60    HA   PRO   7           HA       PRO   7   0.338   1.606 -12.817
   61    HB2  PRO   7          2HB       PRO   7  -1.999   0.323 -12.305
   62    HB3  PRO   7          3HB       PRO   7  -0.838  -0.241 -13.512
   63    HG2  PRO   7          2HG       PRO   7  -1.264  -1.190 -10.705
   64    HG3  PRO   7          3HG       PRO   7  -0.990  -2.139 -12.177
   65    HD2  PRO   7          2HD       PRO   7   0.975  -1.631 -10.385
   66    HD3  PRO   7          3HD       PRO   7   1.289  -1.798 -12.124
   67    H    THR   8           H        THR   8  -0.260   0.538  -9.507
   68    HA   THR   8           HA       THR   8  -2.257   2.359  -8.804
   69    HB   THR   8           HB       THR   8  -1.418   0.381  -7.437
   70    HG1  THR   8           HG1      THR   8  -2.005   1.449  -5.489
   71   HG21  THR   8          1HG2      THR   8   0.971   1.046  -7.467
   72   HG22  THR   8          2HG2      THR   8   0.350   0.789  -5.836
   73   HG23  THR   8          3HG2      THR   8   0.569   2.428  -6.448
   74    H    GLY   9           H        GLY   9   1.073   2.865  -9.440
   75    HA2  GLY   9          2HA       GLY   9   1.754   5.010  -7.840
   76    HA3  GLY   9          3HA       GLY   9   2.330   4.788  -9.485
   77    H    THR  10           H        THR  10  -0.110   5.049 -10.850
   78    HA   THR  10           HA       THR  10  -0.325   7.905 -10.910
   79    HB   THR  10           HB       THR  10  -1.967   5.847 -12.400
   80    HG1  THR  10           HG1      THR  10   0.071   5.573 -13.130
   81   HG21  THR  10          1HG2      THR  10  -3.060   7.536 -13.369
   82   HG22  THR  10          2HG2      THR  10  -1.556   8.391 -13.711
   83   HG23  THR  10          3HG2      THR  10  -2.354   8.599 -12.153
   84    H    ILE  11           H        ILE  11  -2.616   5.273 -10.189
   85    HA   ILE  11           HA       ILE  11  -4.834   6.813  -9.566
   86    HB   ILE  11           HB       ILE  11  -3.993   4.198  -8.311
   87   HG12  ILE  11          2HG1      ILE  11  -6.062   3.707 -10.066
   88   HG13  ILE  11          3HG1      ILE  11  -5.133   4.943 -10.906
   89   HG21  ILE  11          1HG2      ILE  11  -5.663   5.307  -6.947
   90   HG22  ILE  11          2HG2      ILE  11  -6.683   5.558  -8.363
   91   HG23  ILE  11          3HG2      ILE  11  -6.378   3.924  -7.776
   92   HD11  ILE  11          1HD1      ILE  11  -3.114   3.391 -10.275
   93   HD12  ILE  11          2HD1      ILE  11  -4.380   2.165 -10.183
   94   HD13  ILE  11          3HD1      ILE  11  -4.123   3.057 -11.683
   95    H    VAL  12           H        VAL  12  -2.406   5.521  -7.293
   96    HA   VAL  12           HA       VAL  12  -3.372   6.679  -4.969
   97    HB   VAL  12           HB       VAL  12  -0.499   6.144  -5.734
   98   HG11  VAL  12          1HG1      VAL  12  -1.718   6.712  -3.034
   99   HG12  VAL  12          2HG1      VAL  12  -0.069   6.141  -3.301
  100   HG13  VAL  12          3HG1      VAL  12  -0.565   7.723  -3.905
  101   HG21  VAL  12          1HG2      VAL  12  -2.038   4.448  -3.844
  102   HG22  VAL  12          2HG2      VAL  12  -2.394   4.298  -5.565
  103   HG23  VAL  12          3HG2      VAL  12  -0.758   4.008  -4.975
  104    H    LYS  13           H        LYS  13  -1.519   8.101  -7.566
  105    HA   LYS  13           HA       LYS  13  -0.844  10.494  -6.134
  106    HB2  LYS  13          2HB       LYS  13   0.538  10.813  -7.860
  107    HB3  LYS  13          3HB       LYS  13  -0.040   9.292  -8.527
  108    HG2  LYS  13          2HG       LYS  13  -1.780  10.490  -9.755
  109    HG3  LYS  13          3HG       LYS  13  -1.195  12.016  -9.088
  110    HD2  LYS  13          2HD       LYS  13   1.094  11.001 -10.123
  111    HD3  LYS  13          3HD       LYS  13  -0.097  10.345 -11.249
  112    HE2  LYS  13          2HE       LYS  13   0.313  12.352 -12.255
  113    HE3  LYS  13          3HE       LYS  13  -1.000  12.828 -11.180
  114    HZ1  LYS  13          1HZ       LYS  13   1.339  13.086  -9.724
  115    HZ2  LYS  13          2HZ       LYS  13   0.362  14.329 -10.325
  116    HZ3  LYS  13          3HZ       LYS  13   1.666  13.761 -11.241
  117    H    LYS  14           H        LYS  14  -3.421   9.466  -8.276
  118    HA   LYS  14           HA       LYS  14  -4.528  12.096  -8.600
  119    HB2  LYS  14          2HB       LYS  14  -5.652   9.353  -9.190
  120    HB3  LYS  14          3HB       LYS  14  -6.462  10.860  -9.599
  121    HG2  LYS  14          2HG       LYS  14  -3.822   9.883 -10.664
  122    HG3  LYS  14          3HG       LYS  14  -5.348  10.000 -11.542
  123    HD2  LYS  14          2HD       LYS  14  -5.313  12.451 -11.190
  124    HD3  LYS  14          3HD       LYS  14  -3.732  12.289 -10.421
  125    HE2  LYS  14          2HE       LYS  14  -2.665  11.949 -12.387
  126    HE3  LYS  14          3HE       LYS  14  -4.013  11.051 -13.085
  127    HZ1  LYS  14          1HZ       LYS  14  -3.706  13.135 -14.231
  128    HZ2  LYS  14          2HZ       LYS  14  -3.846  14.001 -12.786
  129    HZ3  LYS  14          3HZ       LYS  14  -5.180  13.162 -13.400
  130    H    LEU  15           H        LEU  15  -5.448   9.199  -6.751
  131    HA   LEU  15           HA       LEU  15  -7.740  10.211  -5.542
  132    HB2  LEU  15          2HB       LEU  15  -5.760   8.104  -4.815
  133    HB3  LEU  15          3HB       LEU  15  -6.980   8.577  -3.634
  134    HG   LEU  15           HG       LEU  15  -7.452   6.536  -5.105
  135   HD11  LEU  15          1HD1      LEU  15  -9.758   6.915  -4.993
  136   HD12  LEU  15          2HD1      LEU  15  -9.575   8.654  -5.221
  137   HD13  LEU  15          3HD1      LEU  15  -9.082   7.907  -3.701
  138   HD21  LEU  15          1HD2      LEU  15  -6.747   7.551  -7.224
  139   HD22  LEU  15          2HD2      LEU  15  -8.065   8.716  -7.099
  140   HD23  LEU  15          3HD2      LEU  15  -8.420   6.998  -7.286
  141    H    THR  16           H        THR  16  -4.366  10.682  -4.760
  142    HA   THR  16           HA       THR  16  -4.817  11.839  -2.185
  143    HB   THR  16           HB       THR  16  -2.401  12.013  -3.997
  144    HG1  THR  16           HG1      THR  16  -3.112   9.895  -3.095
  145   HG21  THR  16          1HG2      THR  16  -1.588  12.314  -1.361
  146   HG22  THR  16          2HG2      THR  16  -3.037  13.313  -1.479
  147   HG23  THR  16          3HG2      THR  16  -1.685  13.586  -2.578
  148    H    GLN  17           H        GLN  17  -4.706  13.037  -5.455
  149    HA   GLN  17           HA       GLN  17  -4.210  15.734  -5.036
  150    HB2  GLN  17          2HB       GLN  17  -4.543  14.410  -7.238
  151    HB3  GLN  17          3HB       GLN  17  -6.246  14.799  -7.037
  152    HG2  GLN  17          2HG       GLN  17  -5.346  17.240  -6.772
  153    HG3  GLN  17          3HG       GLN  17  -3.947  16.593  -7.628
  154   HE21  GLN  17          1HE2      GLN  17  -4.656  15.169  -9.573
  155   HE22  GLN  17          2HE2      GLN  17  -5.830  15.894 -10.612
  156    H    TYR  18           H        TYR  18  -7.025  13.857  -4.306
  157    HA   TYR  18           HA       TYR  18  -8.642  16.246  -3.843
  158    HB2  TYR  18          2HB       TYR  18  -9.359  13.312  -3.668
  159    HB3  TYR  18          3HB       TYR  18 -10.484  14.644  -3.428
  160    HD1  TYR  18           HD1      TYR  18 -11.633  15.550  -5.247
  161    HD2  TYR  18           HD2      TYR  18  -8.181  13.164  -5.950
  162    HE1  TYR  18           HE1      TYR  18 -12.102  15.595  -7.661
  163    HE2  TYR  18           HE2      TYR  18  -8.640  13.203  -8.366
  164    HH   TYR  18           HH       TYR  18  -9.979  14.933  -9.958
  165    H    GLU  19           H        GLU  19  -6.900  13.767  -2.141
  166    HA   GLU  19           HA       GLU  19  -8.109  14.204   0.408
  167    HB2  GLU  19          2HB       GLU  19  -5.461  12.934  -0.311
  168    HB3  GLU  19          3HB       GLU  19  -6.210  12.879   1.279
  169    HG2  GLU  19          2HG       GLU  19  -7.540  11.803  -1.189
  170    HG3  GLU  19          3HG       GLU  19  -6.491  10.833  -0.157
  171    H    ILE  20           H        ILE  20  -5.269  15.458  -1.250
  172    HA   ILE  20           HA       ILE  20  -3.969  16.727   0.837
  173    HB   ILE  20           HB       ILE  20  -4.253  17.734  -1.997
  174   HG12  ILE  20          2HG1      ILE  20  -1.787  16.375  -1.096
  175   HG13  ILE  20          3HG1      ILE  20  -3.208  15.347  -1.242
  176   HG21  ILE  20          1HG2      ILE  20  -1.755  18.417  -0.911
  177   HG22  ILE  20          2HG2      ILE  20  -3.083  19.498  -1.333
  178   HG23  ILE  20          3HG2      ILE  20  -2.960  18.850   0.302
  179   HD11  ILE  20          1HD1      ILE  20  -2.660  15.154  -3.383
  180   HD12  ILE  20          2HD1      ILE  20  -3.236  16.810  -3.572
  181   HD13  ILE  20          3HD1      ILE  20  -1.523  16.499  -3.296
  182    H    ALA  21           H        ALA  21  -6.853  17.683  -0.899
  183    HA   ALA  21           HA       ALA  21  -7.055  20.359  -0.268
  184    HB1  ALA  21          1HB       ALA  21  -8.674  19.477  -1.718
  185    HB2  ALA  21          2HB       ALA  21  -9.159  18.237  -0.561
  186    HB3  ALA  21          3HB       ALA  21  -9.566  19.927  -0.265
  187    H    TRP  22           H        TRP  22  -8.020  17.573   1.708
  188    HA   TRP  22           HA       TRP  22  -9.214  18.880   3.825
  189    HB2  TRP  22          2HB       TRP  22  -9.179  16.441   3.610
  190    HB3  TRP  22          3HB       TRP  22  -7.447  16.425   3.931
  191    HD1  TRP  22           HD1      TRP  22  -6.660  16.839   6.459
  192    HE1  TRP  22           HE1      TRP  22  -7.913  16.635   8.699
  193    HE3  TRP  22           HE3      TRP  22 -11.461  16.778   4.702
  194    HZ2  TRP  22           HZ2      TRP  22 -10.582  16.470   9.601
  195    HZ3  TRP  22           HZ3      TRP  22 -13.306  16.594   6.319
  196    HH2  TRP  22           HH2      TRP  22 -12.874  16.442   8.717
  197    H    PHE  23           H        PHE  23  -5.767  18.235   3.302
  198    HA   PHE  23           HA       PHE  23  -4.969  19.482   5.757
  199    HB2  PHE  23          2HB       PHE  23  -3.465  17.846   5.026
  200    HB3  PHE  23          3HB       PHE  23  -3.511  18.412   3.360
  201    HD1  PHE  23           HD1      PHE  23  -2.260  19.207   6.745
  202    HD2  PHE  23           HD2      PHE  23  -1.972  20.004   2.574
  203    HE1  PHE  23           HE1      PHE  23  -0.212  20.512   7.139
  204    HE2  PHE  23           HE2      PHE  23   0.077  21.310   2.961
  205    HZ   PHE  23           HZ       PHE  23   0.960  21.564   5.246
  206    H    LYS  24           H        LYS  24  -5.436  20.499   2.461
  207    HA   LYS  24           HA       LYS  24  -3.938  22.873   2.489
  208    HB2  LYS  24          2HB       LYS  24  -4.827  21.884   0.431
  209    HB3  LYS  24          3HB       LYS  24  -6.468  22.230   0.961
  210    HG2  LYS  24          2HG       LYS  24  -6.153  24.011  -0.400
  211    HG3  LYS  24          3HG       LYS  24  -5.502  24.696   1.091
  212    HD2  LYS  24          2HD       LYS  24  -3.239  23.824   0.311
  213    HD3  LYS  24          3HD       LYS  24  -4.002  23.567  -1.260
  214    HE2  LYS  24          2HE       LYS  24  -4.025  26.212   0.179
  215    HE3  LYS  24          3HE       LYS  24  -2.775  25.753  -0.975
  216    HZ1  LYS  24          1HZ       LYS  24  -5.341  25.299  -2.075
  217    HZ2  LYS  24          2HZ       LYS  24  -4.102  26.299  -2.645
  218    HZ3  LYS  24          3HZ       LYS  24  -5.227  26.897  -1.533
  219    H    ASN  25           H        ASN  25  -7.078  22.089   3.778
  220    HA   ASN  25           HA       ASN  25  -7.867  24.825   4.190
  221    HB2  ASN  25          2HB       ASN  25  -9.006  22.200   5.161
  222    HB3  ASN  25          3HB       ASN  25  -9.714  23.764   5.551
  223   HD21  ASN  25          1HD2      ASN  25  -9.941  21.212   3.542
  224   HD22  ASN  25          2HD2      ASN  25 -10.704  21.963   2.185
  225    H    LYS  26           H        LYS  26  -5.768  22.713   5.743
  226    HA   LYS  26           HA       LYS  26  -6.154  23.880   8.390
  227    HB2  LYS  26          2HB       LYS  26  -4.058  21.863   7.605
  228    HB3  LYS  26          3HB       LYS  26  -4.689  22.201   9.211
  229    HG2  LYS  26          2HG       LYS  26  -6.288  20.993   6.964
  230    HG3  LYS  26          3HG       LYS  26  -5.507  20.077   8.255
  231    HD2  LYS  26          2HD       LYS  26  -6.963  20.865   9.872
  232    HD3  LYS  26          3HD       LYS  26  -7.388  22.300   8.936
  233    HE2  LYS  26          2HE       LYS  26  -8.448  20.667   7.272
  234    HE3  LYS  26          3HE       LYS  26  -8.312  19.467   8.557
  235    HZ1  LYS  26          1HZ       LYS  26  -9.491  21.952   9.406
  236    HZ2  LYS  26          2HZ       LYS  26 -10.009  20.363   9.669
  237    HZ3  LYS  26          3HZ       LYS  26 -10.393  21.149   8.221
  238    H    HIS  27           H        HIS  27  -3.951  23.965   5.683
  239    HA   HIS  27           HA       HIS  27  -2.549  26.200   6.951
  240    HB2  HIS  27          2HB       HIS  27  -1.117  23.926   5.563
  241    HB3  HIS  27          3HB       HIS  27  -0.368  25.351   6.277
  242    HD1  HIS  27           HD1      HIS  27  -2.173  22.187   7.257
  243    HD2  HIS  27           HD2      HIS  27   0.132  25.184   8.978
  244    HE1  HIS  27           HE1      HIS  27  -1.677  21.396   9.592
  245    H    GLY  28           H        GLY  28  -2.981  24.296   3.980
  246    HA2  GLY  28          2HA       GLY  28  -3.751  25.264   1.945
  247    HA3  GLY  28          3HA       GLY  28  -3.137  26.819   2.487
  248    H    TYR  29           H        TYR  29  -1.220  23.924   2.762
  249    HA   TYR  29           HA       TYR  29   0.425  24.829   0.493
  250    HB2  TYR  29          2HB       TYR  29   1.278  23.997   3.255
  251    HB3  TYR  29          3HB       TYR  29   2.381  23.880   1.889
  252    HD1  TYR  29           HD1      TYR  29   0.125  26.344   3.560
  253    HD2  TYR  29           HD2      TYR  29   3.724  25.696   1.385
  254    HE1  TYR  29           HE1      TYR  29   0.717  28.715   3.843
  255    HE2  TYR  29           HE2      TYR  29   4.326  28.064   1.663
  256    HH   TYR  29           HH       TYR  29   2.852  30.091   3.856
  257    H    TYR  30           H        TYR  30   2.246  22.876   0.312
  258    HA   TYR  30           HA       TYR  30   0.895  20.295   0.367
  259    HB2  TYR  30          2HB       TYR  30   2.154  21.137  -2.221
  260    HB3  TYR  30          3HB       TYR  30   0.964  19.875  -1.924
  261    HD1  TYR  30           HD1      TYR  30  -1.366  20.339  -2.009
  262    HD2  TYR  30           HD2      TYR  30   1.444  23.528  -2.208
  263    HE1  TYR  30           HE1      TYR  30  -3.168  21.878  -2.665
  264    HE2  TYR  30           HE2      TYR  30  -0.351  25.076  -2.864
  265    HH   TYR  30           HH       TYR  30  -3.567  23.945  -3.622
  266    HA   PRO  31           HA       PRO  31   5.581  19.675  -0.644
  267    HB2  PRO  31          2HB       PRO  31   7.107  21.907  -0.885
  268    HB3  PRO  31          3HB       PRO  31   6.270  21.164  -2.253
  269    HG2  PRO  31          2HG       PRO  31   5.467  23.525  -0.598
  270    HG3  PRO  31          3HG       PRO  31   5.386  23.312  -2.356
  271    HD2  PRO  31          2HD       PRO  31   3.223  23.026  -0.753
  272    HD3  PRO  31          3HD       PRO  31   3.437  22.087  -2.244
  273    H    TRP  32           H        TRP  32   7.818  20.643   0.470
  274    HA   TRP  32           HA       TRP  32   7.218  20.513   3.292
  275    HB2  TRP  32          2HB       TRP  32   9.480  20.044   3.620
  276    HB3  TRP  32          3HB       TRP  32   9.168  19.359   2.027
  277    HD1  TRP  32           HD1      TRP  32  11.219  21.997   3.787
  278    HE1  TRP  32           HE1      TRP  32  12.814  23.104   2.097
  279    HE3  TRP  32           HE3      TRP  32   9.318  20.029  -0.532
  280    HZ2  TRP  32           HZ2      TRP  32  13.213  23.139  -0.697
  281    HZ3  TRP  32           HZ3      TRP  32  10.364  20.651  -2.671
  282    HH2  TRP  32           HH2      TRP  32  12.270  22.174  -2.750
  283    H    GLU  33           H        GLU  33   7.092  22.981   1.223
  284    HA   GLU  33           HA       GLU  33   8.540  24.954   2.781
  285    HB2  GLU  33          2HB       GLU  33   6.671  25.478   0.474
  286    HB3  GLU  33          3HB       GLU  33   7.952  26.518   1.081
  287    HG2  GLU  33          2HG       GLU  33   9.636  25.016   0.273
  288    HG3  GLU  33          3HG       GLU  33   8.415  23.832  -0.190
  289    H    ILE  34           H        ILE  34   6.702  23.764   4.387
  290    HA   ILE  34           HA       ILE  34   4.360  25.510   4.483
  291    HB   ILE  34           HB       ILE  34   5.039  23.108   6.184
  292   HG12  ILE  34          2HG1      ILE  34   2.812  23.137   4.201
  293   HG13  ILE  34          3HG1      ILE  34   4.454  22.960   3.591
  294   HG21  ILE  34          1HG2      ILE  34   2.440  24.616   5.943
  295   HG22  ILE  34          2HG2      ILE  34   2.762  23.225   6.977
  296   HG23  ILE  34          3HG2      ILE  34   3.572  24.760   7.287
  297   HD11  ILE  34          1HD1      ILE  34   3.102  21.176   5.601
  298   HD12  ILE  34          2HD1      ILE  34   3.424  20.800   3.908
  299   HD13  ILE  34          3HD1      ILE  34   4.763  21.008   5.036
  300    HA   PRO  35           HA       PRO  35   6.237  28.103   7.535
  301    HB2  PRO  35          2HB       PRO  35   3.982  29.385   8.337
  302    HB3  PRO  35          3HB       PRO  35   4.791  29.732   6.804
  303    HG2  PRO  35          2HG       PRO  35   2.391  28.024   7.335
  304    HG3  PRO  35          3HG       PRO  35   2.666  29.190   6.028
  305    HD2  PRO  35          2HD       PRO  35   2.943  26.519   5.680
  306    HD3  PRO  35          3HD       PRO  35   3.929  27.704   4.799
  307    H    ARG  36           H        ARG  36   5.307  28.913   9.865
  308    HA   ARG  36           HA       ARG  36   5.524  26.664  11.547
  309    HB2  ARG  36          2HB       ARG  36   4.527  29.439  12.221
  310    HB3  ARG  36          3HB       ARG  36   5.057  28.227  13.381
  311    HG2  ARG  36          2HG       ARG  36   7.036  29.241  13.258
  312    HG3  ARG  36          3HG       ARG  36   7.213  28.404  11.714
  313    HD2  ARG  36          2HD       ARG  36   6.890  30.288  10.504
  314    HD3  ARG  36          3HD       ARG  36   5.718  30.945  11.645
  315    HE   ARG  36           HE       ARG  36   8.537  31.444  11.589
  316   HH11  ARG  36          1HH1      ARG  36   5.728  31.280  13.639
  317   HH12  ARG  36          2HH1      ARG  36   6.374  32.359  14.831
  318   HH21  ARG  36          1HH2      ARG  36   9.398  32.865  13.151
  319   HH22  ARG  36          2HH2      ARG  36   8.462  33.261  14.552
  320    H    CYS  37           H        CYS  37   3.907  26.179  13.316
  321    HA   CYS  37           HA       CYS  37   1.342  25.644  12.062
  322    HB2  CYS  37          2HB       CYS  37   2.886  24.537  14.319
  323    HB3  CYS  37          3HB       CYS  37   1.142  24.564  14.554
  324    HG   CYS  37           HG       CYS  37   2.538  22.128  13.394
  Start of MODEL    6
    1    H    MET   1           H        MET   1   2.122  -0.940   0.259
    2    HA   MET   1           HA       MET   1   1.915  -0.741  -2.652
    3    HB2  MET   1          2HB       MET   1   0.288   0.657  -0.523
    4    HB3  MET   1          3HB       MET   1  -0.045   0.646  -2.249
    5    HG2  MET   1          2HG       MET   1  -1.185  -1.238  -2.079
    6    HG3  MET   1          3HG       MET   1   0.163  -2.040  -1.276
    7    HE1  MET   1          1HE       MET   1  -2.014  -3.352  -0.485
    8    HE2  MET   1          2HE       MET   1  -0.872  -3.429   0.857
    9    HE3  MET   1          3HE       MET   1  -2.572  -3.069   1.164
   10    H    LYS   2           H        LYS   2   4.246   0.104  -2.416
   11    HA   LYS   2           HA       LYS   2   4.108   3.004  -2.582
   12    HB2  LYS   2          2HB       LYS   2   5.774   1.511  -0.580
   13    HB3  LYS   2          3HB       LYS   2   6.316   3.062  -1.207
   14    HG2  LYS   2          2HG       LYS   2   3.888   3.809  -0.512
   15    HG3  LYS   2          3HG       LYS   2   4.029   2.429   0.579
   16    HD2  LYS   2          2HD       LYS   2   6.343   3.492   1.161
   17    HD3  LYS   2          3HD       LYS   2   5.619   4.959   0.499
   18    HE2  LYS   2          2HE       LYS   2   3.744   3.718   2.252
   19    HE3  LYS   2          3HE       LYS   2   5.294   3.845   3.081
   20    HZ1  LYS   2          1HZ       LYS   2   3.504   5.954   2.154
   21    HZ2  LYS   2          2HZ       LYS   2   5.164   6.259   2.049
   22    HZ3  LYS   2          3HZ       LYS   2   4.466   5.885   3.544
   23    H    PHE   3           H        PHE   3   4.304   1.820  -4.805
   24    HA   PHE   3           HA       PHE   3   7.156   1.485  -5.453
   25    HB2  PHE   3          2HB       PHE   3   4.663   0.271  -6.582
   26    HB3  PHE   3          3HB       PHE   3   6.079   0.444  -7.614
   27    HD1  PHE   3           HD1      PHE   3   7.164  -1.555  -7.870
   28    HD2  PHE   3           HD2      PHE   3   5.578  -0.548  -4.050
   29    HE1  PHE   3           HE1      PHE   3   8.096  -3.633  -6.939
   30    HE2  PHE   3           HE2      PHE   3   6.508  -2.624  -3.113
   31    HZ   PHE   3           HZ       PHE   3   7.770  -4.169  -4.557
   32    H    LYS   4           H        LYS   4   7.639   2.095  -7.810
   33    HA   LYS   4           HA       LYS   4   6.350   4.683  -8.387
   34    HB2  LYS   4          2HB       LYS   4   9.172   3.915  -9.128
   35    HB3  LYS   4          3HB       LYS   4   8.441   5.513  -9.194
   36    HG2  LYS   4          2HG       LYS   4   9.403   5.865  -7.222
   37    HG3  LYS   4          3HG       LYS   4   8.147   4.819  -6.554
   38    HD2  LYS   4          2HD       LYS   4   9.622   2.879  -6.852
   39    HD3  LYS   4          3HD       LYS   4  10.878   3.939  -7.495
   40    HE2  LYS   4          2HE       LYS   4   9.681   4.424  -4.790
   41    HE3  LYS   4          3HE       LYS   4  10.978   3.250  -5.009
   42    HZ1  LYS   4          1HZ       LYS   4  11.499   5.791  -6.254
   43    HZ2  LYS   4          2HZ       LYS   4  12.485   4.860  -5.243
   44    HZ3  LYS   4          3HZ       LYS   4  11.325   5.894  -4.574
   45    H    PHE   5           H        PHE   5   7.517   1.659  -9.679
   46    HA   PHE   5           HA       PHE   5   6.919   2.418 -12.416
   47    HB2  PHE   5          2HB       PHE   5   7.894  -0.172 -11.200
   48    HB3  PHE   5          3HB       PHE   5   7.614   0.061 -12.923
   49    HD1  PHE   5           HD1      PHE   5   8.822   2.229 -13.902
   50    HD2  PHE   5           HD2      PHE   5  10.036   0.079 -10.435
   51    HE1  PHE   5           HE1      PHE   5  11.103   3.117 -14.154
   52    HE2  PHE   5           HE2      PHE   5  12.318   0.965 -10.681
   53    HZ   PHE   5           HZ       PHE   5  12.854   2.486 -12.541
   54    H    ASN   6           H        ASN   6   5.534   0.508  -9.827
   55    HA   ASN   6           HA       ASN   6   3.658  -0.998 -11.180
   56    HB2  ASN   6          2HB       ASN   6   3.934   0.067  -8.448
   57    HB3  ASN   6          3HB       ASN   6   2.279  -0.296  -8.927
   58   HD21  ASN   6          1HD2      ASN   6   1.651  -2.246  -8.398
   59   HD22  ASN   6          2HD2      ASN   6   2.648  -3.654  -8.305
   60    HA   PRO   7           HA       PRO   7   0.606   1.688 -12.828
   61    HB2  PRO   7          2HB       PRO   7  -1.698   0.351 -12.305
   62    HB3  PRO   7          3HB       PRO   7  -0.532  -0.183 -13.521
   63    HG2  PRO   7          2HG       PRO   7  -0.918  -1.150 -10.715
   64    HG3  PRO   7          3HG       PRO   7  -0.632  -2.088 -12.192
   65    HD2  PRO   7          2HD       PRO   7   1.333  -1.541 -10.411
   66    HD3  PRO   7          3HD       PRO   7   1.639  -1.696 -12.153
   67    H    THR   8           H        THR   8   0.056   0.597  -9.517
   68    HA   THR   8           HA       THR   8  -1.977   2.370  -8.794
   69    HB   THR   8           HB       THR   8  -1.084   0.407  -7.440
   70    HG1  THR   8           HG1      THR   8  -2.422   1.365  -6.116
   71   HG21  THR   8          1HG2      THR   8   0.686   0.851  -5.850
   72   HG22  THR   8          2HG2      THR   8   0.863   2.497  -6.458
   73   HG23  THR   8          3HG2      THR   8   1.289   1.127  -7.484
   74    H    GLY   9           H        GLY   9   1.336   2.954  -9.453
   75    HA2  GLY   9          2HA       GLY   9   1.978   5.109  -7.850
   76    HA3  GLY   9          3HA       GLY   9   2.548   4.905  -9.500
   77    H    THR  10           H        THR  10   0.094   5.114 -10.848
   78    HA   THR  10           HA       THR  10  -0.187   7.965 -10.897
   79    HB   THR  10           HB       THR  10  -1.793   5.876 -12.382
   80    HG1  THR  10           HG1      THR  10  -0.295   6.169 -14.018
   81   HG21  THR  10          1HG2      THR  10  -2.927   7.542 -13.343
   82   HG22  THR  10          2HG2      THR  10  -1.444   8.434 -13.685
   83   HG23  THR  10          3HG2      THR  10  -2.241   8.615 -12.123
   84    H    ILE  11           H        ILE  11  -2.412   5.279 -10.168
   85    HA   ILE  11           HA       ILE  11  -4.661   6.765  -9.525
   86    HB   ILE  11           HB       ILE  11  -3.751   4.166  -8.285
   87   HG12  ILE  11          2HG1      ILE  11  -5.820   3.632 -10.026
   88   HG13  ILE  11          3HG1      ILE  11  -4.928   4.894 -10.869
   89   HG21  ILE  11          1HG2      ILE  11  -6.124   3.835  -7.732
   90   HG22  ILE  11          2HG2      ILE  11  -5.435   5.232  -6.906
   91   HG23  ILE  11          3HG2      ILE  11  -6.473   5.463  -8.313
   92   HD11  ILE  11          1HD1      ILE  11  -2.868   3.386 -10.257
   93   HD12  ILE  11          2HD1      ILE  11  -4.105   2.131 -10.165
   94   HD13  ILE  11          3HD1      ILE  11  -3.877   3.037 -11.660
   95    H    VAL  12           H        VAL  12  -2.189   5.522  -7.273
   96    HA   VAL  12           HA       VAL  12  -3.164   6.651  -4.939
   97    HB   VAL  12           HB       VAL  12  -0.285   6.185  -5.725
   98   HG11  VAL  12          1HG1      VAL  12  -0.374   7.756  -3.891
   99   HG12  VAL  12          2HG1      VAL  12  -1.497   6.714  -3.014
  100   HG13  VAL  12          3HG1      VAL  12   0.162   6.185  -3.297
  101   HG21  VAL  12          1HG2      VAL  12  -2.137   4.297  -5.548
  102   HG22  VAL  12          2HG2      VAL  12  -0.490   4.041  -4.973
  103   HG23  VAL  12          3HG2      VAL  12  -1.769   4.446  -3.829
  104    H    LYS  13           H        LYS  13  -1.363   8.123  -7.544
  105    HA   LYS  13           HA       LYS  13  -0.733  10.527  -6.109
  106    HB2  LYS  13          2HB       LYS  13   0.629  10.883  -7.844
  107    HB3  LYS  13          3HB       LYS  13   0.081   9.351  -8.512
  108    HG2  LYS  13          2HG       LYS  13  -1.694  10.513  -9.724
  109    HG3  LYS  13          3HG       LYS  13  -1.140  12.050  -9.056
  110    HD2  LYS  13          2HD       LYS  13   0.827  10.340 -10.493
  111    HD3  LYS  13          3HD       LYS  13  -0.370  11.221 -11.445
  112    HE2  LYS  13          2HE       LYS  13   0.362  13.256 -10.013
  113    HE3  LYS  13          3HE       LYS  13   1.790  12.282  -9.663
  114    HZ1  LYS  13          1HZ       LYS  13   2.394  13.516 -11.513
  115    HZ2  LYS  13          2HZ       LYS  13   0.884  13.356 -12.258
  116    HZ3  LYS  13          3HZ       LYS  13   1.938  12.034 -12.190
  117    H    LYS  14           H        LYS  14  -3.301   9.446  -8.237
  118    HA   LYS  14           HA       LYS  14  -4.470  12.051  -8.544
  119    HB2  LYS  14          2HB       LYS  14  -5.535   9.285  -9.136
  120    HB3  LYS  14          3HB       LYS  14  -6.382  10.774  -9.535
  121    HG2  LYS  14          2HG       LYS  14  -3.727   9.861 -10.620
  122    HG3  LYS  14          3HG       LYS  14  -5.262   9.945 -11.488
  123    HD2  LYS  14          2HD       LYS  14  -5.280  12.396 -11.128
  124    HD3  LYS  14          3HD       LYS  14  -3.691  12.268 -10.370
  125    HE2  LYS  14          2HE       LYS  14  -3.072  11.050 -12.609
  126    HE3  LYS  14          3HE       LYS  14  -4.472  11.923 -13.230
  127    HZ1  LYS  14          1HZ       LYS  14  -3.200  13.704 -13.433
  128    HZ2  LYS  14          2HZ       LYS  14  -1.874  12.886 -12.774
  129    HZ3  LYS  14          3HZ       LYS  14  -2.938  13.727 -11.762
  130    H    LEU  15           H        LEU  15  -5.310   9.128  -6.699
  131    HA   LEU  15           HA       LEU  15  -7.617  10.083  -5.471
  132    HB2  LEU  15          2HB       LEU  15  -5.583   8.020  -4.764
  133    HB3  LEU  15          3HB       LEU  15  -6.806   8.461  -3.574
  134    HG   LEU  15           HG       LEU  15  -7.241   6.414  -5.047
  135   HD11  LEU  15          1HD1      LEU  15  -9.640   7.860  -5.497
  136   HD12  LEU  15          2HD1      LEU  15  -8.944   8.410  -3.973
  137   HD13  LEU  15          3HD1      LEU  15  -9.276   6.696  -4.223
  138   HD21  LEU  15          1HD2      LEU  15  -7.914   8.584  -7.032
  139   HD22  LEU  15          2HD2      LEU  15  -8.235   6.860  -7.220
  140   HD23  LEU  15          3HD2      LEU  15  -6.573   7.448  -7.169
  141    H    THR  16           H        THR  16  -4.249  10.629  -4.711
  142    HA   THR  16           HA       THR  16  -4.710  11.769  -2.129
  143    HB   THR  16           HB       THR  16  -2.310  12.003  -3.954
  144    HG1  THR  16           HG1      THR  16  -2.590  10.404  -1.623
  145   HG21  THR  16          1HG2      THR  16  -1.601  13.574  -2.532
  146   HG22  THR  16          2HG2      THR  16  -1.507  12.307  -1.308
  147   HG23  THR  16          3HG2      THR  16  -2.961  13.295  -1.445
  148    H    GLN  17           H        GLN  17  -4.646  12.977  -5.396
  149    HA   GLN  17           HA       GLN  17  -4.208  15.684  -4.974
  150    HB2  GLN  17          2HB       GLN  17  -4.856  14.114  -7.136
  151    HB3  GLN  17          3HB       GLN  17  -6.288  15.118  -6.959
  152    HG2  GLN  17          2HG       GLN  17  -5.162  17.056  -7.436
  153    HG3  GLN  17          3HG       GLN  17  -3.609  16.410  -6.909
  154   HE21  GLN  17          1HE2      GLN  17  -2.261  15.610  -8.387
  155   HE22  GLN  17          2HE2      GLN  17  -2.642  15.370 -10.055
  156    H    TYR  18           H        TYR  18  -6.975  13.742  -4.231
  157    HA   TYR  18           HA       TYR  18  -8.643  16.094  -3.752
  158    HB2  TYR  18          2HB       TYR  18  -9.291  13.144  -3.579
  159    HB3  TYR  18          3HB       TYR  18 -10.445  14.450  -3.328
  160    HD1  TYR  18           HD1      TYR  18  -8.127  13.026  -5.869
  161    HD2  TYR  18           HD2      TYR  18 -11.623  15.338  -5.138
  162    HE1  TYR  18           HE1      TYR  18  -8.602  13.059  -8.282
  163    HE2  TYR  18           HE2      TYR  18 -12.109  15.377  -7.549
  164    HH   TYR  18           HH       TYR  18 -10.648  13.343  -9.752
  165    H    GLU  19           H        GLU  19  -6.835  13.651  -2.066
  166    HA   GLU  19           HA       GLU  19  -8.037  14.056   0.492
  167    HB2  GLU  19          2HB       GLU  19  -5.367  12.846  -0.249
  168    HB3  GLU  19          3HB       GLU  19  -6.101  12.773   1.347
  169    HG2  GLU  19          2HG       GLU  19  -7.420  11.667  -1.114
  170    HG3  GLU  19          3HG       GLU  19  -6.350  10.721  -0.082
  171    H    ILE  20           H        ILE  20  -5.236  15.376  -1.182
  172    HA   ILE  20           HA       ILE  20  -3.952  16.669   0.900
  173    HB   ILE  20           HB       ILE  20  -4.275  17.675  -1.930
  174   HG12  ILE  20          2HG1      ILE  20  -1.774  16.369  -1.046
  175   HG13  ILE  20          3HG1      ILE  20  -3.173  15.310  -1.187
  176   HG21  ILE  20          1HG2      ILE  20  -3.141  19.464  -1.268
  177   HG22  ILE  20          2HG2      ILE  20  -2.992  18.813   0.364
  178   HG23  ILE  20          3HG2      ILE  20  -1.786  18.412  -0.859
  179   HD11  ILE  20          1HD1      ILE  20  -1.511  16.461  -3.244
  180   HD12  ILE  20          2HD1      ILE  20  -2.679  15.143  -3.338
  181   HD13  ILE  20          3HD1      ILE  20  -3.219  16.813  -3.511
  182    H    ALA  21           H        ALA  21  -6.867  17.565  -0.817
  183    HA   ALA  21           HA       ALA  21  -7.123  20.234  -0.181
  184    HB1  ALA  21          1HB       ALA  21  -9.083  18.036  -0.629
  185    HB2  ALA  21          2HB       ALA  21  -9.666  19.596  -0.047
  186    HB3  ALA  21          3HB       ALA  21  -8.788  19.497  -1.573
  187    H    TRP  22           H        TRP  22  -8.015  17.424   1.796
  188    HA   TRP  22           HA       TRP  22  -9.225  18.701   3.923
  189    HB2  TRP  22          2HB       TRP  22  -9.166  16.276   3.737
  190    HB3  TRP  22          3HB       TRP  22  -7.420  16.274   3.973
  191    HD1  TRP  22           HD1      TRP  22  -6.516  16.737   6.465
  192    HE1  TRP  22           HE1      TRP  22  -7.654  16.493   8.761
  193    HE3  TRP  22           HE3      TRP  22 -11.389  16.516   4.936
  194    HZ2  TRP  22           HZ2      TRP  22 -10.271  16.241   9.788
  195    HZ3  TRP  22           HZ3      TRP  22 -13.150  16.273   6.638
  196    HH2  TRP  22           HH2      TRP  22 -12.600  16.138   9.013
  197    H    PHE  23           H        PHE  23  -5.768  18.135   3.378
  198    HA   PHE  23           HA       PHE  23  -4.984  19.396   5.830
  199    HB2  PHE  23          2HB       PHE  23  -3.448  17.796   5.087
  200    HB3  PHE  23          3HB       PHE  23  -3.516  18.364   3.422
  201    HD1  PHE  23           HD1      PHE  23  -2.020  19.994   2.631
  202    HD2  PHE  23           HD2      PHE  23  -2.261  19.178   6.801
  203    HE1  PHE  23           HE1      PHE  23   0.002  21.345   3.009
  204    HE2  PHE  23           HE2      PHE  23  -0.241  20.528   7.186
  205    HZ   PHE  23           HZ       PHE  23   0.893  21.614   5.289
  206    H    LYS  24           H        LYS  24  -5.493  20.408   2.538
  207    HA   LYS  24           HA       LYS  24  -4.050  22.815   2.562
  208    HB2  LYS  24          2HB       LYS  24  -4.927  21.808   0.507
  209    HB3  LYS  24          3HB       LYS  24  -6.572  22.117   1.047
  210    HG2  LYS  24          2HG       LYS  24  -6.306  23.907  -0.313
  211    HG3  LYS  24          3HG       LYS  24  -5.661  24.604   1.175
  212    HD2  LYS  24          2HD       LYS  24  -3.384  23.784   0.380
  213    HD3  LYS  24          3HD       LYS  24  -4.151  23.511  -1.186
  214    HE2  LYS  24          2HE       LYS  24  -4.224  26.154   0.256
  215    HE3  LYS  24          3HE       LYS  24  -2.971  25.724  -0.908
  216    HZ1  LYS  24          1HZ       LYS  24  -4.328  26.432  -2.489
  217    HZ2  LYS  24          2HZ       LYS  24  -5.591  26.674  -1.389
  218    HZ3  LYS  24          3HZ       LYS  24  -5.389  25.165  -2.127
  219    H    ASN  25           H        ASN  25  -7.164  21.957   3.867
  220    HA   ASN  25           HA       ASN  25  -8.014  24.673   4.288
  221    HB2  ASN  25          2HB       ASN  25  -9.089  22.035   5.302
  222    HB3  ASN  25          3HB       ASN  25  -9.844  23.593   5.626
  223   HD21  ASN  25          1HD2      ASN  25 -10.142  20.977   3.803
  224   HD22  ASN  25          2HD2      ASN  25 -10.842  21.650   2.374
  225    H    LYS  26           H        LYS  26  -5.858  22.608   5.826
  226    HA   LYS  26           HA       LYS  26  -6.256  23.765   8.476
  227    HB2  LYS  26          2HB       LYS  26  -4.122  21.793   7.676
  228    HB3  LYS  26          3HB       LYS  26  -4.746  22.119   9.287
  229    HG2  LYS  26          2HG       LYS  26  -6.343  20.879   7.056
  230    HG3  LYS  26          3HG       LYS  26  -5.525  19.976   8.335
  231    HD2  LYS  26          2HD       LYS  26  -6.944  20.832   9.996
  232    HD3  LYS  26          3HD       LYS  26  -7.514  22.140   8.957
  233    HE2  LYS  26          2HE       LYS  26  -8.419  20.223   7.466
  234    HE3  LYS  26          3HE       LYS  26  -8.232  19.232   8.912
  235    HZ1  LYS  26          1HZ       LYS  26 -10.131  21.367   8.357
  236    HZ2  LYS  26          2HZ       LYS  26  -9.527  21.298   9.935
  237    HZ3  LYS  26          3HZ       LYS  26 -10.322  19.959   9.275
  238    H    HIS  27           H        HIS  27  -4.070  23.899   5.757
  239    HA   HIS  27           HA       HIS  27  -2.711  26.164   7.020
  240    HB2  HIS  27          2HB       HIS  27  -1.237  23.924   5.620
  241    HB3  HIS  27          3HB       HIS  27  -0.516  25.364   6.333
  242    HD1  HIS  27           HD1      HIS  27  -2.247  22.160   7.317
  243    HD2  HIS  27           HD2      HIS  27   0.006  25.202   9.029
  244    HE1  HIS  27           HE1      HIS  27  -1.719  21.376   9.648
  245    H    GLY  28           H        GLY  28  -3.118  24.254   4.049
  246    HA2  GLY  28          2HA       GLY  28  -3.921  25.208   2.020
  247    HA3  GLY  28          3HA       GLY  28  -3.339  26.776   2.561
  248    H    TYR  29           H        TYR  29  -1.355  23.925   2.821
  249    HA   TYR  29           HA       TYR  29   0.256  24.870   0.543
  250    HB2  TYR  29          2HB       TYR  29   1.143  24.054   3.299
  251    HB3  TYR  29          3HB       TYR  29   2.241  23.964   1.926
  252    HD1  TYR  29           HD1      TYR  29  -0.061  26.373   3.615
  253    HD2  TYR  29           HD2      TYR  29   3.539  25.811   1.418
  254    HE1  TYR  29           HE1      TYR  29   0.477  28.756   3.899
  255    HE2  TYR  29           HE2      TYR  29   4.087  28.192   1.696
  256    HH   TYR  29           HH       TYR  29   1.819  30.474   2.881
  257    H    TYR  30           H        TYR  30   2.120  22.959   0.350
  258    HA   TYR  30           HA       TYR  30   0.828  20.348   0.408
  259    HB2  TYR  30          2HB       TYR  30   2.053  21.222  -2.186
  260    HB3  TYR  30          3HB       TYR  30   0.894  19.932  -1.883
  261    HD1  TYR  30           HD1      TYR  30  -1.446  20.343  -1.955
  262    HD2  TYR  30           HD2      TYR  30   1.288  23.596  -2.165
  263    HE1  TYR  30           HE1      TYR  30  -3.288  21.841  -2.598
  264    HE2  TYR  30           HE2      TYR  30  -0.545  25.103  -2.808
  265    HH   TYR  30           HH       TYR  30  -3.398  24.141  -3.960
  266    HA   PRO  31           HA       PRO  31   5.521  19.836  -0.630
  267    HB2  PRO  31          2HB       PRO  31   6.994  22.103  -0.876
  268    HB3  PRO  31          3HB       PRO  31   6.167  21.342  -2.240
  269    HG2  PRO  31          2HG       PRO  31   5.320  23.683  -0.577
  270    HG3  PRO  31          3HG       PRO  31   5.234  23.470  -2.335
  271    HD2  PRO  31          2HD       PRO  31   3.087  23.133  -0.720
  272    HD3  PRO  31          3HD       PRO  31   3.314  22.201  -2.214
  273    H    TRP  32           H        TRP  32   7.742  20.854   0.473
  274    HA   TRP  32           HA       TRP  32   7.160  20.706   3.298
  275    HB2  TRP  32          2HB       TRP  32   9.435  20.288   3.612
  276    HB3  TRP  32          3HB       TRP  32   9.129  19.598   2.021
  277    HD1  TRP  32           HD1      TRP  32  11.130  22.280   3.773
  278    HE1  TRP  32           HE1      TRP  32  12.689  23.425   2.075
  279    HE3  TRP  32           HE3      TRP  32   9.250  20.275  -0.538
  280    HZ2  TRP  32           HZ2      TRP  32  13.071  23.473  -0.721
  281    HZ3  TRP  32           HZ3      TRP  32  10.269  20.923  -2.682
  282    HH2  TRP  32           HH2      TRP  32  12.139  22.489  -2.770
  283    H    GLU  33           H        GLU  33   6.967  23.173   1.233
  284    HA   GLU  33           HA       GLU  33   8.378  25.176   2.787
  285    HB2  GLU  33          2HB       GLU  33   6.485  25.661   0.491
  286    HB3  GLU  33          3HB       GLU  33   7.745  26.729   1.093
  287    HG2  GLU  33          2HG       GLU  33   9.458  25.266   0.273
  288    HG3  GLU  33          3HG       GLU  33   8.262  24.056  -0.186
  289    H    ILE  34           H        ILE  34   6.577  23.942   4.401
  290    HA   ILE  34           HA       ILE  34   4.196  25.634   4.513
  291    HB   ILE  34           HB       ILE  34   4.939  23.246   6.206
  292   HG12  ILE  34          2HG1      ILE  34   2.701  23.226   4.236
  293   HG13  ILE  34          3HG1      ILE  34   4.343  23.090   3.616
  294   HG21  ILE  34          1HG2      ILE  34   3.441  24.863   7.319
  295   HG22  ILE  34          2HG2      ILE  34   2.306  24.695   5.981
  296   HG23  ILE  34          3HG2      ILE  34   2.664  23.310   7.012
  297   HD11  ILE  34          1HD1      ILE  34   4.724  21.099   4.858
  298   HD12  ILE  34          2HD1      ILE  34   3.208  21.293   5.740
  299   HD13  ILE  34          3HD1      ILE  34   3.185  20.924   4.016
  300    HA   PRO  35           HA       PRO  35   6.031  28.265   7.558
  301    HB2  PRO  35          2HB       PRO  35   3.752  29.495   8.375
  302    HB3  PRO  35          3HB       PRO  35   4.545  29.862   6.838
  303    HG2  PRO  35          2HG       PRO  35   2.186  28.099   7.379
  304    HG3  PRO  35          3HG       PRO  35   2.429  29.273   6.073
  305    HD2  PRO  35          2HD       PRO  35   2.764  26.610   5.719
  306    HD3  PRO  35          3HD       PRO  35   3.718  27.818   4.834
  307    H    ARG  36           H        ARG  36   5.096  29.050   9.895
  308    HA   ARG  36           HA       ARG  36   4.336  26.610  11.357
  309    HB2  ARG  36          2HB       ARG  36   5.818  27.491  13.222
  310    HB3  ARG  36          3HB       ARG  36   6.645  26.854  11.807
  311    HG2  ARG  36          2HG       ARG  36   6.092  29.734  11.718
  312    HG3  ARG  36          3HG       ARG  36   7.210  29.221  12.984
  313    HD2  ARG  36          2HD       ARG  36   8.812  28.604  11.507
  314    HD3  ARG  36          3HD       ARG  36   7.642  28.057  10.306
  315    HE   ARG  36           HE       ARG  36   7.700  30.137   9.350
  316   HH11  ARG  36          1HH1      ARG  36   9.145  30.288  12.514
  317   HH12  ARG  36          2HH1      ARG  36   9.723  31.909  12.316
  318   HH21  ARG  36          1HH2      ARG  36   8.456  32.272   9.077
  319   HH22  ARG  36          2HH2      ARG  36   9.330  33.037  10.361
  320    H    CYS  37           H        CYS  37   3.421  27.050  13.522
  321    HA   CYS  37           HA       CYS  37   1.880  29.561  13.506
  322    HB2  CYS  37          2HB       CYS  37   0.677  27.289  13.228
  323    HB3  CYS  37          3HB       CYS  37   1.016  27.062  14.940
  324    HG   CYS  37           HG       CYS  37  -0.313  29.575  15.562
  Start of MODEL    7
    1    H    MET   1           H        MET   1   6.994  -1.289  -0.688
    2    HA   MET   1           HA       MET   1   4.574  -0.008   0.009
    3    HB2  MET   1          2HB       MET   1   6.922  -0.283   1.259
    4    HB3  MET   1          3HB       MET   1   7.158   1.333   0.609
    5    HG2  MET   1          2HG       MET   1   6.258   1.797   2.659
    6    HG3  MET   1          3HG       MET   1   4.819   1.796   1.642
    7    HE1  MET   1          1HE       MET   1   5.110   1.766   4.569
    8    HE2  MET   1          2HE       MET   1   4.013   0.548   5.221
    9    HE3  MET   1          3HE       MET   1   5.757   0.283   5.274
   10    H    LYS   2           H        LYS   2   3.563   1.073  -1.609
   11    HA   LYS   2           HA       LYS   2   3.119   2.674  -3.166
   12    HB2  LYS   2          2HB       LYS   2   5.195   4.102  -1.503
   13    HB3  LYS   2          3HB       LYS   2   4.279   4.887  -2.782
   14    HG2  LYS   2          2HG       LYS   2   2.568   5.228  -1.421
   15    HG3  LYS   2          3HG       LYS   2   2.496   3.514  -1.005
   16    HD2  LYS   2          2HD       LYS   2   4.362   3.921   0.617
   17    HD3  LYS   2          3HD       LYS   2   4.190   5.647   0.289
   18    HE2  LYS   2          2HE       LYS   2   2.610   5.732   1.848
   19    HE3  LYS   2          3HE       LYS   2   1.606   4.699   0.832
   20    HZ1  LYS   2          1HZ       LYS   2   3.261   3.989   3.145
   21    HZ2  LYS   2          2HZ       LYS   2   3.051   2.835   1.927
   22    HZ3  LYS   2          3HZ       LYS   2   1.705   3.467   2.733
   23    H    PHE   3           H        PHE   3   4.286   0.974  -4.563
   24    HA   PHE   3           HA       PHE   3   6.879   1.303  -5.496
   25    HB2  PHE   3          2HB       PHE   3   4.391   0.124  -6.668
   26    HB3  PHE   3          3HB       PHE   3   5.816   0.301  -7.686
   27    HD1  PHE   3           HD1      PHE   3   5.305  -0.720  -4.133
   28    HD2  PHE   3           HD2      PHE   3   6.864  -1.716  -7.966
   29    HE1  PHE   3           HE1      PHE   3   6.214  -2.815  -3.215
   30    HE2  PHE   3           HE2      PHE   3   7.775  -3.812  -7.055
   31    HZ   PHE   3           HZ       PHE   3   7.450  -4.364  -4.677
   32    H    LYS   4           H        LYS   4   7.412   1.946  -7.827
   33    HA   LYS   4           HA       LYS   4   6.156   4.553  -8.388
   34    HB2  LYS   4          2HB       LYS   4   8.969   3.765  -9.136
   35    HB3  LYS   4          3HB       LYS   4   8.260   5.374  -9.149
   36    HG2  LYS   4          2HG       LYS   4   9.304   5.610  -7.188
   37    HG3  LYS   4          3HG       LYS   4   7.948   4.682  -6.543
   38    HD2  LYS   4          2HD       LYS   4   9.316   2.605  -7.020
   39    HD3  LYS   4          3HD       LYS   4  10.681   3.684  -7.318
   40    HE2  LYS   4          2HE       LYS   4   9.094   3.475  -4.760
   41    HE3  LYS   4          3HE       LYS   4  10.718   2.844  -5.031
   42    HZ1  LYS   4          1HZ       LYS   4  11.051   5.398  -5.702
   43    HZ2  LYS   4          2HZ       LYS   4  11.311   4.804  -4.141
   44    HZ3  LYS   4          3HZ       LYS   4   9.850   5.564  -4.523
   45    H    PHE   5           H        PHE   5   7.283   1.528  -9.710
   46    HA   PHE   5           HA       PHE   5   6.723   2.332 -12.442
   47    HB2  PHE   5          2HB       PHE   5   7.545  -0.360 -11.331
   48    HB3  PHE   5          3HB       PHE   5   7.468   0.069 -13.036
   49    HD1  PHE   5           HD1      PHE   5   9.726  -0.645 -10.693
   50    HD2  PHE   5           HD2      PHE   5   8.734   2.604 -13.258
   51    HE1  PHE   5           HE1      PHE   5  12.056   0.140 -10.594
   52    HE2  PHE   5           HE2      PHE   5  11.063   3.394 -13.163
   53    HZ   PHE   5           HZ       PHE   5  12.727   2.161 -11.831
   54    H    ASN   6           H        ASN   6   5.277   0.428  -9.885
   55    HA   ASN   6           HA       ASN   6   3.391  -1.037 -11.269
   56    HB2  ASN   6          2HB       ASN   6   3.653   0.007  -8.528
   57    HB3  ASN   6          3HB       ASN   6   1.998  -0.329  -9.028
   58   HD21  ASN   6          1HD2      ASN   6   1.489  -2.169  -8.060
   59   HD22  ASN   6          2HD2      ASN   6   2.404  -3.632  -8.141
   60    HA   PRO   7           HA       PRO   7   0.405   1.712 -12.934
   61    HB2  PRO   7          2HB       PRO   7  -1.928   0.412 -12.445
   62    HB3  PRO   7          3HB       PRO   7  -0.758  -0.134 -13.652
   63    HG2  PRO   7          2HG       PRO   7  -1.192  -1.112 -10.856
   64    HG3  PRO   7          3HG       PRO   7  -0.906  -2.046 -12.336
   65    HD2  PRO   7          2HD       PRO   7   1.048  -1.545 -10.530
   66    HD3  PRO   7          3HD       PRO   7   1.371  -1.693 -12.269
   67    H    THR   8           H        THR   8  -0.202   0.610  -9.637
   68    HA   THR   8           HA       THR   8  -2.211   2.413  -8.925
   69    HB   THR   8           HB       THR   8  -1.368   0.427  -7.574
   70    HG1  THR   8           HG1      THR   8  -2.792   1.497  -6.396
   71   HG21  THR   8          1HG2      THR   8   0.604   2.476  -6.556
   72   HG22  THR   8          2HG2      THR   8   1.017   1.105  -7.586
   73   HG23  THR   8          3HG2      THR   8   0.390   0.830  -5.960
   74    H    GLY   9           H        GLY   9   1.119   2.943  -9.542
   75    HA2  GLY   9          2HA       GLY   9   1.780   5.077  -7.918
   76    HA3  GLY   9          3HA       GLY   9   2.365   4.873  -9.563
   77    H    THR  10           H        THR  10  -0.070   5.134 -10.937
   78    HA   THR  10           HA       THR  10  -0.301   7.989 -10.970
   79    HB   THR  10           HB       THR  10  -1.925   5.937 -12.487
   80    HG1  THR  10           HG1      THR  10  -0.329   6.862 -14.172
   81   HG21  THR  10          1HG2      THR  10  -3.022   7.628 -13.446
   82   HG22  THR  10          2HG2      THR  10  -1.522   8.496 -13.771
   83   HG23  THR  10          3HG2      THR  10  -2.329   8.683 -12.215
   84    H    ILE  11           H        ILE  11  -2.580   5.338 -10.285
   85    HA   ILE  11           HA       ILE  11  -4.810   6.860  -9.657
   86    HB   ILE  11           HB       ILE  11  -3.960   4.237  -8.423
   87   HG12  ILE  11          2HG1      ILE  11  -6.018   3.752 -10.192
   88   HG13  ILE  11          3HG1      ILE  11  -5.092   5.001 -11.016
   89   HG21  ILE  11          1HG2      ILE  11  -5.642   5.324  -7.056
   90   HG22  ILE  11          2HG2      ILE  11  -6.657   5.584  -8.474
   91   HG23  ILE  11          3HG2      ILE  11  -6.346   3.945  -7.901
   92   HD11  ILE  11          1HD1      ILE  11  -3.068   3.454 -10.391
   93   HD12  ILE  11          2HD1      ILE  11  -4.327   2.221 -10.317
   94   HD13  ILE  11          3HD1      ILE  11  -4.068   3.128 -11.806
   95    H    VAL  12           H        VAL  12  -2.385   5.559  -7.385
   96    HA   VAL  12           HA       VAL  12  -3.367   6.690  -5.055
   97    HB   VAL  12           HB       VAL  12  -0.488   6.178  -5.812
   98   HG11  VAL  12          1HG1      VAL  12  -0.070   6.154  -3.378
   99   HG12  VAL  12          2HG1      VAL  12  -0.570   7.740  -3.969
  100   HG13  VAL  12          3HG1      VAL  12  -1.721   6.713  -3.112
  101   HG21  VAL  12          1HG2      VAL  12  -2.066   4.464  -3.959
  102   HG22  VAL  12          2HG2      VAL  12  -2.343   4.311  -5.694
  103   HG23  VAL  12          3HG2      VAL  12  -0.732   4.037  -5.031
  104    H    LYS  13           H        LYS  13  -1.511   8.147  -7.630
  105    HA   LYS  13           HA       LYS  13  -0.855  10.530  -6.173
  106    HB2  LYS  13          2HB       LYS  13   0.532  10.872  -7.890
  107    HB3  LYS  13          3HB       LYS  13  -0.035   9.355  -8.574
  108    HG2  LYS  13          2HG       LYS  13  -1.776  10.556  -9.798
  109    HG3  LYS  13          3HG       LYS  13  -1.202  12.078  -9.114
  110    HD2  LYS  13          2HD       LYS  13   0.925  10.534 -10.362
  111    HD3  LYS  13          3HD       LYS  13  -0.372  10.940 -11.489
  112    HE2  LYS  13          2HE       LYS  13  -0.136  13.269 -11.035
  113    HE3  LYS  13          3HE       LYS  13   0.954  12.956  -9.686
  114    HZ1  LYS  13          1HZ       LYS  13   2.295  13.616 -11.481
  115    HZ2  LYS  13          2HZ       LYS  13   1.493  12.607 -12.576
  116    HZ3  LYS  13          3HZ       LYS  13   2.486  11.937 -11.381
  117    H    LYS  14           H        LYS  14  -3.418   9.508  -8.335
  118    HA   LYS  14           HA       LYS  14  -4.538  12.135  -8.638
  119    HB2  LYS  14          2HB       LYS  14  -5.644   9.393  -9.261
  120    HB3  LYS  14          3HB       LYS  14  -6.459  10.900  -9.659
  121    HG2  LYS  14          2HG       LYS  14  -3.809   9.946 -10.720
  122    HG3  LYS  14          3HG       LYS  14  -5.332  10.065 -11.606
  123    HD2  LYS  14          2HD       LYS  14  -5.310  12.512 -11.229
  124    HD3  LYS  14          3HD       LYS  14  -3.732  12.350 -10.453
  125    HE2  LYS  14          2HE       LYS  14  -2.694  11.704 -12.455
  126    HE3  LYS  14          3HE       LYS  14  -4.232  11.345 -13.237
  127    HZ1  LYS  14          1HZ       LYS  14  -4.725  13.628 -13.425
  128    HZ2  LYS  14          2HZ       LYS  14  -3.122  13.464 -13.938
  129    HZ3  LYS  14          3HZ       LYS  14  -3.458  14.080 -12.398
  130    H    LEU  15           H        LEU  15  -5.449   9.214  -6.823
  131    HA   LEU  15           HA       LEU  15  -7.753  10.203  -5.615
  132    HB2  LEU  15          2HB       LEU  15  -5.767   8.096  -4.902
  133    HB3  LEU  15          3HB       LEU  15  -6.995   8.551  -3.722
  134    HG   LEU  15           HG       LEU  15  -7.453   6.525  -5.215
  135   HD11  LEU  15          1HD1      LEU  15  -9.751   6.882  -5.084
  136   HD12  LEU  15          2HD1      LEU  15  -9.595   8.617  -5.357
  137   HD13  LEU  15          3HD1      LEU  15  -9.094   7.918  -3.817
  138   HD21  LEU  15          1HD2      LEU  15  -8.054   8.720  -7.194
  139   HD22  LEU  15          2HD2      LEU  15  -8.410   7.005  -7.398
  140   HD23  LEU  15          3HD2      LEU  15  -6.735   7.556  -7.320
  141    H    THR  16           H        THR  16  -4.384  10.680  -4.813
  142    HA   THR  16           HA       THR  16  -4.857  11.810  -2.228
  143    HB   THR  16           HB       THR  16  -2.424  11.998  -4.015
  144    HG1  THR  16           HG1      THR  16  -1.746  10.213  -2.980
  145   HG21  THR  16          1HG2      THR  16  -1.750  13.578  -2.578
  146   HG22  THR  16          2HG2      THR  16  -1.609  12.280  -1.392
  147   HG23  THR  16          3HG2      THR  16  -3.080  13.249  -1.468
  148    H    GLN  17           H        GLN  17  -4.714  13.035  -5.486
  149    HA   GLN  17           HA       GLN  17  -4.220  15.729  -5.040
  150    HB2  GLN  17          2HB       GLN  17  -4.632  14.332  -7.246
  151    HB3  GLN  17          3HB       GLN  17  -6.270  14.944  -7.064
  152    HG2  GLN  17          2HG       GLN  17  -5.702  17.016  -7.683
  153    HG3  GLN  17          3HG       GLN  17  -4.185  16.977  -6.786
  154   HE21  GLN  17          1HE2      GLN  17  -5.446  14.958  -9.411
  155   HE22  GLN  17          2HE2      GLN  17  -4.129  15.239 -10.493
  156    H    TYR  18           H        TYR  18  -7.043  13.848  -4.353
  157    HA   TYR  18           HA       TYR  18  -8.662  16.236  -3.883
  158    HB2  TYR  18          2HB       TYR  18  -9.386  13.302  -3.739
  159    HB3  TYR  18          3HB       TYR  18 -10.511  14.635  -3.504
  160    HD1  TYR  18           HD1      TYR  18  -8.186  13.157  -6.008
  161    HD2  TYR  18           HD2      TYR  18 -11.628  15.566  -5.332
  162    HE1  TYR  18           HE1      TYR  18  -8.616  13.212  -8.429
  163    HE2  TYR  18           HE2      TYR  18 -12.067  15.627  -7.751
  164    HH   TYR  18           HH       TYR  18 -11.039  13.639  -9.858
  165    H    GLU  19           H        GLU  19  -6.939  13.738  -2.188
  166    HA   GLU  19           HA       GLU  19  -8.173  14.153   0.353
  167    HB2  GLU  19          2HB       GLU  19  -5.517  12.889  -0.349
  168    HB3  GLU  19          3HB       GLU  19  -6.286  12.816   1.230
  169    HG2  GLU  19          2HG       GLU  19  -7.612  11.781  -1.254
  170    HG3  GLU  19          3HG       GLU  19  -6.540  10.792  -0.264
  171    H    ILE  20           H        ILE  20  -5.316  15.421  -1.266
  172    HA   ILE  20           HA       ILE  20  -4.035  16.668   0.846
  173    HB   ILE  20           HB       ILE  20  -4.292  17.703  -1.981
  174   HG12  ILE  20          2HG1      ILE  20  -1.835  16.334  -1.069
  175   HG13  ILE  20          3HG1      ILE  20  -3.255  15.307  -1.239
  176   HG21  ILE  20          1HG2      ILE  20  -3.019  18.794   0.342
  177   HG22  ILE  20          2HG2      ILE  20  -1.804  18.373  -0.864
  178   HG23  ILE  20          3HG2      ILE  20  -3.127  19.460  -1.287
  179   HD11  ILE  20          1HD1      ILE  20  -1.534  16.426  -3.261
  180   HD12  ILE  20          2HD1      ILE  20  -2.743  15.148  -3.386
  181   HD13  ILE  20          3HD1      ILE  20  -3.224  16.836  -3.551
  182    H    ALA  21           H        ALA  21  -6.903  17.643  -0.907
  183    HA   ALA  21           HA       ALA  21  -7.108  20.313  -0.254
  184    HB1  ALA  21          1HB       ALA  21  -9.692  19.146   0.019
  185    HB2  ALA  21          2HB       ALA  21  -9.028  20.063  -1.334
  186    HB3  ALA  21          3HB       ALA  21  -8.826  18.312  -1.272
  187    H    TRP  22           H        TRP  22  -8.093  17.509   1.687
  188    HA   TRP  22           HA       TRP  22  -9.306  18.796   3.805
  189    HB2  TRP  22          2HB       TRP  22  -9.301  16.373   3.604
  190    HB3  TRP  22          3HB       TRP  22  -7.559  16.327   3.860
  191    HD1  TRP  22           HD1      TRP  22  -6.679  16.817   6.372
  192    HE1  TRP  22           HE1      TRP  22  -7.848  16.556   8.650
  193    HE3  TRP  22           HE3      TRP  22 -11.527  16.563   4.771
  194    HZ2  TRP  22           HZ2      TRP  22 -10.477  16.279   9.637
  195    HZ3  TRP  22           HZ3      TRP  22 -13.310  16.299   6.446
  196    HH2  TRP  22           HH2      TRP  22 -12.794  16.160   8.829
  197    H    PHE  23           H        PHE  23  -5.855  18.155   3.308
  198    HA   PHE  23           HA       PHE  23  -5.079  19.379   5.782
  199    HB2  PHE  23          2HB       PHE  23  -3.570  17.749   5.050
  200    HB3  PHE  23          3HB       PHE  23  -3.599  18.331   3.389
  201    HD1  PHE  23           HD1      PHE  23  -2.053  19.930   2.633
  202    HD2  PHE  23           HD2      PHE  23  -2.378  19.091   6.793
  203    HE1  PHE  23           HE1      PHE  23  -0.007  21.231   3.051
  204    HE2  PHE  23           HE2      PHE  23  -0.333  20.391   7.218
  205    HZ   PHE  23           HZ       PHE  23   0.855  21.464   5.347
  206    H    LYS  24           H        LYS  24  -5.515  20.427   2.491
  207    HA   LYS  24           HA       LYS  24  -4.017  22.800   2.555
  208    HB2  LYS  24          2HB       LYS  24  -4.887  21.830   0.480
  209    HB3  LYS  24          3HB       LYS  24  -6.532  22.172   0.998
  210    HG2  LYS  24          2HG       LYS  24  -6.205  23.966  -0.344
  211    HG3  LYS  24          3HG       LYS  24  -5.567  24.636   1.160
  212    HD2  LYS  24          2HD       LYS  24  -3.297  23.770   0.392
  213    HD3  LYS  24          3HD       LYS  24  -4.047  23.529  -1.187
  214    HE2  LYS  24          2HE       LYS  24  -4.082  26.160   0.275
  215    HE3  LYS  24          3HE       LYS  24  -2.821  25.711  -0.871
  216    HZ1  LYS  24          1HZ       LYS  24  -4.224  26.750  -2.285
  217    HZ2  LYS  24          2HZ       LYS  24  -5.602  26.432  -1.358
  218    HZ3  LYS  24          3HZ       LYS  24  -4.951  25.223  -2.346
  219    H    ASN  25           H        ASN  25  -7.170  22.005   3.807
  220    HA   ASN  25           HA       ASN  25  -7.962  24.737   4.237
  221    HB2  ASN  25          2HB       ASN  25  -9.108  22.088   5.118
  222    HB3  ASN  25          3HB       ASN  25  -9.802  23.630   5.611
  223   HD21  ASN  25          1HD2      ASN  25  -9.735  21.240   3.258
  224   HD22  ASN  25          2HD2      ASN  25 -10.643  22.058   2.037
  225    H    LYS  26           H        LYS  26  -5.877  22.610   5.790
  226    HA   LYS  26           HA       LYS  26  -6.288  23.754   8.444
  227    HB2  LYS  26          2HB       LYS  26  -4.185  21.742   7.660
  228    HB3  LYS  26          3HB       LYS  26  -4.831  22.067   9.263
  229    HG2  LYS  26          2HG       LYS  26  -6.411  20.880   6.992
  230    HG3  LYS  26          3HG       LYS  26  -5.641  19.952   8.281
  231    HD2  LYS  26          2HD       LYS  26  -7.025  21.016   9.941
  232    HD3  LYS  26          3HD       LYS  26  -7.710  22.101   8.729
  233    HE2  LYS  26          2HE       LYS  26  -8.230  19.672   7.628
  234    HE3  LYS  26          3HE       LYS  26  -8.353  19.302   9.347
  235    HZ1  LYS  26          1HZ       LYS  26 -10.124  20.709   9.617
  236    HZ2  LYS  26          2HZ       LYS  26 -10.416  20.147   8.049
  237    HZ3  LYS  26          3HZ       LYS  26  -9.726  21.673   8.285
  238    H    HIS  27           H        HIS  27  -4.060  23.862   5.758
  239    HA   HIS  27           HA       HIS  27  -2.669  26.085   7.060
  240    HB2  HIS  27          2HB       HIS  27  -1.224  23.823   5.664
  241    HB3  HIS  27          3HB       HIS  27  -0.482  25.241   6.400
  242    HD1  HIS  27           HD1      HIS  27  -2.298  22.069   7.332
  243    HD2  HIS  27           HD2      HIS  27  -0.007  25.048   9.103
  244    HE1  HIS  27           HE1      HIS  27  -1.824  21.256   9.664
  245    H    GLY  28           H        GLY  28  -3.074  24.208   4.068
  246    HA2  GLY  28          2HA       GLY  28  -3.824  25.196   2.035
  247    HA3  GLY  28          3HA       GLY  28  -3.215  26.745   2.597
  248    H    TYR  29           H        TYR  29  -1.302  23.847   2.864
  249    HA   TYR  29           HA       TYR  29   0.365  24.772   0.618
  250    HB2  TYR  29          2HB       TYR  29   1.191  23.915   3.380
  251    HB3  TYR  29          3HB       TYR  29   2.307  23.810   2.023
  252    HD1  TYR  29           HD1      TYR  29   0.037  26.260   3.696
  253    HD2  TYR  29           HD2      TYR  29   3.655  25.630   1.548
  254    HE1  TYR  29           HE1      TYR  29   0.626  28.628   4.006
  255    HE2  TYR  29           HE2      TYR  29   4.255  27.996   1.852
  256    HH   TYR  29           HH       TYR  29   3.107  30.144   2.282
  257    H    TYR  30           H        TYR  30   2.187  22.820   0.436
  258    HA   TYR  30           HA       TYR  30   0.835  20.240   0.455
  259    HB2  TYR  30          2HB       TYR  30   2.119  21.104  -2.113
  260    HB3  TYR  30          3HB       TYR  30   0.926  19.840  -1.838
  261    HD1  TYR  30           HD1      TYR  30   1.409  23.495  -2.085
  262    HD2  TYR  30           HD2      TYR  30  -1.404  20.306  -1.939
  263    HE1  TYR  30           HE1      TYR  30  -0.379  25.050  -2.745
  264    HE2  TYR  30           HE2      TYR  30  -3.199  21.852  -2.599
  265    HH   TYR  30           HH       TYR  30  -2.739  24.726  -3.973
  266    HA   PRO  31           HA       PRO  31   5.529  19.627  -0.516
  267    HB2  PRO  31          2HB       PRO  31   7.059  21.860  -0.723
  268    HB3  PRO  31          3HB       PRO  31   6.234  21.129  -2.105
  269    HG2  PRO  31          2HG       PRO  31   5.417  23.477  -0.437
  270    HG3  PRO  31          3HG       PRO  31   5.352  23.279  -2.198
  271    HD2  PRO  31          2HD       PRO  31   3.174  22.979  -0.618
  272    HD3  PRO  31          3HD       PRO  31   3.402  22.054  -2.115
  273    H    TRP  32           H        TRP  32   7.756  20.584   0.628
  274    HA   TRP  32           HA       TRP  32   7.129  20.429   3.442
  275    HB2  TRP  32          2HB       TRP  32   9.388  19.956   3.787
  276    HB3  TRP  32          3HB       TRP  32   9.091  19.285   2.186
  277    HD1  TRP  32           HD1      TRP  32  11.126  21.907   3.988
  278    HE1  TRP  32           HE1      TRP  32  12.737  23.028   2.324
  279    HE3  TRP  32           HE3      TRP  32   9.266  19.978  -0.366
  280    HZ2  TRP  32           HZ2      TRP  32  13.163  23.088  -0.466
  281    HZ3  TRP  32           HZ3      TRP  32  10.332  20.618  -2.489
  282    HH2  TRP  32           HH2      TRP  32  12.239  22.141  -2.536
  283    H    GLU  33           H        GLU  33   7.024  22.915   1.394
  284    HA   GLU  33           HA       GLU  33   8.457  24.873   2.984
  285    HB2  GLU  33          2HB       GLU  33   6.611  25.419   0.663
  286    HB3  GLU  33          3HB       GLU  33   7.886  26.453   1.293
  287    HG2  GLU  33          2HG       GLU  33   9.577  24.957   0.487
  288    HG3  GLU  33          3HG       GLU  33   8.360  23.778   0.001
  289    H    ILE  34           H        ILE  34   6.605  23.670   4.562
  290    HA   ILE  34           HA       ILE  34   4.262  25.416   4.651
  291    HB   ILE  34           HB       ILE  34   4.924  22.999   6.337
  292   HG12  ILE  34          2HG1      ILE  34   2.716  23.046   4.334
  293   HG13  ILE  34          3HG1      ILE  34   4.363  22.875   3.737
  294   HG21  ILE  34          1HG2      ILE  34   2.640  23.109   7.110
  295   HG22  ILE  34          2HG2      ILE  34   3.448  24.641   7.441
  296   HG23  ILE  34          3HG2      ILE  34   2.328  24.510   6.085
  297   HD11  ILE  34          1HD1      ILE  34   3.262  21.098   5.883
  298   HD12  ILE  34          2HD1      ILE  34   3.052  20.750   4.167
  299   HD13  ILE  34          3HD1      ILE  34   4.672  20.845   4.856
  300    HA   PRO  35           HA       PRO  35   6.111  27.981   7.744
  301    HB2  PRO  35          2HB       PRO  35   3.849  29.257   8.536
  302    HB3  PRO  35          3HB       PRO  35   4.672  29.617   7.014
  303    HG2  PRO  35          2HG       PRO  35   2.266  27.905   7.507
  304    HG3  PRO  35          3HG       PRO  35   2.555  29.083   6.213
  305    HD2  PRO  35          2HD       PRO  35   2.834  26.415   5.844
  306    HD3  PRO  35          3HD       PRO  35   3.829  27.607   4.983
  307    H    ARG  36           H        ARG  36   5.159  28.771  10.072
  308    HA   ARG  36           HA       ARG  36   4.551  26.278  11.521
  309    HB2  ARG  36          2HB       ARG  36   5.651  27.482  13.480
  310    HB3  ARG  36          3HB       ARG  36   6.711  26.955  12.180
  311    HG2  ARG  36          2HG       ARG  36   5.633  29.707  12.015
  312    HG3  ARG  36          3HG       ARG  36   6.852  29.379  13.248
  313    HD2  ARG  36          2HD       ARG  36   8.498  29.143  11.734
  314    HD3  ARG  36          3HD       ARG  36   7.463  28.276  10.600
  315    HE   ARG  36           HE       ARG  36   6.787  31.035  10.727
  316   HH11  ARG  36          1HH1      ARG  36   9.102  28.796   9.405
  317   HH12  ARG  36          2HH1      ARG  36   9.501  29.804   8.054
  318   HH21  ARG  36          1HH2      ARG  36   7.303  32.371   8.951
  319   HH22  ARG  36          2HH2      ARG  36   8.477  31.838   7.797
  320    H    CYS  37           H        CYS  37   3.303  26.506  13.507
  321    HA   CYS  37           HA       CYS  37   1.286  28.627  13.242
  322    HB2  CYS  37          2HB       CYS  37   0.366  26.391  13.065
  323    HB3  CYS  37          3HB       CYS  37   1.140  25.915  14.571
  324    HG   CYS  37           HG       CYS  37  -0.413  27.939  16.002
  Start of MODEL    8
    1    H    MET   1           H        MET   1   7.833  -0.256   0.296
    2    HA   MET   1           HA       MET   1   5.029  -0.168  -0.212
    3    HB2  MET   1          2HB       MET   1   6.731   1.676   1.474
    4    HB3  MET   1          3HB       MET   1   4.977   1.561   1.525
    5    HG2  MET   1          2HG       MET   1   6.831  -0.718   2.167
    6    HG3  MET   1          3HG       MET   1   6.153   0.379   3.368
    7    HE1  MET   1          1HE       MET   1   3.043   0.052   3.978
    8    HE2  MET   1          2HE       MET   1   3.532  -1.513   4.627
    9    HE3  MET   1          3HE       MET   1   4.652  -0.151   4.672
   10    H    LYS   2           H        LYS   2   3.861   1.201  -1.424
   11    HA   LYS   2           HA       LYS   2   3.354   2.785  -2.976
   12    HB2  LYS   2          2HB       LYS   2   5.542   4.367  -1.613
   13    HB3  LYS   2          3HB       LYS   2   4.271   5.020  -2.639
   14    HG2  LYS   2          2HG       LYS   2   2.630   4.690  -1.038
   15    HG3  LYS   2          3HG       LYS   2   3.583   3.487  -0.166
   16    HD2  LYS   2          2HD       LYS   2   4.972   6.010  -0.266
   17    HD3  LYS   2          3HD       LYS   2   3.353   6.216   0.408
   18    HE2  LYS   2          2HE       LYS   2   5.172   4.020   1.342
   19    HE3  LYS   2          3HE       LYS   2   5.279   5.647   2.012
   20    HZ1  LYS   2          1HZ       LYS   2   2.597   4.618   1.925
   21    HZ2  LYS   2          2HZ       LYS   2   3.432   5.349   3.201
   22    HZ3  LYS   2          3HZ       LYS   2   3.629   3.696   2.898
   23    H    PHE   3           H        PHE   3   4.392   1.145  -4.449
   24    HA   PHE   3           HA       PHE   3   6.994   1.414  -5.431
   25    HB2  PHE   3          2HB       PHE   3   4.462   0.250  -6.531
   26    HB3  PHE   3          3HB       PHE   3   5.875   0.388  -7.573
   27    HD1  PHE   3           HD1      PHE   3   7.010  -1.581  -7.802
   28    HD2  PHE   3           HD2      PHE   3   5.277  -0.638  -4.031
   29    HE1  PHE   3           HE1      PHE   3   7.902  -3.677  -6.872
   30    HE2  PHE   3           HE2      PHE   3   6.166  -2.732  -3.094
   31    HZ   PHE   3           HZ       PHE   3   7.482  -4.254  -4.515
   32    H    LYS   4           H        LYS   4   7.517   2.068  -7.732
   33    HA   LYS   4           HA       LYS   4   6.218   4.645  -8.327
   34    HB2  LYS   4          2HB       LYS   4   9.058   3.872  -9.001
   35    HB3  LYS   4          3HB       LYS   4   8.326   5.465  -9.138
   36    HG2  LYS   4          2HG       LYS   4   9.322   5.837  -7.171
   37    HG3  LYS   4          3HG       LYS   4   7.946   4.953  -6.506
   38    HD2  LYS   4          2HD       LYS   4   9.210   2.905  -6.481
   39    HD3  LYS   4          3HD       LYS   4  10.556   3.677  -7.321
   40    HE2  LYS   4          2HE       LYS   4  10.915   5.150  -5.413
   41    HE3  LYS   4          3HE       LYS   4   9.542   4.425  -4.579
   42    HZ1  LYS   4          1HZ       LYS   4  11.071   3.083  -3.696
   43    HZ2  LYS   4          2HZ       LYS   4  12.238   3.456  -4.862
   44    HZ3  LYS   4          3HZ       LYS   4  11.064   2.282  -5.186
   45    H    PHE   5           H        PHE   5   7.314   1.598  -9.582
   46    HA   PHE   5           HA       PHE   5   6.788   2.370 -12.337
   47    HB2  PHE   5          2HB       PHE   5   7.698  -0.250 -11.129
   48    HB3  PHE   5          3HB       PHE   5   7.495   0.036 -12.855
   49    HD1  PHE   5           HD1      PHE   5   9.690   0.291 -10.055
   50    HD2  PHE   5           HD2      PHE   5   8.897   1.862 -13.931
   51    HE1  PHE   5           HE1      PHE   5  11.995   1.144 -10.178
   52    HE2  PHE   5           HE2      PHE   5  11.200   2.717 -14.060
   53    HZ   PHE   5           HZ       PHE   5  12.753   2.358 -12.182
   54    H    ASN   6           H        ASN   6   5.354   0.478  -9.762
   55    HA   ASN   6           HA       ASN   6   3.485  -1.017 -11.134
   56    HB2  ASN   6          2HB       ASN   6   3.735   0.054  -8.403
   57    HB3  ASN   6          3HB       ASN   6   2.082  -0.292  -8.902
   58   HD21  ASN   6          1HD2      ASN   6   5.280  -1.799  -9.248
   59   HD22  ASN   6          2HD2      ASN   6   4.765  -3.386  -8.801
   60    HA   PRO   7           HA       PRO   7   0.477   1.687 -12.834
   61    HB2  PRO   7          2HB       PRO   7  -1.845   0.370 -12.337
   62    HB3  PRO   7          3HB       PRO   7  -0.667  -0.178 -13.536
   63    HG2  PRO   7          2HG       PRO   7  -1.098  -1.130 -10.731
   64    HG3  PRO   7          3HG       PRO   7  -0.800  -2.077 -12.200
   65    HD2  PRO   7          2HD       PRO   7   1.145  -1.539 -10.395
   66    HD3  PRO   7          3HD       PRO   7   1.473  -1.702 -12.132
   67    H    THR   8           H        THR   8  -0.127   0.613  -9.527
   68    HA   THR   8           HA       THR   8  -2.155   2.405  -8.838
   69    HB   THR   8           HB       THR   8  -1.296   0.440  -7.465
   70    HG1  THR   8           HG1      THR   8  -1.982   1.452  -5.558
   71   HG21  THR   8          1HG2      THR   8   1.083   1.141  -7.479
   72   HG22  THR   8          2HG2      THR   8   0.455   0.876  -5.852
   73   HG23  THR   8          3HG2      THR   8   0.653   2.518  -6.464
   74    H    GLY   9           H        GLY   9   1.172   2.959  -9.453
   75    HA2  GLY   9          2HA       GLY   9   1.810   5.115  -7.850
   76    HA3  GLY   9          3HA       GLY   9   2.400   4.900  -9.491
   77    H    THR  10           H        THR  10  -0.034   5.124 -10.873
   78    HA   THR  10           HA       THR  10  -0.290   7.977 -10.937
   79    HB   THR  10           HB       THR  10  -1.893   5.895 -12.435
   80    HG1  THR  10           HG1      THR  10   0.036   5.625 -13.315
   81   HG21  THR  10          1HG2      THR  10  -3.002   7.566 -13.415
   82   HG22  THR  10          2HG2      THR  10  -1.508   8.444 -13.746
   83   HG23  THR  10          3HG2      THR  10  -2.321   8.640 -12.193
   84    H    ILE  11           H        ILE  11  -2.547   5.312 -10.228
   85    HA   ILE  11           HA       ILE  11  -4.792   6.820  -9.622
   86    HB   ILE  11           HB       ILE  11  -3.921   4.218  -8.359
   87   HG12  ILE  11          2HG1      ILE  11  -5.970   3.695 -10.127
   88   HG13  ILE  11          3HG1      ILE  11  -5.054   4.945 -10.962
   89   HG21  ILE  11          1HG2      ILE  11  -6.304   3.909  -7.838
   90   HG22  ILE  11          2HG2      ILE  11  -5.616   5.304  -7.008
   91   HG23  ILE  11          3HG2      ILE  11  -6.632   5.538  -8.430
   92   HD11  ILE  11          1HD1      ILE  11  -4.014   3.070 -11.730
   93   HD12  ILE  11          2HD1      ILE  11  -3.018   3.423 -10.317
   94   HD13  ILE  11          3HD1      ILE  11  -4.265   2.179 -10.228
   95    H    VAL  12           H        VAL  12  -2.361   5.565  -7.331
   96    HA   VAL  12           HA       VAL  12  -3.358   6.711  -5.015
   97    HB   VAL  12           HB       VAL  12  -0.473   6.217  -5.760
   98   HG11  VAL  12          1HG1      VAL  12  -0.060   6.222  -3.325
   99   HG12  VAL  12          2HG1      VAL  12  -0.574   7.797  -3.933
  100   HG13  VAL  12          3HG1      VAL  12  -1.717   6.768  -3.069
  101   HG21  VAL  12          1HG2      VAL  12  -0.732   4.072  -5.102
  102   HG22  VAL  12          2HG2      VAL  12  -1.900   4.483  -3.847
  103   HG23  VAL  12          3HG2      VAL  12  -2.416   4.370  -5.529
  104    H    LYS  13           H        LYS  13  -1.510   8.158  -7.601
  105    HA   LYS  13           HA       LYS  13  -0.879  10.562  -6.167
  106    HB2  LYS  13          2HB       LYS  13   0.509  10.899  -7.884
  107    HB3  LYS  13          3HB       LYS  13  -0.042   9.369  -8.554
  108    HG2  LYS  13          2HG       LYS  13  -1.791  10.542  -9.794
  109    HG3  LYS  13          3HG       LYS  13  -1.233  12.077  -9.124
  110    HD2  LYS  13          2HD       LYS  13   0.830  10.431 -10.437
  111    HD3  LYS  13          3HD       LYS  13  -0.421  11.078 -11.501
  112    HE2  LYS  13          2HE       LYS  13   1.102  12.771  -9.533
  113    HE3  LYS  13          3HE       LYS  13   1.634  12.517 -11.194
  114    HZ1  LYS  13          1HZ       LYS  13  -0.225  13.623 -12.032
  115    HZ2  LYS  13          2HZ       LYS  13   0.254  14.573 -10.717
  116    HZ3  LYS  13          3HZ       LYS  13  -1.071  13.533 -10.570
  117    H    LYS  14           H        LYS  14  -3.427   9.494  -8.325
  118    HA   LYS  14           HA       LYS  14  -4.570  12.108  -8.658
  119    HB2  LYS  14          2HB       LYS  14  -5.650   9.349  -9.254
  120    HB3  LYS  14          3HB       LYS  14  -6.478  10.843  -9.670
  121    HG2  LYS  14          2HG       LYS  14  -3.817   9.904 -10.715
  122    HG3  LYS  14          3HG       LYS  14  -5.339   9.998 -11.605
  123    HD2  LYS  14          2HD       LYS  14  -5.341  12.450 -11.254
  124    HD3  LYS  14          3HD       LYS  14  -3.764  12.312 -10.473
  125    HE2  LYS  14          2HE       LYS  14  -2.885  11.303 -12.569
  126    HE3  LYS  14          3HE       LYS  14  -4.445  11.616 -13.328
  127    HZ1  LYS  14          1HZ       LYS  14  -2.288  13.349 -13.110
  128    HZ2  LYS  14          2HZ       LYS  14  -3.498  13.973 -12.108
  129    HZ3  LYS  14          3HZ       LYS  14  -3.821  13.684 -13.743
  130    H    LEU  15           H        LEU  15  -5.460   9.198  -6.814
  131    HA   LEU  15           HA       LEU  15  -7.775  10.179  -5.621
  132    HB2  LEU  15          2HB       LEU  15  -5.771   8.099  -4.880
  133    HB3  LEU  15          3HB       LEU  15  -7.005   8.555  -3.708
  134    HG   LEU  15           HG       LEU  15  -7.439   6.508  -5.180
  135   HD11  LEU  15          1HD1      LEU  15  -9.090   8.175  -3.885
  136   HD12  LEU  15          2HD1      LEU  15  -9.647   6.768  -4.790
  137   HD13  LEU  15          3HD1      LEU  15  -9.703   8.369  -5.527
  138   HD21  LEU  15          1HD2      LEU  15  -8.397   6.955  -7.369
  139   HD22  LEU  15          2HD2      LEU  15  -6.729   7.525  -7.296
  140   HD23  LEU  15          3HD2      LEU  15  -8.061   8.676  -7.183
  141    H    THR  16           H        THR  16  -4.413  10.696  -4.816
  142    HA   THR  16           HA       THR  16  -4.900  11.849  -2.245
  143    HB   THR  16           HB       THR  16  -2.470  12.049  -4.035
  144    HG1  THR  16           HG1      THR  16  -1.947  10.172  -3.206
  145   HG21  THR  16          1HG2      THR  16  -1.828  13.660  -2.615
  146   HG22  THR  16          2HG2      THR  16  -1.647  12.371  -1.425
  147   HG23  THR  16          3HG2      THR  16  -3.140  13.308  -1.491
  148    H    GLN  17           H        GLN  17  -4.773  13.044  -5.516
  149    HA   GLN  17           HA       GLN  17  -4.313  15.748  -5.096
  150    HB2  GLN  17          2HB       GLN  17  -4.675  14.352  -7.292
  151    HB3  GLN  17          3HB       GLN  17  -6.344  14.875  -7.112
  152    HG2  GLN  17          2HG       GLN  17  -5.887  16.911  -7.864
  153    HG3  GLN  17          3HG       GLN  17  -4.490  17.073  -6.801
  154   HE21  GLN  17          1HE2      GLN  17  -5.610  16.101  -9.940
  155   HE22  GLN  17          2HE2      GLN  17  -4.057  16.007 -10.691
  156    H    TYR  18           H        TYR  18  -7.112  13.838  -4.391
  157    HA   TYR  18           HA       TYR  18  -8.761  16.210  -3.944
  158    HB2  TYR  18          2HB       TYR  18  -9.447  13.268  -3.772
  159    HB3  TYR  18          3HB       TYR  18 -10.589  14.588  -3.547
  160    HD1  TYR  18           HD1      TYR  18  -8.246  13.123  -6.041
  161    HD2  TYR  18           HD2      TYR  18 -11.723  15.486  -5.381
  162    HE1  TYR  18           HE1      TYR  18  -8.679  13.151  -8.462
  163    HE2  TYR  18           HE2      TYR  18 -12.166  15.519  -7.800
  164    HH   TYR  18           HH       TYR  18 -11.558  13.973  -9.805
  165    H    GLU  19           H        GLU  19  -7.007  13.751  -2.224
  166    HA   GLU  19           HA       GLU  19  -8.246  14.176   0.313
  167    HB2  GLU  19          2HB       GLU  19  -5.575  12.937  -0.378
  168    HB3  GLU  19          3HB       GLU  19  -6.342  12.872   1.203
  169    HG2  GLU  19          2HG       GLU  19  -7.647  11.790  -1.273
  170    HG3  GLU  19          3HG       GLU  19  -6.576  10.827  -0.257
  171    H    ILE  20           H        ILE  20  -5.404  15.462  -1.319
  172    HA   ILE  20           HA       ILE  20  -4.139  16.746   0.780
  173    HB   ILE  20           HB       ILE  20  -4.406  17.748  -2.058
  174   HG12  ILE  20          2HG1      ILE  20  -1.934  16.418  -1.129
  175   HG13  ILE  20          3HG1      ILE  20  -3.341  15.373  -1.290
  176   HG21  ILE  20          1HG2      ILE  20  -3.267  19.527  -1.380
  177   HG22  ILE  20          2HG2      ILE  20  -3.147  18.878   0.254
  178   HG23  ILE  20          3HG2      ILE  20  -1.928  18.463  -0.950
  179   HD11  ILE  20          1HD1      ILE  20  -3.323  16.880  -3.618
  180   HD12  ILE  20          2HD1      ILE  20  -1.630  16.485  -3.321
  181   HD13  ILE  20          3HD1      ILE  20  -2.830  15.197  -3.435
  182    H    ALA  21           H        ALA  21  -7.017  17.668  -0.984
  183    HA   ALA  21           HA       ALA  21  -7.255  20.342  -0.359
  184    HB1  ALA  21          1HB       ALA  21  -9.277  18.174  -0.756
  185    HB2  ALA  21          2HB       ALA  21  -9.788  19.803  -0.313
  186    HB3  ALA  21          3HB       ALA  21  -8.879  19.538  -1.801
  187    H    TRP  22           H        TRP  22  -8.207  17.547   1.611
  188    HA   TRP  22           HA       TRP  22  -9.436  18.843   3.715
  189    HB2  TRP  22          2HB       TRP  22  -9.426  16.429   3.568
  190    HB3  TRP  22          3HB       TRP  22  -7.676  16.384   3.763
  191    HD1  TRP  22           HD1      TRP  22  -6.712  16.944   6.242
  192    HE1  TRP  22           HE1      TRP  22  -7.799  16.682   8.560
  193    HE3  TRP  22           HE3      TRP  22 -11.604  16.559   4.806
  194    HZ2  TRP  22           HZ2      TRP  22 -10.387  16.356   9.638
  195    HZ3  TRP  22           HZ3      TRP  22 -13.323  16.274   6.542
  196    HH2  TRP  22           HH2      TRP  22 -12.726  16.174   8.908
  197    H    PHE  23           H        PHE  23  -5.978  18.237   3.226
  198    HA   PHE  23           HA       PHE  23  -5.218  19.496   5.687
  199    HB2  PHE  23          2HB       PHE  23  -3.688  17.876   4.973
  200    HB3  PHE  23          3HB       PHE  23  -3.724  18.441   3.305
  201    HD1  PHE  23           HD1      PHE  23  -2.514  19.251   6.701
  202    HD2  PHE  23           HD2      PHE  23  -2.197  20.051   2.533
  203    HE1  PHE  23           HE1      PHE  23  -0.485  20.580   7.114
  204    HE2  PHE  23           HE2      PHE  23  -0.167  21.381   2.939
  205    HZ   PHE  23           HZ       PHE  23   0.692  21.646   5.232
  206    H    LYS  24           H        LYS  24  -5.664  20.504   2.385
  207    HA   LYS  24           HA       LYS  24  -4.194  22.895   2.425
  208    HB2  LYS  24          2HB       LYS  24  -5.052  21.893   0.359
  209    HB3  LYS  24          3HB       LYS  24  -6.701  22.221   0.873
  210    HG2  LYS  24          2HG       LYS  24  -6.395  24.004  -0.487
  211    HG3  LYS  24          3HG       LYS  24  -5.766  24.698   1.009
  212    HD2  LYS  24          2HD       LYS  24  -3.485  23.851   0.252
  213    HD3  LYS  24          3HD       LYS  24  -4.230  23.584  -1.325
  214    HE2  LYS  24          2HE       LYS  24  -4.298  26.230   0.110
  215    HE3  LYS  24          3HE       LYS  24  -3.031  25.784  -1.032
  216    HZ1  LYS  24          1HZ       LYS  24  -5.873  25.631  -1.806
  217    HZ2  LYS  24          2HZ       LYS  24  -4.509  25.779  -2.795
  218    HZ3  LYS  24          3HZ       LYS  24  -5.040  27.101  -1.883
  219    H    ASN  25           H        ASN  25  -7.338  22.076   3.684
  220    HA   ASN  25           HA       ASN  25  -8.163  24.803   4.085
  221    HB2  ASN  25          2HB       ASN  25  -9.286  22.187   5.106
  222    HB3  ASN  25          3HB       ASN  25 -10.032  23.758   5.383
  223   HD21  ASN  25          1HD2      ASN  25 -10.129  21.093   3.505
  224   HD22  ASN  25          2HD2      ASN  25 -10.860  21.754   2.085
  225    H    LYS  26           H        LYS  26  -6.054  22.717   5.661
  226    HA   LYS  26           HA       LYS  26  -6.480  23.884   8.302
  227    HB2  LYS  26          2HB       LYS  26  -4.353  21.889   7.540
  228    HB3  LYS  26          3HB       LYS  26  -5.003  22.223   9.140
  229    HG2  LYS  26          2HG       LYS  26  -6.569  20.994   6.881
  230    HG3  LYS  26          3HG       LYS  26  -5.788  20.088   8.179
  231    HD2  LYS  26          2HD       LYS  26  -7.194  21.105   9.827
  232    HD3  LYS  26          3HD       LYS  26  -7.853  22.236   8.642
  233    HE2  LYS  26          2HE       LYS  26  -8.605  20.095   7.390
  234    HE3  LYS  26          3HE       LYS  26  -8.356  19.299   8.943
  235    HZ1  LYS  26          1HZ       LYS  26  -9.802  21.399   9.692
  236    HZ2  LYS  26          2HZ       LYS  26 -10.481  19.912   9.259
  237    HZ3  LYS  26          3HZ       LYS  26 -10.419  21.173   8.133
  238    H    HIS  27           H        HIS  27  -4.252  23.990   5.617
  239    HA   HIS  27           HA       HIS  27  -2.887  26.242   6.895
  240    HB2  HIS  27          2HB       HIS  27  -1.416  23.983   5.524
  241    HB3  HIS  27          3HB       HIS  27  -0.690  25.417   6.244
  242    HD1  HIS  27           HD1      HIS  27  -2.469  22.234   7.209
  243    HD2  HIS  27           HD2      HIS  27  -0.214  25.259   8.950
  244    HE1  HIS  27           HE1      HIS  27  -1.987  21.451   9.550
  245    H    GLY  28           H        GLY  28  -3.269  24.330   3.923
  246    HA2  GLY  28          2HA       GLY  28  -4.030  25.287   1.879
  247    HA3  GLY  28          3HA       GLY  28  -3.439  26.849   2.426
  248    H    TYR  29           H        TYR  29  -1.492  23.977   2.723
  249    HA   TYR  29           HA       TYR  29   0.165  24.898   0.468
  250    HB2  TYR  29          2HB       TYR  29   1.000  24.080   3.240
  251    HB3  TYR  29          3HB       TYR  29   2.118  23.974   1.884
  252    HD1  TYR  29           HD1      TYR  29  -0.182  26.414   3.531
  253    HD2  TYR  29           HD2      TYR  29   3.444  25.805   1.391
  254    HE1  TYR  29           HE1      TYR  29   0.378  28.791   3.817
  255    HE2  TYR  29           HE2      TYR  29   4.016  28.180   1.672
  256    HH   TYR  29           HH       TYR  29   1.749  30.488   2.854
  257    H    TYR  30           H        TYR  30   2.010  22.966   0.308
  258    HA   TYR  30           HA       TYR  30   0.688  20.370   0.353
  259    HB2  TYR  30          2HB       TYR  30   1.964  21.223  -2.223
  260    HB3  TYR  30          3HB       TYR  30   0.785  19.948  -1.936
  261    HD1  TYR  30           HD1      TYR  30   1.226  23.606  -2.221
  262    HD2  TYR  30           HD2      TYR  30  -1.549  20.386  -2.042
  263    HE1  TYR  30           HE1      TYR  30  -0.580  25.133  -2.897
  264    HE2  TYR  30           HE2      TYR  30  -3.363  21.904  -2.719
  265    HH   TYR  30           HH       TYR  30  -3.718  23.989  -3.782
  266    HA   PRO  31           HA       PRO  31   5.391  19.803  -0.610
  267    HB2  PRO  31          2HB       PRO  31   6.893  22.052  -0.839
  268    HB3  PRO  31          3HB       PRO  31   6.079  21.297  -2.214
  269    HG2  PRO  31          2HG       PRO  31   5.232  23.652  -0.570
  270    HG3  PRO  31          3HG       PRO  31   5.171  23.435  -2.329
  271    HD2  PRO  31          2HD       PRO  31   2.996  23.126  -0.747
  272    HD3  PRO  31          3HD       PRO  31   3.236  22.188  -2.235
  273    H    TRP  32           H        TRP  32   7.605  20.798   0.525
  274    HA   TRP  32           HA       TRP  32   6.978  20.665   3.341
  275    HB2  TRP  32          2HB       TRP  32   9.243  20.223   3.692
  276    HB3  TRP  32          3HB       TRP  32   8.954  19.531   2.098
  277    HD1  TRP  32           HD1      TRP  32  10.958  22.196   3.873
  278    HE1  TRP  32           HE1      TRP  32  12.556  23.319   2.197
  279    HE3  TRP  32           HE3      TRP  32   9.122  20.199  -0.461
  280    HZ2  TRP  32           HZ2      TRP  32  12.982  23.354  -0.594
  281    HZ3  TRP  32           HZ3      TRP  32  10.181  20.829  -2.591
  282    HH2  TRP  32           HH2      TRP  32  12.071  22.374  -2.654
  283    H    GLU  33           H        GLU  33   6.845  23.128   1.267
  284    HA   GLU  33           HA       GLU  33   8.254  25.119   2.837
  285    HB2  GLU  33          2HB       GLU  33   6.402  25.620   0.511
  286    HB3  GLU  33          3HB       GLU  33   7.665  26.675   1.130
  287    HG2  GLU  33          2HG       GLU  33   9.374  25.191   0.341
  288    HG3  GLU  33          3HG       GLU  33   8.171  23.993  -0.134
  289    H    ILE  34           H        ILE  34   6.415  23.911   4.427
  290    HA   ILE  34           HA       ILE  34   4.051  25.630   4.497
  291    HB   ILE  34           HB       ILE  34   4.741  23.238   6.208
  292   HG12  ILE  34          2HG1      ILE  34   2.534  23.238   4.203
  293   HG13  ILE  34          3HG1      ILE  34   4.183  23.081   3.609
  294   HG21  ILE  34          1HG2      ILE  34   2.456  23.329   6.979
  295   HG22  ILE  34          2HG2      ILE  34   3.245  24.874   7.294
  296   HG23  ILE  34          3HG2      ILE  34   2.127  24.715   5.939
  297   HD11  ILE  34          1HD1      ILE  34   2.987  20.930   4.003
  298   HD12  ILE  34          2HD1      ILE  34   4.522  21.089   4.856
  299   HD13  ILE  34          3HD1      ILE  34   3.003  21.305   5.725
  300    HA   PRO  35           HA       PRO  35   5.868  28.249   7.564
  301    HB2  PRO  35          2HB       PRO  35   3.591  29.505   8.341
  302    HB3  PRO  35          3HB       PRO  35   4.410  29.860   6.816
  303    HG2  PRO  35          2HG       PRO  35   2.025  28.124   7.326
  304    HG3  PRO  35          3HG       PRO  35   2.300  29.292   6.020
  305    HD2  PRO  35          2HD       PRO  35   2.612  26.624   5.678
  306    HD3  PRO  35          3HD       PRO  35   3.592  27.819   4.805
  307    H    ARG  36           H        ARG  36   4.926  29.046   9.885
  308    HA   ARG  36           HA       ARG  36   3.686  26.899  11.370
  309    HB2  ARG  36          2HB       ARG  36   5.622  26.799  12.998
  310    HB3  ARG  36          3HB       ARG  36   5.892  26.032  11.439
  311    HG2  ARG  36          2HG       ARG  36   6.715  28.784  11.357
  312    HG3  ARG  36          3HG       ARG  36   7.492  27.938  12.697
  313    HD2  ARG  36          2HD       ARG  36   7.434  26.940   9.853
  314    HD3  ARG  36          3HD       ARG  36   8.768  27.850  10.561
  315    HE   ARG  36           HE       ARG  36   8.251  25.652  12.203
  316   HH11  ARG  36          1HH1      ARG  36   9.410  26.329   8.991
  317   HH12  ARG  36          2HH1      ARG  36  10.400  24.910   8.908
  318   HH21  ARG  36          1HH2      ARG  36   9.551  23.780  12.106
  319   HH22  ARG  36          2HH2      ARG  36  10.479  23.460  10.680
  320    H    CYS  37           H        CYS  37   3.657  27.498  13.789
  321    HA   CYS  37           HA       CYS  37   3.065  30.371  13.966
  322    HB2  CYS  37          2HB       CYS  37   1.899  27.937  15.233
  323    HB3  CYS  37          3HB       CYS  37   1.874  29.435  16.156
  324    HG   CYS  37           HG       CYS  37  -0.026  30.633  14.854
  Start of MODEL    9
    1    H    MET   1           H        MET   1   3.338   0.515   1.542
    2    HA   MET   1           HA       MET   1   4.033  -1.025  -0.725
    3    HB2  MET   1          2HB       MET   1   1.113  -0.587  -0.183
    4    HB3  MET   1          3HB       MET   1   1.706  -0.685  -1.835
    5    HG2  MET   1          2HG       MET   1   2.350  -2.904  -1.606
    6    HG3  MET   1          3HG       MET   1   2.355  -2.820   0.154
    7    HE1  MET   1          1HE       MET   1   0.026  -4.772   1.017
    8    HE2  MET   1          2HE       MET   1   0.893  -3.331   1.547
    9    HE3  MET   1          3HE       MET   1  -0.867  -3.309   1.432
   10    H    LYS   2           H        LYS   2   5.108   0.443  -1.853
   11    HA   LYS   2           HA       LYS   2   3.841   2.884  -2.696
   12    HB2  LYS   2          2HB       LYS   2   5.957   2.873  -0.600
   13    HB3  LYS   2          3HB       LYS   2   6.031   4.130  -1.827
   14    HG2  LYS   2          2HG       LYS   2   3.464   4.368  -1.171
   15    HG3  LYS   2          3HG       LYS   2   4.074   3.713   0.351
   16    HD2  LYS   2          2HD       LYS   2   5.638   5.507   0.576
   17    HD3  LYS   2          3HD       LYS   2   5.284   6.091  -1.052
   18    HE2  LYS   2          2HE       LYS   2   3.617   7.340  -0.282
   19    HE3  LYS   2          3HE       LYS   2   2.855   5.929   0.451
   20    HZ1  LYS   2          1HZ       LYS   2   5.133   6.973   1.896
   21    HZ2  LYS   2          2HZ       LYS   2   3.628   6.460   2.471
   22    HZ3  LYS   2          3HZ       LYS   2   3.803   8.016   1.830
   23    H    PHE   3           H        PHE   3   4.303   1.385  -4.573
   24    HA   PHE   3           HA       PHE   3   7.059   1.320  -5.467
   25    HB2  PHE   3          2HB       PHE   3   4.475   0.188  -6.475
   26    HB3  PHE   3          3HB       PHE   3   5.855   0.301  -7.563
   27    HD1  PHE   3           HD1      PHE   3   5.393  -0.683  -3.990
   28    HD2  PHE   3           HD2      PHE   3   6.917  -1.706  -7.830
   29    HE1  PHE   3           HE1      PHE   3   6.281  -2.787  -3.073
   30    HE2  PHE   3           HE2      PHE   3   7.807  -3.811  -6.919
   31    HZ   PHE   3           HZ       PHE   3   7.488  -4.355  -4.539
   32    H    LYS   4           H        LYS   4   7.552   2.001  -7.742
   33    HA   LYS   4           HA       LYS   4   6.224   4.566  -8.326
   34    HB2  LYS   4          2HB       LYS   4   9.055   3.830  -9.067
   35    HB3  LYS   4          3HB       LYS   4   8.307   5.420  -9.129
   36    HG2  LYS   4          2HG       LYS   4   9.320   5.751  -7.170
   37    HG3  LYS   4          3HG       LYS   4   8.010   4.777  -6.500
   38    HD2  LYS   4          2HD       LYS   4   9.812   3.655  -5.646
   39    HD3  LYS   4          3HD       LYS   4   9.611   2.788  -7.171
   40    HE2  LYS   4          2HE       LYS   4  11.613   3.446  -7.893
   41    HE3  LYS   4          3HE       LYS   4  11.265   5.131  -7.509
   42    HZ1  LYS   4          1HZ       LYS   4  12.113   4.900  -5.375
   43    HZ2  LYS   4          2HZ       LYS   4  13.196   4.003  -6.313
   44    HZ3  LYS   4          3HZ       LYS   4  12.015   3.211  -5.395
   45    H    PHE   5           H        PHE   5   7.334   1.528  -9.594
   46    HA   PHE   5           HA       PHE   5   6.780   2.291 -12.344
   47    HB2  PHE   5          2HB       PHE   5   7.615  -0.382 -11.198
   48    HB3  PHE   5          3HB       PHE   5   7.542   0.030 -12.908
   49    HD1  PHE   5           HD1      PHE   5   9.094   1.785 -13.802
   50    HD2  PHE   5           HD2      PHE   5   9.501   0.130  -9.901
   51    HE1  PHE   5           HE1      PHE   5  11.419   2.583 -13.710
   52    HE2  PHE   5           HE2      PHE   5  11.827   0.927  -9.803
   53    HZ   PHE   5           HZ       PHE   5  12.789   2.156 -11.708
   54    H    ASN   6           H        ASN   6   5.353   0.421  -9.752
   55    HA   ASN   6           HA       ASN   6   3.470  -1.074 -11.111
   56    HB2  ASN   6          2HB       ASN   6   3.743  -0.001  -8.383
   57    HB3  ASN   6          3HB       ASN   6   2.086  -0.345  -8.869
   58   HD21  ASN   6          1HD2      ASN   6   1.705  -2.121  -7.675
   59   HD22  ASN   6          2HD2      ASN   6   2.577  -3.605  -7.827
   60    HA   PRO   7           HA       PRO   7   0.459   1.642 -12.788
   61    HB2  PRO   7          2HB       PRO   7  -1.864   0.335 -12.272
   62    HB3  PRO   7          3HB       PRO   7  -0.698  -0.218 -13.480
   63    HG2  PRO   7          2HG       PRO   7  -1.111  -1.168 -10.671
   64    HG3  PRO   7          3HG       PRO   7  -0.828  -2.117 -12.143
   65    HD2  PRO   7          2HD       PRO   7   1.133  -1.586 -10.353
   66    HD3  PRO   7          3HD       PRO   7   1.447  -1.751 -12.093
   67    H    THR   8           H        THR   8  -0.123   0.572  -9.476
   68    HA   THR   8           HA       THR   8  -2.138   2.372  -8.772
   69    HB   THR   8           HB       THR   8  -1.276   0.404  -7.404
   70    HG1  THR   8           HG1      THR   8  -2.704   1.486  -6.238
   71   HG21  THR   8          1HG2      THR   8   1.106   1.096  -7.438
   72   HG22  THR   8          2HG2      THR   8   0.490   0.834  -5.806
   73   HG23  THR   8          3HG2      THR   8   0.690   2.474  -6.420
   74    H    GLY   9           H        GLY   9   1.185   2.913  -9.414
   75    HA2  GLY   9          2HA       GLY   9   1.845   5.067  -7.817
   76    HA3  GLY   9          3HA       GLY   9   2.421   4.850  -9.463
   77    H    THR  10           H        THR  10  -0.023   5.082 -10.825
   78    HA   THR  10           HA       THR  10  -0.270   7.935 -10.887
   79    HB   THR  10           HB       THR  10  -1.892   5.859 -12.372
   80    HG1  THR  10           HG1      THR  10   0.573   7.143 -12.915
   81   HG21  THR  10          1HG2      THR  10  -2.311   8.605 -12.127
   82   HG22  THR  10          2HG2      THR  10  -3.000   7.535 -13.348
   83   HG23  THR  10          3HG2      THR  10  -1.506   8.408 -13.683
   84    H    ILE  11           H        ILE  11  -2.531   5.279 -10.160
   85    HA   ILE  11           HA       ILE  11  -4.765   6.796  -9.536
   86    HB   ILE  11           HB       ILE  11  -3.894   4.191  -8.279
   87   HG12  ILE  11          2HG1      ILE  11  -5.959   3.675 -10.030
   88   HG13  ILE  11          3HG1      ILE  11  -5.045   4.921 -10.873
   89   HG21  ILE  11          1HG2      ILE  11  -6.273   3.891  -7.739
   90   HG22  ILE  11          2HG2      ILE  11  -5.574   5.283  -6.915
   91   HG23  ILE  11          3HG2      ILE  11  -6.600   5.520  -8.329
   92   HD11  ILE  11          1HD1      ILE  11  -4.016   3.043 -11.649
   93   HD12  ILE  11          2HD1      ILE  11  -3.009   3.392 -10.244
   94   HD13  ILE  11          3HD1      ILE  11  -4.260   2.153 -10.146
   95    H    VAL  12           H        VAL  12  -2.320   5.533  -7.264
   96    HA   VAL  12           HA       VAL  12  -3.295   6.683  -4.941
   97    HB   VAL  12           HB       VAL  12  -0.418   6.178  -5.709
   98   HG11  VAL  12          1HG1      VAL  12  -0.497   7.758  -3.882
   99   HG12  VAL  12          2HG1      VAL  12  -1.638   6.735  -3.007
  100   HG13  VAL  12          3HG1      VAL  12   0.016   6.183  -3.278
  101   HG21  VAL  12          1HG2      VAL  12  -0.648   4.044  -4.920
  102   HG22  VAL  12          2HG2      VAL  12  -1.961   4.471  -3.822
  103   HG23  VAL  12          3HG2      VAL  12  -2.274   4.306  -5.550
  104    H    LYS  13           H        LYS  13  -1.462   8.122  -7.542
  105    HA   LYS  13           HA       LYS  13  -0.810  10.524  -6.114
  106    HB2  LYS  13          2HB       LYS  13   0.565  10.856  -7.843
  107    HB3  LYS  13          3HB       LYS  13   0.002   9.328  -8.507
  108    HG2  LYS  13          2HG       LYS  13  -1.753  10.506  -9.733
  109    HG3  LYS  13          3HG       LYS  13  -1.183  12.039  -9.069
  110    HD2  LYS  13          2HD       LYS  13   0.643  10.221 -10.609
  111    HD3  LYS  13          3HD       LYS  13  -0.408  11.379 -11.428
  112    HE2  LYS  13          2HE       LYS  13   1.476  12.181  -9.225
  113    HE3  LYS  13          3HE       LYS  13   1.968  12.135 -10.918
  114    HZ1  LYS  13          1HZ       LYS  13  -0.315  13.547 -11.031
  115    HZ2  LYS  13          2HZ       LYS  13   1.229  14.230 -10.941
  116    HZ3  LYS  13          3HZ       LYS  13   0.304  14.045  -9.537
  117    H    LYS  14           H        LYS  14  -3.381   9.466  -8.250
  118    HA   LYS  14           HA       LYS  14  -4.516  12.084  -8.574
  119    HB2  LYS  14          2HB       LYS  14  -5.612   9.329  -9.162
  120    HB3  LYS  14          3HB       LYS  14  -6.437  10.827  -9.571
  121    HG2  LYS  14          2HG       LYS  14  -3.788   9.876 -10.637
  122    HG3  LYS  14          3HG       LYS  14  -5.316   9.978 -11.515
  123    HD2  LYS  14          2HD       LYS  14  -5.304  12.429 -11.164
  124    HD3  LYS  14          3HD       LYS  14  -3.722  12.283 -10.395
  125    HE2  LYS  14          2HE       LYS  14  -3.421  10.929 -12.786
  126    HE3  LYS  14          3HE       LYS  14  -4.435  12.307 -13.214
  127    HZ1  LYS  14          1HZ       LYS  14  -1.735  12.348 -12.985
  128    HZ2  LYS  14          2HZ       LYS  14  -2.233  13.006 -11.509
  129    HZ3  LYS  14          3HZ       LYS  14  -2.739  13.709 -12.962
  130    H    LEU  15           H        LEU  15  -5.401   9.177  -6.724
  131    HA   LEU  15           HA       LEU  15  -7.703  10.166  -5.512
  132    HB2  LEU  15          2HB       LEU  15  -5.703   8.076  -4.790
  133    HB3  LEU  15          3HB       LEU  15  -6.926   8.536  -3.607
  134    HG   LEU  15           HG       LEU  15  -7.383   6.493  -5.076
  135   HD11  LEU  15          1HD1      LEU  15  -9.018   7.972  -3.702
  136   HD12  LEU  15          2HD1      LEU  15  -9.658   6.812  -4.866
  137   HD13  LEU  15          3HD1      LEU  15  -9.565   8.522  -5.286
  138   HD21  LEU  15          1HD2      LEU  15  -8.353   6.946  -7.259
  139   HD22  LEU  15          2HD2      LEU  15  -6.680   7.503  -7.197
  140   HD23  LEU  15          3HD2      LEU  15  -8.003   8.665  -7.076
  141    H    THR  16           H        THR  16  -4.332  10.667  -4.734
  142    HA   THR  16           HA       THR  16  -4.797  11.821  -2.158
  143    HB   THR  16           HB       THR  16  -2.374  12.000  -3.961
  144    HG1  THR  16           HG1      THR  16  -1.588  10.394  -2.461
  145   HG21  THR  16          1HG2      THR  16  -1.659  13.573  -2.542
  146   HG22  THR  16          2HG2      THR  16  -1.583  12.308  -1.315
  147   HG23  THR  16          3HG2      THR  16  -3.025  13.313  -1.458
  148    H    GLN  17           H        GLN  17  -4.677  13.013  -5.430
  149    HA   GLN  17           HA       GLN  17  -4.193  15.713  -5.015
  150    HB2  GLN  17          2HB       GLN  17  -4.628  14.279  -7.202
  151    HB3  GLN  17          3HB       GLN  17  -6.256  14.919  -7.017
  152    HG2  GLN  17          2HG       GLN  17  -5.658  16.973  -7.667
  153    HG3  GLN  17          3HG       GLN  17  -4.137  16.922  -6.777
  154   HE21  GLN  17          1HE2      GLN  17  -5.703  15.534  -9.636
  155   HE22  GLN  17          2HE2      GLN  17  -4.286  15.531 -10.625
  156    H    TYR  18           H        TYR  18  -7.003  13.828  -4.290
  157    HA   TYR  18           HA       TYR  18  -8.630  16.213  -3.836
  158    HB2  TYR  18          2HB       TYR  18  -9.339  13.278  -3.656
  159    HB3  TYR  18          3HB       TYR  18 -10.469  14.609  -3.428
  160    HD1  TYR  18           HD1      TYR  18 -11.604  15.511  -5.259
  161    HD2  TYR  18           HD2      TYR  18  -8.153  13.115  -5.930
  162    HE1  TYR  18           HE1      TYR  18 -12.059  15.544  -7.676
  163    HE2  TYR  18           HE2      TYR  18  -8.598  13.142  -8.349
  164    HH   TYR  18           HH       TYR  18 -10.938  13.501  -9.784
  165    H    GLU  19           H        GLU  19  -6.885  13.742  -2.125
  166    HA   GLU  19           HA       GLU  19  -8.105  14.179   0.420
  167    HB2  GLU  19          2HB       GLU  19  -5.449  12.918  -0.287
  168    HB3  GLU  19          3HB       GLU  19  -6.205  12.861   1.299
  169    HG2  GLU  19          2HG       GLU  19  -7.536  11.786  -1.167
  170    HG3  GLU  19          3HG       GLU  19  -6.466  10.816  -0.157
  171    H    ILE  20           H        ILE  20  -5.265  15.442  -1.231
  172    HA   ILE  20           HA       ILE  20  -3.976  16.718   0.858
  173    HB   ILE  20           HB       ILE  20  -4.255  17.721  -1.977
  174   HG12  ILE  20          2HG1      ILE  20  -1.786  16.372  -1.067
  175   HG13  ILE  20          3HG1      ILE  20  -3.203  15.338  -1.217
  176   HG21  ILE  20          1HG2      ILE  20  -1.763  18.414  -0.885
  177   HG22  ILE  20          2HG2      ILE  20  -3.093  19.490  -1.312
  178   HG23  ILE  20          3HG2      ILE  20  -2.972  18.843   0.325
  179   HD11  ILE  20          1HD1      ILE  20  -3.223  16.808  -3.548
  180   HD12  ILE  20          2HD1      ILE  20  -1.513  16.480  -3.266
  181   HD13  ILE  20          3HD1      ILE  20  -2.663  15.147  -3.357
  182    H    ALA  21           H        ALA  21  -6.858  17.661  -0.887
  183    HA   ALA  21           HA       ALA  21  -7.072  20.337  -0.260
  184    HB1  ALA  21          1HB       ALA  21  -9.657  19.254   0.033
  185    HB2  ALA  21          2HB       ALA  21  -8.952  20.019  -1.392
  186    HB3  ALA  21          3HB       ALA  21  -8.823  18.274  -1.173
  187    H    TRP  22           H        TRP  22  -8.032  17.549   1.717
  188    HA   TRP  22           HA       TRP  22  -9.237  18.854   3.828
  189    HB2  TRP  22          2HB       TRP  22  -9.238  16.437   3.672
  190    HB3  TRP  22          3HB       TRP  22  -7.490  16.386   3.876
  191    HD1  TRP  22           HD1      TRP  22  -6.530  16.861   6.353
  192    HE1  TRP  22           HE1      TRP  22  -7.633  16.638   8.669
  193    HE3  TRP  22           HE3      TRP  22 -11.431  16.692   4.906
  194    HZ2  TRP  22           HZ2      TRP  22 -10.235  16.419   9.740
  195    HZ3  TRP  22           HZ3      TRP  22 -13.165  16.475   6.638
  196    HH2  TRP  22           HH2      TRP  22 -12.577  16.340   9.004
  197    H    PHE  23           H        PHE  23  -5.786  18.223   3.317
  198    HA   PHE  23           HA       PHE  23  -5.001  19.476   5.772
  199    HB2  PHE  23          2HB       PHE  23  -3.489  17.845   5.048
  200    HB3  PHE  23          3HB       PHE  23  -3.531  18.409   3.381
  201    HD1  PHE  23           HD1      PHE  23  -1.996  20.006   2.598
  202    HD2  PHE  23           HD2      PHE  23  -2.292  19.212   6.769
  203    HE1  PHE  23           HE1      PHE  23   0.047  21.320   2.990
  204    HE2  PHE  23           HE2      PHE  23  -0.251  20.525   7.168
  205    HZ   PHE  23           HZ       PHE  23   0.921  21.582   5.277
  206    H    LYS  24           H        LYS  24  -5.462  20.487   2.473
  207    HA   LYS  24           HA       LYS  24  -3.973  22.867   2.502
  208    HB2  LYS  24          2HB       LYS  24  -4.852  21.871   0.443
  209    HB3  LYS  24          3HB       LYS  24  -6.496  22.211   0.968
  210    HG2  LYS  24          2HG       LYS  24  -6.185  23.992  -0.395
  211    HG3  LYS  24          3HG       LYS  24  -5.541  24.681   1.097
  212    HD2  LYS  24          2HD       LYS  24  -3.272  23.818   0.325
  213    HD3  LYS  24          3HD       LYS  24  -4.029  23.556  -1.247
  214    HE2  LYS  24          2HE       LYS  24  -4.068  26.203   0.187
  215    HE3  LYS  24          3HE       LYS  24  -2.812  25.747  -0.963
  216    HZ1  LYS  24          1HZ       LYS  24  -5.498  25.370  -1.939
  217    HZ2  LYS  24          2HZ       LYS  24  -4.166  26.091  -2.689
  218    HZ3  LYS  24          3HZ       LYS  24  -5.113  26.984  -1.609
  219    H    ASN  25           H        ASN  25  -7.115  22.072   3.783
  220    HA   ASN  25           HA       ASN  25  -7.916  24.806   4.189
  221    HB2  ASN  25          2HB       ASN  25  -9.048  22.183   5.175
  222    HB3  ASN  25          3HB       ASN  25  -9.769  23.749   5.533
  223   HD21  ASN  25          1HD2      ASN  25 -10.049  21.169   3.613
  224   HD22  ASN  25          2HD2      ASN  25 -10.768  21.891   2.218
  225    H    LYS  26           H        LYS  26  -5.812  22.704   5.750
  226    HA   LYS  26           HA       LYS  26  -6.212  23.874   8.394
  227    HB2  LYS  26          2HB       LYS  26  -4.105  21.864   7.619
  228    HB3  LYS  26          3HB       LYS  26  -4.742  22.202   9.222
  229    HG2  LYS  26          2HG       LYS  26  -6.331  20.984   6.974
  230    HG3  LYS  26          3HG       LYS  26  -5.548  20.073   8.267
  231    HD2  LYS  26          2HD       LYS  26  -6.968  20.979   9.909
  232    HD3  LYS  26          3HD       LYS  26  -7.520  22.269   8.837
  233    HE2  LYS  26          2HE       LYS  26  -9.154  20.996   8.017
  234    HE3  LYS  26          3HE       LYS  26  -8.048  19.657   7.713
  235    HZ1  LYS  26          1HZ       LYS  26  -9.424  20.276  10.269
  236    HZ2  LYS  26          2HZ       LYS  26  -8.252  19.070  10.087
  237    HZ3  LYS  26          3HZ       LYS  26  -9.719  18.957   9.252
  238    H    HIS  27           H        HIS  27  -4.001  23.963   5.694
  239    HA   HIS  27           HA       HIS  27  -2.612  26.206   6.963
  240    HB2  HIS  27          2HB       HIS  27  -1.166  23.936   5.583
  241    HB3  HIS  27          3HB       HIS  27  -0.425  25.365   6.298
  242    HD1  HIS  27           HD1      HIS  27  -2.221  22.195   7.276
  243    HD2  HIS  27           HD2      HIS  27   0.067  25.204   9.001
  244    HE1  HIS  27           HE1      HIS  27  -1.729  21.409   9.614
  245    H    GLY  28           H        GLY  28  -3.027  24.295   3.994
  246    HA2  GLY  28          2HA       GLY  28  -3.794  25.258   1.955
  247    HA3  GLY  28          3HA       GLY  28  -3.188  26.816   2.497
  248    H    TYR  29           H        TYR  29  -1.261  23.929   2.783
  249    HA   TYR  29           HA       TYR  29   0.388  24.836   0.517
  250    HB2  TYR  29          2HB       TYR  29   1.235  24.012   3.283
  251    HB3  TYR  29          3HB       TYR  29   2.343  23.897   1.920
  252    HD1  TYR  29           HD1      TYR  29   0.072  26.356   3.579
  253    HD2  TYR  29           HD2      TYR  29   3.682  25.717   1.419
  254    HE1  TYR  29           HE1      TYR  29   0.653  28.729   3.860
  255    HE2  TYR  29           HE2      TYR  29   4.273  28.088   1.695
  256    HH   TYR  29           HH       TYR  29   2.591  30.166   3.835
  257    H    TYR  30           H        TYR  30   2.217  22.890   0.344
  258    HA   TYR  30           HA       TYR  30   0.876  20.305   0.399
  259    HB2  TYR  30          2HB       TYR  30   2.141  21.148  -2.187
  260    HB3  TYR  30          3HB       TYR  30   0.955  19.881  -1.891
  261    HD1  TYR  30           HD1      TYR  30   1.421  23.536  -2.179
  262    HD2  TYR  30           HD2      TYR  30  -1.377  20.336  -1.982
  263    HE1  TYR  30           HE1      TYR  30  -0.378  25.076  -2.843
  264    HE2  TYR  30           HE2      TYR  30  -3.183  21.867  -2.647
  265    HH   TYR  30           HH       TYR  30  -2.728  24.754  -4.042
  266    HA   PRO  31           HA       PRO  31   5.567  19.701  -0.596
  267    HB2  PRO  31          2HB       PRO  31   7.086  21.939  -0.835
  268    HB3  PRO  31          3HB       PRO  31   6.256  21.190  -2.204
  269    HG2  PRO  31          2HG       PRO  31   5.439  23.551  -0.555
  270    HG3  PRO  31          3HG       PRO  31   5.365  23.335  -2.314
  271    HD2  PRO  31          2HD       PRO  31   3.197  23.043  -0.717
  272    HD3  PRO  31          3HD       PRO  31   3.420  22.102  -2.206
  273    H    TRP  32           H        TRP  32   7.797  20.679   0.525
  274    HA   TRP  32           HA       TRP  32   7.188  20.551   3.345
  275    HB2  TRP  32          2HB       TRP  32   9.451  20.090   3.681
  276    HB3  TRP  32          3HB       TRP  32   9.146  19.402   2.088
  277    HD1  TRP  32           HD1      TRP  32  11.182  22.050   3.851
  278    HE1  TRP  32           HE1      TRP  32  12.778  23.161   2.166
  279    HE3  TRP  32           HE3      TRP  32   9.304  20.070  -0.472
  280    HZ2  TRP  32           HZ2      TRP  32  13.187  23.194  -0.627
  281    HZ3  TRP  32           HZ3      TRP  32  10.354  20.692  -2.608
  282    HH2  TRP  32           HH2      TRP  32  12.255  22.223  -2.682
  283    H    GLU  33           H        GLU  33   7.060  23.015   1.271
  284    HA   GLU  33           HA       GLU  33   8.495  24.995   2.832
  285    HB2  GLU  33          2HB       GLU  33   6.632  25.510   0.517
  286    HB3  GLU  33          3HB       GLU  33   7.907  26.555   1.128
  287    HG2  GLU  33          2HG       GLU  33   9.599  25.058   0.328
  288    HG3  GLU  33          3HG       GLU  33   8.384  23.869  -0.138
  289    H    ILE  34           H        ILE  34   6.656  23.801   4.433
  290    HA   ILE  34           HA       ILE  34   4.307  25.538   4.518
  291    HB   ILE  34           HB       ILE  34   4.989  23.142   6.226
  292   HG12  ILE  34          2HG1      ILE  34   2.770  23.158   4.235
  293   HG13  ILE  34          3HG1      ILE  34   4.414  22.988   3.631
  294   HG21  ILE  34          1HG2      ILE  34   3.511  24.791   7.320
  295   HG22  ILE  34          2HG2      ILE  34   2.386  24.640   5.972
  296   HG23  ILE  34          3HG2      ILE  34   2.709  23.252   7.010
  297   HD11  ILE  34          1HD1      ILE  34   4.734  20.966   4.751
  298   HD12  ILE  34          2HD1      ILE  34   3.347  21.230   5.808
  299   HD13  ILE  34          3HD1      ILE  34   3.098  20.865   4.101
  300    HA   PRO  35           HA       PRO  35   6.164  28.143   7.573
  301    HB2  PRO  35          2HB       PRO  35   3.901  29.418   8.365
  302    HB3  PRO  35          3HB       PRO  35   4.714  29.766   6.834
  303    HG2  PRO  35          2HG       PRO  35   2.318  28.050   7.359
  304    HG3  PRO  35          3HG       PRO  35   2.595  29.215   6.052
  305    HD2  PRO  35          2HD       PRO  35   2.883  26.544   5.709
  306    HD3  PRO  35          3HD       PRO  35   3.867  27.731   4.829
  307    H    ARG  36           H        ARG  36   5.238  28.950   9.899
  308    HA   ARG  36           HA       ARG  36   5.228  26.558  11.499
  309    HB2  ARG  36          2HB       ARG  36   4.920  29.407  12.451
  310    HB3  ARG  36          3HB       ARG  36   5.456  28.018  13.388
  311    HG2  ARG  36          2HG       ARG  36   7.503  28.809  12.963
  312    HG3  ARG  36          3HG       ARG  36   7.289  28.036  11.391
  313    HD2  ARG  36          2HD       ARG  36   7.737  30.071  10.562
  314    HD3  ARG  36          3HD       ARG  36   6.066  30.434  10.991
  315    HE   ARG  36           HE       ARG  36   7.548  30.960  13.250
  316   HH11  ARG  36          1HH1      ARG  36   7.476  32.084   9.955
  317   HH12  ARG  36          2HH1      ARG  36   8.048  33.672  10.347
  318   HH21  ARG  36          1HH2      ARG  36   8.301  33.047  13.778
  319   HH22  ARG  36          2HH2      ARG  36   8.518  34.218  12.522
  320    H    CYS  37           H        CYS  37   3.665  26.148  13.207
  321    HA   CYS  37           HA       CYS  37   1.038  26.034  12.286
  322    HB2  CYS  37          2HB       CYS  37   2.334  25.632  14.952
  323    HB3  CYS  37          3HB       CYS  37   0.577  25.682  14.859
  324    HG   CYS  37           HG       CYS  37   1.267  23.016  14.920
  Start of MODEL   10
    1    H    MET   1           H        MET   1   3.816  -1.008  -2.196
    2    HA   MET   1           HA       MET   1   4.177  -0.109   0.297
    3    HB2  MET   1          2HB       MET   1   6.868  -1.040  -0.718
    4    HB3  MET   1          3HB       MET   1   6.614  -0.052   0.714
    5    HG2  MET   1          2HG       MET   1   5.332  -1.865   1.736
    6    HG3  MET   1          3HG       MET   1   5.599  -2.855   0.303
    7    HE1  MET   1          1HE       MET   1   7.921  -3.042   3.946
    8    HE2  MET   1          2HE       MET   1   7.516  -1.358   3.611
    9    HE3  MET   1          3HE       MET   1   6.251  -2.588   3.601
   10    H    LYS   2           H        LYS   2   3.197   1.115  -1.772
   11    HA   LYS   2           HA       LYS   2   3.207   3.016  -3.022
   12    HB2  LYS   2          2HB       LYS   2   5.576   3.778  -1.306
   13    HB3  LYS   2          3HB       LYS   2   4.550   4.875  -2.220
   14    HG2  LYS   2          2HG       LYS   2   3.327   5.125  -0.393
   15    HG3  LYS   2          3HG       LYS   2   2.802   3.450  -0.584
   16    HD2  LYS   2          2HD       LYS   2   4.952   2.835   0.669
   17    HD3  LYS   2          3HD       LYS   2   5.026   4.541   1.116
   18    HE2  LYS   2          2HE       LYS   2   3.913   3.515   2.901
   19    HE3  LYS   2          3HE       LYS   2   2.627   4.246   1.941
   20    HZ1  LYS   2          1HZ       LYS   2   2.299   2.048   0.888
   21    HZ2  LYS   2          2HZ       LYS   2   1.978   2.046   2.549
   22    HZ3  LYS   2          3HZ       LYS   2   3.422   1.386   1.966
   23    H    PHE   3           H        PHE   3   4.069   1.289  -4.622
   24    HA   PHE   3           HA       PHE   3   6.793   1.448  -5.428
   25    HB2  PHE   3          2HB       PHE   3   4.303   0.256  -6.584
   26    HB3  PHE   3          3HB       PHE   3   5.733   0.407  -7.600
   27    HD1  PHE   3           HD1      PHE   3   5.142  -0.575  -4.046
   28    HD2  PHE   3           HD2      PHE   3   6.836  -1.585  -7.818
   29    HE1  PHE   3           HE1      PHE   3   6.039  -2.654  -3.083
   30    HE2  PHE   3           HE2      PHE   3   7.735  -3.666  -6.861
   31    HZ   PHE   3           HZ       PHE   3   7.336  -4.203  -4.491
   32    H    LYS   4           H        LYS   4   7.316   2.030  -7.787
   33    HA   LYS   4           HA       LYS   4   6.076   4.633  -8.400
   34    HB2  LYS   4          2HB       LYS   4   8.893   3.817  -9.108
   35    HB3  LYS   4          3HB       LYS   4   8.188   5.426  -9.183
   36    HG2  LYS   4          2HG       LYS   4   9.267   5.697  -7.234
   37    HG3  LYS   4          3HG       LYS   4   7.846   4.889  -6.569
   38    HD2  LYS   4          2HD       LYS   4   9.225   2.718  -7.110
   39    HD3  LYS   4          3HD       LYS   4  10.595   3.829  -7.036
   40    HE2  LYS   4          2HE       LYS   4   9.358   4.568  -4.798
   41    HE3  LYS   4          3HE       LYS   4   8.763   2.911  -4.889
   42    HZ1  LYS   4          1HZ       LYS   4  11.162   2.249  -5.164
   43    HZ2  LYS   4          2HZ       LYS   4  10.732   2.833  -3.636
   44    HZ3  LYS   4          3HZ       LYS   4  11.573   3.827  -4.715
   45    H    PHE   5           H        PHE   5   7.159   1.565  -9.638
   46    HA   PHE   5           HA       PHE   5   6.621   2.316 -12.395
   47    HB2  PHE   5          2HB       PHE   5   7.494  -0.314 -11.181
   48    HB3  PHE   5          3HB       PHE   5   7.321  -0.011 -12.907
   49    HD1  PHE   5           HD1      PHE   5   8.667   2.089 -13.780
   50    HD2  PHE   5           HD2      PHE   5   9.574  -0.095 -10.241
   51    HE1  PHE   5           HE1      PHE   5  10.983   2.915 -13.869
   52    HE2  PHE   5           HE2      PHE   5  11.891   0.728 -10.324
   53    HZ   PHE   5           HZ       PHE   5  12.598   2.235 -12.138
   54    H    ASN   6           H        ASN   6   5.178   0.457  -9.801
   55    HA   ASN   6           HA       ASN   6   3.289  -1.028 -11.164
   56    HB2  ASN   6          2HB       ASN   6   3.574   0.031  -8.434
   57    HB3  ASN   6          3HB       ASN   6   1.910  -0.283  -8.919
   58   HD21  ASN   6          1HD2      ASN   6   5.098  -1.823  -9.189
   59   HD22  ASN   6          2HD2      ASN   6   4.551  -3.412  -8.784
   60    HA   PRO   7           HA       PRO   7   0.295   1.705 -12.841
   61    HB2  PRO   7          2HB       PRO   7  -2.036   0.409 -12.330
   62    HB3  PRO   7          3HB       PRO   7  -0.871  -0.149 -13.537
   63    HG2  PRO   7          2HG       PRO   7  -1.292  -1.099 -10.730
   64    HG3  PRO   7          3HG       PRO   7  -1.013  -2.047 -12.202
   65    HD2  PRO   7          2HD       PRO   7   0.949  -1.529 -10.409
   66    HD3  PRO   7          3HD       PRO   7   1.264  -1.694 -12.149
   67    H    THR   8           H        THR   8  -0.295   0.635  -9.531
   68    HA   THR   8           HA       THR   8  -2.303   2.444  -8.827
   69    HB   THR   8           HB       THR   8  -1.451   0.471  -7.460
   70    HG1  THR   8           HG1      THR   8  -2.962   1.995  -6.632
   71   HG21  THR   8          1HG2      THR   8   0.934   1.152  -7.491
   72   HG22  THR   8          2HG2      THR   8   0.315   0.892  -5.860
   73   HG23  THR   8          3HG2      THR   8   0.524   2.532  -6.473
   74    H    GLY   9           H        GLY   9   1.024   2.970  -9.466
   75    HA2  GLY   9          2HA       GLY   9   1.691   5.120  -7.867
   76    HA3  GLY   9          3HA       GLY   9   2.269   4.901  -9.512
   77    H    THR  10           H        THR  10  -0.174   5.145 -10.876
   78    HA   THR  10           HA       THR  10  -0.406   8.000 -10.938
   79    HB   THR  10           HB       THR  10  -2.037   5.931 -12.425
   80    HG1  THR  10           HG1      THR  10  -0.038   5.656 -13.210
   81   HG21  THR  10          1HG2      THR  10  -3.140   7.612 -13.396
   82   HG22  THR  10          2HG2      THR  10  -1.642   8.476 -13.739
   83   HG23  THR  10          3HG2      THR  10  -2.440   8.680 -12.180
   84    H    ILE  11           H        ILE  11  -2.681   5.355 -10.213
   85    HA   ILE  11           HA       ILE  11  -4.908   6.882  -9.590
   86    HB   ILE  11           HB       ILE  11  -4.051   4.273  -8.333
   87   HG12  ILE  11          2HG1      ILE  11  -6.117   3.768 -10.087
   88   HG13  ILE  11          3HG1      ILE  11  -5.195   5.009 -10.929
   89   HG21  ILE  11          1HG2      ILE  11  -6.432   3.984  -7.796
   90   HG22  ILE  11          2HG2      ILE  11  -5.727   5.374  -6.971
   91   HG23  ILE  11          3HG2      ILE  11  -6.750   5.615  -8.387
   92   HD11  ILE  11          1HD1      ILE  11  -4.178   3.123 -11.703
   93   HD12  ILE  11          2HD1      ILE  11  -3.168   3.469 -10.299
   94   HD13  ILE  11          3HD1      ILE  11  -4.425   2.237 -10.199
   95    H    VAL  12           H        VAL  12  -2.470   5.607  -7.318
   96    HA   VAL  12           HA       VAL  12  -3.441   6.760  -4.995
   97    HB   VAL  12           HB       VAL  12  -0.565   6.242  -5.761
   98   HG11  VAL  12          1HG1      VAL  12  -0.134   6.243  -3.330
   99   HG12  VAL  12          2HG1      VAL  12  -0.640   7.822  -3.933
  100   HG13  VAL  12          3HG1      VAL  12  -1.784   6.802  -3.060
  101   HG21  VAL  12          1HG2      VAL  12  -2.081   4.536  -3.865
  102   HG22  VAL  12          2HG2      VAL  12  -2.459   4.388  -5.581
  103   HG23  VAL  12          3HG2      VAL  12  -0.814   4.104  -5.013
  104    H    LYS  13           H        LYS  13  -1.598   8.192  -7.593
  105    HA   LYS  13           HA       LYS  13  -0.937  10.590  -6.164
  106    HB2  LYS  13          2HB       LYS  13   0.441  10.917  -7.891
  107    HB3  LYS  13          3HB       LYS  13  -0.127   9.391  -8.556
  108    HG2  LYS  13          2HG       LYS  13  -1.876  10.577  -9.784
  109    HG3  LYS  13          3HG       LYS  13  -1.300  12.108  -9.119
  110    HD2  LYS  13          2HD       LYS  13   0.839  10.578 -10.344
  111    HD3  LYS  13          3HD       LYS  13  -0.471  10.910 -11.480
  112    HE2  LYS  13          2HE       LYS  13   0.963  12.747 -11.691
  113    HE3  LYS  13          3HE       LYS  13  -0.335  13.324 -10.648
  114    HZ1  LYS  13          1HZ       LYS  13   2.286  12.320  -9.680
  115    HZ2  LYS  13          2HZ       LYS  13   1.056  12.994  -8.735
  116    HZ3  LYS  13          3HZ       LYS  13   1.886  13.955  -9.853
  117    H    LYS  14           H        LYS  14  -3.510   9.544  -8.303
  118    HA   LYS  14           HA       LYS  14  -4.633  12.167  -8.628
  119    HB2  LYS  14          2HB       LYS  14  -5.740   9.417  -9.216
  120    HB3  LYS  14          3HB       LYS  14  -6.560  10.918  -9.625
  121    HG2  LYS  14          2HG       LYS  14  -3.915   9.957 -10.691
  122    HG3  LYS  14          3HG       LYS  14  -5.442  10.065 -11.569
  123    HD2  LYS  14          2HD       LYS  14  -5.421  12.517 -11.217
  124    HD3  LYS  14          3HD       LYS  14  -3.839  12.364 -10.450
  125    HE2  LYS  14          2HE       LYS  14  -3.184  11.157 -12.659
  126    HE3  LYS  14          3HE       LYS  14  -4.608  11.965 -13.314
  127    HZ1  LYS  14          1HZ       LYS  14  -2.786  13.642 -11.798
  128    HZ2  LYS  14          2HZ       LYS  14  -3.615  13.967 -13.236
  129    HZ3  LYS  14          3HZ       LYS  14  -2.187  13.060 -13.270
  130    H    LEU  15           H        LEU  15  -5.533   9.266  -6.776
  131    HA   LEU  15           HA       LEU  15  -7.831  10.267  -5.567
  132    HB2  LEU  15          2HB       LEU  15  -5.841   8.169  -4.842
  133    HB3  LEU  15          3HB       LEU  15  -7.062   8.636  -3.660
  134    HG   LEU  15           HG       LEU  15  -7.526   6.593  -5.130
  135   HD11  LEU  15          1HD1      LEU  15  -9.783   8.455  -5.468
  136   HD12  LEU  15          2HD1      LEU  15  -9.151   8.297  -3.830
  137   HD13  LEU  15          3HD1      LEU  15  -9.719   6.870  -4.697
  138   HD21  LEU  15          1HD2      LEU  15  -8.496   7.050  -7.311
  139   HD22  LEU  15          2HD2      LEU  15  -6.824   7.608  -7.250
  140   HD23  LEU  15          3HD2      LEU  15  -8.146   8.769  -7.126
  141    H    THR  16           H        THR  16  -4.458  10.754  -4.787
  142    HA   THR  16           HA       THR  16  -4.917  11.912  -2.213
  143    HB   THR  16           HB       THR  16  -2.495  12.084  -4.017
  144    HG1  THR  16           HG1      THR  16  -3.228   9.968  -3.095
  145   HG21  THR  16          1HG2      THR  16  -1.692  12.388  -1.379
  146   HG22  THR  16          2HG2      THR  16  -3.140  13.387  -1.504
  147   HG23  THR  16          3HG2      THR  16  -1.784  13.658  -2.598
  148    H    GLN  17           H        GLN  17  -4.794  13.103  -5.485
  149    HA   GLN  17           HA       GLN  17  -4.301  15.801  -5.071
  150    HB2  GLN  17          2HB       GLN  17  -4.808  14.320  -7.249
  151    HB3  GLN  17          3HB       GLN  17  -6.377  15.095  -7.072
  152    HG2  GLN  17          2HG       GLN  17  -5.021  17.283  -6.911
  153    HG3  GLN  17          3HG       GLN  17  -3.713  16.334  -7.615
  154   HE21  GLN  17          1HE2      GLN  17  -3.556  16.867  -9.672
  155   HE22  GLN  17          2HE2      GLN  17  -4.866  16.998 -10.790
  156    H    TYR  18           H        TYR  18  -7.119  13.925  -4.347
  157    HA   TYR  18           HA       TYR  18  -8.737  16.315  -3.893
  158    HB2  TYR  18          2HB       TYR  18  -9.456  13.382  -3.713
  159    HB3  TYR  18          3HB       TYR  18 -10.581  14.716  -3.484
  160    HD1  TYR  18           HD1      TYR  18  -8.271  13.217  -5.988
  161    HD2  TYR  18           HD2      TYR  18 -11.712  15.626  -5.315
  162    HE1  TYR  18           HE1      TYR  18  -8.716  13.245  -8.406
  163    HE2  TYR  18           HE2      TYR  18 -12.168  15.661  -7.731
  164    HH   TYR  18           HH       TYR  18 -10.083  15.042 -10.004
  165    H    GLU  19           H        GLU  19  -7.000  13.839  -2.181
  166    HA   GLU  19           HA       GLU  19  -8.219  14.280   0.363
  167    HB2  GLU  19          2HB       GLU  19  -5.566  13.012  -0.341
  168    HB3  GLU  19          3HB       GLU  19  -6.326  12.955   1.243
  169    HG2  GLU  19          2HG       GLU  19  -7.663  11.891  -1.224
  170    HG3  GLU  19          3HG       GLU  19  -6.586  10.914  -0.227
  171    H    ILE  20           H        ILE  20  -5.375  15.534  -1.288
  172    HA   ILE  20           HA       ILE  20  -4.081  16.806   0.801
  173    HB   ILE  20           HB       ILE  20  -4.359  17.810  -2.034
  174   HG12  ILE  20          2HG1      ILE  20  -1.894  16.455  -1.126
  175   HG13  ILE  20          3HG1      ILE  20  -3.313  15.424  -1.274
  176   HG21  ILE  20          1HG2      ILE  20  -3.194  19.577  -1.367
  177   HG22  ILE  20          2HG2      ILE  20  -3.072  18.928   0.268
  178   HG23  ILE  20          3HG2      ILE  20  -1.865  18.497  -0.943
  179   HD11  ILE  20          1HD1      ILE  20  -1.637  16.606  -3.330
  180   HD12  ILE  20          2HD1      ILE  20  -2.731  15.225  -3.408
  181   HD13  ILE  20          3HD1      ILE  20  -3.360  16.861  -3.607
  182    H    ALA  21           H        ALA  21  -6.962  17.758  -0.943
  183    HA   ALA  21           HA       ALA  21  -7.167  20.434  -0.315
  184    HB1  ALA  21          1HB       ALA  21  -9.633  20.097  -0.420
  185    HB2  ALA  21          2HB       ALA  21  -8.753  19.405  -1.784
  186    HB3  ALA  21          3HB       ALA  21  -9.344  18.359  -0.493
  187    H    TRP  22           H        TRP  22  -8.135  17.649   1.661
  188    HA   TRP  22           HA       TRP  22  -9.336  18.957   3.774
  189    HB2  TRP  22          2HB       TRP  22  -9.353  16.544   3.628
  190    HB3  TRP  22          3HB       TRP  22  -7.602  16.480   3.806
  191    HD1  TRP  22           HD1      TRP  22  -6.608  17.020   6.276
  192    HE1  TRP  22           HE1      TRP  22  -7.676  16.773   8.604
  193    HE3  TRP  22           HE3      TRP  22 -11.519  16.709   4.887
  194    HZ2  TRP  22           HZ2      TRP  22 -10.259  16.484   9.706
  195    HZ3  TRP  22           HZ3      TRP  22 -13.225  16.448   6.640
  196    HH2  TRP  22           HH2      TRP  22 -12.607  16.337   8.999
  197    H    PHE  23           H        PHE  23  -5.887  18.315   3.260
  198    HA   PHE  23           HA       PHE  23  -5.097  19.565   5.716
  199    HB2  PHE  23          2HB       PHE  23  -3.590  17.930   4.991
  200    HB3  PHE  23          3HB       PHE  23  -3.631  18.495   3.324
  201    HD1  PHE  23           HD1      PHE  23  -2.093  20.088   2.540
  202    HD2  PHE  23           HD2      PHE  23  -2.388  19.293   6.711
  203    HE1  PHE  23           HE1      PHE  23  -0.046  21.396   2.931
  204    HE2  PHE  23           HE2      PHE  23  -0.342  20.600   7.109
  205    HZ   PHE  23           HZ       PHE  23   0.831  21.654   5.218
  206    H    LYS  24           H        LYS  24  -5.555  20.579   2.417
  207    HA   LYS  24           HA       LYS  24  -4.060  22.954   2.448
  208    HB2  LYS  24          2HB       LYS  24  -4.942  21.962   0.387
  209    HB3  LYS  24          3HB       LYS  24  -6.585  22.307   0.913
  210    HG2  LYS  24          2HG       LYS  24  -6.268  24.087  -0.449
  211    HG3  LYS  24          3HG       LYS  24  -5.622  24.774   1.043
  212    HD2  LYS  24          2HD       LYS  24  -3.356  23.904   0.270
  213    HD3  LYS  24          3HD       LYS  24  -4.115  23.643  -1.302
  214    HE2  LYS  24          2HE       LYS  24  -4.144  26.291   0.132
  215    HE3  LYS  24          3HE       LYS  24  -2.891  25.831  -1.020
  216    HZ1  LYS  24          1HZ       LYS  24  -5.130  27.104  -1.696
  217    HZ2  LYS  24          2HZ       LYS  24  -5.620  25.504  -1.945
  218    HZ3  LYS  24          3HZ       LYS  24  -4.265  26.110  -2.757
  219    H    ASN  25           H        ASN  25  -7.203  22.168   3.728
  220    HA   ASN  25           HA       ASN  25  -7.997  24.904   4.135
  221    HB2  ASN  25          2HB       ASN  25  -9.134  22.270   5.079
  222    HB3  ASN  25          3HB       ASN  25  -9.837  23.826   5.512
  223   HD21  ASN  25          1HD2      ASN  25  -9.950  21.324   3.367
  224   HD22  ASN  25          2HD2      ASN  25 -10.776  22.104   2.066
  225    H    LYS  26           H        LYS  26  -5.899  22.796   5.696
  226    HA   LYS  26           HA       LYS  26  -6.294  23.967   8.340
  227    HB2  LYS  26          2HB       LYS  26  -4.194  21.950   7.564
  228    HB3  LYS  26          3HB       LYS  26  -4.830  22.291   9.168
  229    HG2  LYS  26          2HG       LYS  26  -6.422  21.078   6.919
  230    HG3  LYS  26          3HG       LYS  26  -5.643  20.164   8.213
  231    HD2  LYS  26          2HD       LYS  26  -6.994  21.412   9.862
  232    HD3  LYS  26          3HD       LYS  26  -7.810  22.241   8.535
  233    HE2  LYS  26          2HE       LYS  26  -9.297  20.548   8.922
  234    HE3  LYS  26          3HE       LYS  26  -8.262  19.776   7.722
  235    HZ1  LYS  26          1HZ       LYS  26  -7.972  19.465  10.661
  236    HZ2  LYS  26          2HZ       LYS  26  -7.069  18.666   9.475
  237    HZ3  LYS  26          3HZ       LYS  26  -8.721  18.343   9.640
  238    H    HIS  27           H        HIS  27  -4.084  24.049   5.639
  239    HA   HIS  27           HA       HIS  27  -2.686  26.287   6.908
  240    HB2  HIS  27          2HB       HIS  27  -1.249  24.012   5.526
  241    HB3  HIS  27          3HB       HIS  27  -0.503  25.439   6.240
  242    HD1  HIS  27           HD1      HIS  27  -2.309  22.275   7.220
  243    HD2  HIS  27           HD2      HIS  27  -0.009  25.276   8.942
  244    HE1  HIS  27           HE1      HIS  27  -1.817  21.487   9.557
  245    H    GLY  28           H        GLY  28  -3.110  24.380   3.938
  246    HA2  GLY  28          2HA       GLY  28  -3.875  25.346   1.900
  247    HA3  GLY  28          3HA       GLY  28  -3.264  26.901   2.443
  248    H    TYR  29           H        TYR  29  -1.345  24.009   2.726
  249    HA   TYR  29           HA       TYR  29   0.305  24.912   0.459
  250    HB2  TYR  29          2HB       TYR  29   1.152  24.085   3.224
  251    HB3  TYR  29          3HB       TYR  29   2.258  23.968   1.860
  252    HD1  TYR  29           HD1      TYR  29   3.602  25.784   1.359
  253    HD2  TYR  29           HD2      TYR  29  -0.003  26.431   3.524
  254    HE1  TYR  29           HE1      TYR  29   4.200  28.154   1.635
  255    HE2  TYR  29           HE2      TYR  29   0.584  28.803   3.805
  256    HH   TYR  29           HH       TYR  29   2.743  30.384   2.038
  257    H    TYR  30           H        TYR  30   2.128  22.961   0.285
  258    HA   TYR  30           HA       TYR  30   0.780  20.379   0.340
  259    HB2  TYR  30          2HB       TYR  30   2.045  21.218  -2.246
  260    HB3  TYR  30          3HB       TYR  30   0.855  19.955  -1.950
  261    HD1  TYR  30           HD1      TYR  30  -1.475  20.417  -2.042
  262    HD2  TYR  30           HD2      TYR  30   1.332  23.609  -2.237
  263    HE1  TYR  30           HE1      TYR  30  -3.277  21.953  -2.705
  264    HE2  TYR  30           HE2      TYR  30  -0.463  25.154  -2.900
  265    HH   TYR  30           HH       TYR  30  -2.644  25.143  -3.849
  266    HA   PRO  31           HA       PRO  31   5.469  19.763  -0.658
  267    HB2  PRO  31          2HB       PRO  31   6.993  21.996  -0.898
  268    HB3  PRO  31          3HB       PRO  31   6.160  21.250  -2.266
  269    HG2  PRO  31          2HG       PRO  31   5.351  23.613  -0.617
  270    HG3  PRO  31          3HG       PRO  31   5.275  23.397  -2.375
  271    HD2  PRO  31          2HD       PRO  31   3.108  23.111  -0.777
  272    HD3  PRO  31          3HD       PRO  31   3.327  22.170  -2.266
  273    H    TRP  32           H        TRP  32   7.702  20.734   0.462
  274    HA   TRP  32           HA       TRP  32   7.094  20.608   3.282
  275    HB2  TRP  32          2HB       TRP  32   9.356  20.141   3.616
  276    HB3  TRP  32          3HB       TRP  32   9.049  19.453   2.024
  277    HD1  TRP  32           HD1      TRP  32  11.093  22.096   3.785
  278    HE1  TRP  32           HE1      TRP  32  12.691  23.202   2.098
  279    HE3  TRP  32           HE3      TRP  32   9.206  20.119  -0.536
  280    HZ2  TRP  32           HZ2      TRP  32  13.098  23.233  -0.696
  281    HZ3  TRP  32           HZ3      TRP  32  10.257  20.738  -2.673
  282    HH2  TRP  32           HH2      TRP  32  12.162  22.263  -2.749
  283    H    GLU  33           H        GLU  33   6.972  23.072   1.209
  284    HA   GLU  33           HA       GLU  33   8.414  25.048   2.768
  285    HB2  GLU  33          2HB       GLU  33   6.550  25.568   0.455
  286    HB3  GLU  33          3HB       GLU  33   7.829  26.610   1.065
  287    HG2  GLU  33          2HG       GLU  33   9.516  25.108   0.263
  288    HG3  GLU  33          3HG       GLU  33   8.297  23.922  -0.202
  289    H    ILE  34           H        ILE  34   6.573  23.859   4.371
  290    HA   ILE  34           HA       ILE  34   4.229  25.603   4.459
  291    HB   ILE  34           HB       ILE  34   4.906  23.204   6.165
  292   HG12  ILE  34          2HG1      ILE  34   2.684  23.228   4.176
  293   HG13  ILE  34          3HG1      ILE  34   4.328  23.052   3.571
  294   HG21  ILE  34          1HG2      ILE  34   2.628  23.320   6.953
  295   HG22  ILE  34          2HG2      ILE  34   3.435  24.856   7.262
  296   HG23  ILE  34          3HG2      ILE  34   2.306  24.709   5.916
  297   HD11  ILE  34          1HD1      ILE  34   4.576  20.980   4.456
  298   HD12  ILE  34          2HD1      ILE  34   3.496  21.306   5.812
  299   HD13  ILE  34          3HD1      ILE  34   2.829  20.976   4.213
  300    HA   PRO  35           HA       PRO  35   6.096  28.203   7.511
  301    HB2  PRO  35          2HB       PRO  35   3.838  29.484   8.306
  302    HB3  PRO  35          3HB       PRO  35   4.650  29.829   6.774
  303    HG2  PRO  35          2HG       PRO  35   2.250  28.119   7.302
  304    HG3  PRO  35          3HG       PRO  35   2.528  29.284   5.994
  305    HD2  PRO  35          2HD       PRO  35   2.809  26.613   5.651
  306    HD3  PRO  35          3HD       PRO  35   3.795  27.797   4.770
  307    H    ARG  36           H        ARG  36   5.171  29.013   9.839
  308    HA   ARG  36           HA       ARG  36   5.190  26.637  11.449
  309    HB2  ARG  36          2HB       ARG  36   4.791  29.485  12.369
  310    HB3  ARG  36          3HB       ARG  36   5.336  28.120  13.335
  311    HG2  ARG  36          2HG       ARG  36   7.364  28.996  12.947
  312    HG3  ARG  36          3HG       ARG  36   7.225  28.127  11.418
  313    HD2  ARG  36          2HD       ARG  36   7.472  30.068  10.366
  314    HD3  ARG  36          3HD       ARG  36   5.911  30.562  11.019
  315    HE   ARG  36           HE       ARG  36   7.001  31.959  12.464
  316   HH11  ARG  36          1HH1      ARG  36   9.274  29.653  11.184
  317   HH12  ARG  36          2HH1      ARG  36  10.655  30.426  11.890
  318   HH21  ARG  36          1HH2      ARG  36   8.811  32.986  13.398
  319   HH22  ARG  36          2HH2      ARG  36  10.390  32.321  13.150
  320    H    CYS  37           H        CYS  37   3.623  26.204  13.157
  321    HA   CYS  37           HA       CYS  37   0.910  26.550  12.166
  322    HB2  CYS  37          2HB       CYS  37   1.857  24.322  12.943
  323    HB3  CYS  37          3HB       CYS  37   1.780  24.962  14.580
  324    HG   CYS  37           HG       CYS  37  -1.132  25.398  13.129
  Start of MODEL   11
    1    H    MET   1           H        MET   1   3.144  -1.338  -1.638
    2    HA   MET   1           HA       MET   1   4.217  -0.482   0.303
    3    HB2  MET   1          2HB       MET   1   5.863  -2.430   0.154
    4    HB3  MET   1          3HB       MET   1   6.835  -1.392  -0.880
    5    HG2  MET   1          2HG       MET   1   6.743   0.299   1.026
    6    HG3  MET   1          3HG       MET   1   6.151  -1.035   2.014
    7    HE1  MET   1          1HE       MET   1   8.102  -0.370   3.572
    8    HE2  MET   1          2HE       MET   1   7.967  -2.128   3.607
    9    HE3  MET   1          3HE       MET   1   9.556  -1.367   3.518
   10    H    LYS   2           H        LYS   2   3.283   1.009  -1.601
   11    HA   LYS   2           HA       LYS   2   3.469   2.951  -2.776
   12    HB2  LYS   2          2HB       LYS   2   5.786   3.291  -0.865
   13    HB3  LYS   2          3HB       LYS   2   5.162   4.574  -1.894
   14    HG2  LYS   2          2HG       LYS   2   3.769   5.097  -0.255
   15    HG3  LYS   2          3HG       LYS   2   2.929   3.576  -0.565
   16    HD2  LYS   2          2HD       LYS   2   4.538   2.467   0.999
   17    HD3  LYS   2          3HD       LYS   2   5.161   4.068   1.402
   18    HE2  LYS   2          2HE       LYS   2   3.589   4.151   2.978
   19    HE3  LYS   2          3HE       LYS   2   2.419   4.331   1.672
   20    HZ1  LYS   2          1HZ       LYS   2   2.776   2.162   3.459
   21    HZ2  LYS   2          2HZ       LYS   2   2.934   1.628   1.862
   22    HZ3  LYS   2          3HZ       LYS   2   1.529   2.434   2.349
   23    H    PHE   3           H        PHE   3   4.125   1.393  -4.559
   24    HA   PHE   3           HA       PHE   3   6.902   1.451  -5.343
   25    HB2  PHE   3          2HB       PHE   3   4.402   0.232  -6.453
   26    HB3  PHE   3          3HB       PHE   3   5.818   0.388  -7.488
   27    HD1  PHE   3           HD1      PHE   3   5.304  -0.567  -3.916
   28    HD2  PHE   3           HD2      PHE   3   6.907  -1.612  -7.718
   29    HE1  PHE   3           HE1      PHE   3   6.228  -2.635  -2.954
   30    HE2  PHE   3           HE2      PHE   3   7.832  -3.682  -6.763
   31    HZ   PHE   3           HZ       PHE   3   7.492  -4.197  -4.379
   32    H    LYS   4           H        LYS   4   7.455   2.102  -7.630
   33    HA   LYS   4           HA       LYS   4   6.125   4.654  -8.264
   34    HB2  LYS   4          2HB       LYS   4   8.960   3.926  -8.990
   35    HB3  LYS   4          3HB       LYS   4   8.210   5.517  -9.018
   36    HG2  LYS   4          2HG       LYS   4   9.257   5.791  -7.061
   37    HG3  LYS   4          3HG       LYS   4   7.910   4.856  -6.408
   38    HD2  LYS   4          2HD       LYS   4   9.810   3.796  -5.552
   39    HD3  LYS   4          3HD       LYS   4   9.343   2.793  -6.927
   40    HE2  LYS   4          2HE       LYS   4  11.389   3.051  -7.750
   41    HE3  LYS   4          3HE       LYS   4  11.056   4.771  -7.945
   42    HZ1  LYS   4          1HZ       LYS   4  12.140   3.530  -5.475
   43    HZ2  LYS   4          2HZ       LYS   4  11.908   5.182  -5.749
   44    HZ3  LYS   4          3HZ       LYS   4  13.069   4.332  -6.639
   45    H    PHE   5           H        PHE   5   7.301   1.621  -9.507
   46    HA   PHE   5           HA       PHE   5   6.771   2.356 -12.265
   47    HB2  PHE   5          2HB       PHE   5   7.710  -0.215 -10.984
   48    HB3  PHE   5          3HB       PHE   5   7.431  -0.036 -12.713
   49    HD1  PHE   5           HD1      PHE   5   8.632   2.161 -13.713
   50    HD2  PHE   5           HD2      PHE   5   9.874  -0.021 -10.277
   51    HE1  PHE   5           HE1      PHE   5  10.918   3.027 -13.994
   52    HE2  PHE   5           HE2      PHE   5  12.162   0.842 -10.551
   53    HZ   PHE   5           HZ       PHE   5  12.686   2.368 -12.411
   54    H    ASN   6           H        ASN   6   5.310   0.483  -9.689
   55    HA   ASN   6           HA       ASN   6   3.443  -1.007 -11.072
   56    HB2  ASN   6          2HB       ASN   6   3.685   0.060  -8.340
   57    HB3  ASN   6          3HB       ASN   6   2.031  -0.274  -8.847
   58   HD21  ASN   6          1HD2      ASN   6   1.879  -1.955  -7.348
   59   HD22  ASN   6          2HD2      ASN   6   2.647  -3.480  -7.613
   60    HA   PRO   7           HA       PRO   7   0.456   1.710 -12.788
   61    HB2  PRO   7          2HB       PRO   7  -1.874   0.403 -12.305
   62    HB3  PRO   7          3HB       PRO   7  -0.692  -0.150 -13.497
   63    HG2  PRO   7          2HG       PRO   7  -1.143  -1.102 -10.695
   64    HG3  PRO   7          3HG       PRO   7  -0.840  -2.049 -12.163
   65    HD2  PRO   7          2HD       PRO   7   1.097  -1.519 -10.347
   66    HD3  PRO   7          3HD       PRO   7   1.434  -1.684 -12.082
   67    H    THR   8           H        THR   8  -0.170   0.638  -9.485
   68    HA   THR   8           HA       THR   8  -2.196   2.436  -8.807
   69    HB   THR   8           HB       THR   8  -1.350   0.469  -7.428
   70    HG1  THR   8           HG1      THR   8  -2.765   2.380  -6.744
   71   HG21  THR   8          1HG2      THR   8   1.032   1.164  -7.431
   72   HG22  THR   8          2HG2      THR   8   0.395   0.899  -5.807
   73   HG23  THR   8          3HG2      THR   8   0.601   2.541  -6.418
   74    H    GLY   9           H        GLY   9   1.136   2.980  -9.405
   75    HA2  GLY   9          2HA       GLY   9   1.772   5.135  -7.799
   76    HA3  GLY   9          3HA       GLY   9   2.370   4.918  -9.437
   77    H    THR  10           H        THR  10  -0.057   5.148 -10.830
   78    HA   THR  10           HA       THR  10  -0.304   8.001 -10.897
   79    HB   THR  10           HB       THR  10  -1.906   5.923 -12.402
   80    HG1  THR  10           HG1      THR  10   0.437   5.936 -12.751
   81   HG21  THR  10          1HG2      THR  10  -3.005   7.598 -13.388
   82   HG22  THR  10          2HG2      THR  10  -1.507   8.470 -13.712
   83   HG23  THR  10          3HG2      THR  10  -2.327   8.670 -12.164
   84    H    ILE  11           H        ILE  11  -2.572   5.344 -10.198
   85    HA   ILE  11           HA       ILE  11  -4.815   6.860  -9.602
   86    HB   ILE  11           HB       ILE  11  -3.959   4.256  -8.334
   87   HG12  ILE  11          2HG1      ILE  11  -6.002   3.741 -10.114
   88   HG13  ILE  11          3HG1      ILE  11  -5.072   4.983 -10.944
   89   HG21  ILE  11          1HG2      ILE  11  -6.666   5.582  -8.423
   90   HG22  ILE  11          2HG2      ILE  11  -6.345   3.955  -7.826
   91   HG23  ILE  11          3HG2      ILE  11  -5.660   5.350  -6.994
   92   HD11  ILE  11          1HD1      ILE  11  -4.298   2.216 -10.192
   93   HD12  ILE  11          2HD1      ILE  11  -4.043   3.094 -11.700
   94   HD13  ILE  11          3HD1      ILE  11  -3.048   3.456 -10.290
   95    H    VAL  12           H        VAL  12  -2.398   5.599  -7.300
   96    HA   VAL  12           HA       VAL  12  -3.403   6.748  -4.990
   97    HB   VAL  12           HB       VAL  12  -0.516   6.247  -5.721
   98   HG11  VAL  12          1HG1      VAL  12  -0.621   7.826  -3.895
   99   HG12  VAL  12          2HG1      VAL  12  -1.771   6.800  -3.034
  100   HG13  VAL  12          3HG1      VAL  12  -0.113   6.251  -3.285
  101   HG21  VAL  12          1HG2      VAL  12  -2.358   4.370  -5.598
  102   HG22  VAL  12          2HG2      VAL  12  -0.751   4.112  -4.920
  103   HG23  VAL  12          3HG2      VAL  12  -2.096   4.539  -3.862
  104    H    LYS  13           H        LYS  13  -1.538   8.189  -7.567
  105    HA   LYS  13           HA       LYS  13  -0.907  10.591  -6.131
  106    HB2  LYS  13          2HB       LYS  13   0.490  10.924  -7.842
  107    HB3  LYS  13          3HB       LYS  13  -0.062   9.395  -8.513
  108    HG2  LYS  13          2HG       LYS  13  -1.803  10.572  -9.762
  109    HG3  LYS  13          3HG       LYS  13  -1.243  12.105  -9.092
  110    HD2  LYS  13          2HD       LYS  13   0.929  10.604 -10.279
  111    HD3  LYS  13          3HD       LYS  13  -0.372  10.890 -11.438
  112    HE2  LYS  13          2HE       LYS  13  -0.289  13.323 -10.573
  113    HE3  LYS  13          3HE       LYS  13   1.291  12.878  -9.931
  114    HZ1  LYS  13          1HZ       LYS  13   1.387  13.890 -12.160
  115    HZ2  LYS  13          2HZ       LYS  13   0.498  12.591 -12.778
  116    HZ3  LYS  13          3HZ       LYS  13   2.037  12.329 -12.125
  117    H    LYS  14           H        LYS  14  -3.448   9.530  -8.300
  118    HA   LYS  14           HA       LYS  14  -4.582  12.147  -8.640
  119    HB2  LYS  14          2HB       LYS  14  -5.667   9.391  -9.241
  120    HB3  LYS  14          3HB       LYS  14  -6.489  10.888  -9.660
  121    HG2  LYS  14          2HG       LYS  14  -3.826   9.940 -10.693
  122    HG3  LYS  14          3HG       LYS  14  -5.343  10.039 -11.590
  123    HD2  LYS  14          2HD       LYS  14  -5.339  12.491 -11.239
  124    HD3  LYS  14          3HD       LYS  14  -3.766  12.347 -10.452
  125    HE2  LYS  14          2HE       LYS  14  -3.011  12.784 -12.537
  126    HE3  LYS  14          3HE       LYS  14  -3.243  11.048 -12.739
  127    HZ1  LYS  14          1HZ       LYS  14  -4.310  12.919 -14.336
  128    HZ2  LYS  14          2HZ       LYS  14  -5.591  12.648 -13.265
  129    HZ3  LYS  14          3HZ       LYS  14  -4.939  11.359 -14.146
  130    H    LEU  15           H        LEU  15  -5.488   9.241  -6.799
  131    HA   LEU  15           HA       LEU  15  -7.805  10.230  -5.617
  132    HB2  LEU  15          2HB       LEU  15  -5.814   8.141  -4.868
  133    HB3  LEU  15          3HB       LEU  15  -7.052   8.602  -3.702
  134    HG   LEU  15           HG       LEU  15  -7.489   6.558  -5.176
  135   HD11  LEU  15          1HD1      LEU  15  -9.187   8.592  -4.157
  136   HD12  LEU  15          2HD1      LEU  15  -9.531   6.877  -4.383
  137   HD13  LEU  15          3HD1      LEU  15  -9.859   8.022  -5.684
  138   HD21  LEU  15          1HD2      LEU  15  -8.089   8.729  -7.182
  139   HD22  LEU  15          2HD2      LEU  15  -8.432   7.009  -7.371
  140   HD23  LEU  15          3HD2      LEU  15  -6.762   7.571  -7.287
  141    H    THR  16           H        THR  16  -4.445  10.734  -4.797
  142    HA   THR  16           HA       THR  16  -4.942  11.888  -2.228
  143    HB   THR  16           HB       THR  16  -2.499  12.071  -4.002
  144    HG1  THR  16           HG1      THR  16  -3.257   9.957  -3.061
  145   HG21  THR  16          1HG2      THR  16  -3.179  13.358  -1.482
  146   HG22  THR  16          2HG2      THR  16  -1.832  13.664  -2.578
  147   HG23  THR  16          3HG2      THR  16  -1.712  12.386  -1.370
  148    H    GLN  17           H        GLN  17  -4.786  13.081  -5.498
  149    HA   GLN  17           HA       GLN  17  -4.311  15.781  -5.077
  150    HB2  GLN  17          2HB       GLN  17  -4.827  14.271  -7.258
  151    HB3  GLN  17          3HB       GLN  17  -6.362  15.116  -7.103
  152    HG2  GLN  17          2HG       GLN  17  -4.251  16.998  -6.789
  153    HG3  GLN  17          3HG       GLN  17  -3.953  16.042  -8.240
  154   HE21  GLN  17          1HE2      GLN  17  -5.155  16.393 -10.016
  155   HE22  GLN  17          2HE2      GLN  17  -6.441  17.543 -10.117
  156    H    TYR  18           H        TYR  18  -7.127  13.891  -4.386
  157    HA   TYR  18           HA       TYR  18  -8.763  16.273  -3.951
  158    HB2  TYR  18          2HB       TYR  18  -9.469  13.337  -3.780
  159    HB3  TYR  18          3HB       TYR  18 -10.604  14.665  -3.565
  160    HD1  TYR  18           HD1      TYR  18 -11.720  15.566  -5.408
  161    HD2  TYR  18           HD2      TYR  18  -8.256  13.178  -6.041
  162    HE1  TYR  18           HE1      TYR  18 -12.147  15.599  -7.830
  163    HE2  TYR  18           HE2      TYR  18  -8.673  13.205  -8.465
  164    HH   TYR  18           HH       TYR  18 -11.525  14.018  -9.830
  165    H    GLU  19           H        GLU  19  -7.035  13.805  -2.220
  166    HA   GLU  19           HA       GLU  19  -8.285  14.240   0.310
  167    HB2  GLU  19          2HB       GLU  19  -5.619  12.983  -0.365
  168    HB3  GLU  19          3HB       GLU  19  -6.395  12.925   1.212
  169    HG2  GLU  19          2HG       GLU  19  -7.694  11.848  -1.270
  170    HG3  GLU  19          3HG       GLU  19  -6.635  10.880  -0.247
  171    H    ILE  20           H        ILE  20  -5.426  15.506  -1.307
  172    HA   ILE  20           HA       ILE  20  -4.164  16.784   0.798
  173    HB   ILE  20           HB       ILE  20  -4.409  17.785  -2.041
  174   HG12  ILE  20          2HG1      ILE  20  -1.951  16.440  -1.099
  175   HG13  ILE  20          3HG1      ILE  20  -3.364  15.404  -1.266
  176   HG21  ILE  20          1HG2      ILE  20  -3.260  19.557  -1.360
  177   HG22  ILE  20          2HG2      ILE  20  -3.157  18.910   0.277
  178   HG23  ILE  20          3HG2      ILE  20  -1.933  18.484  -0.919
  179   HD11  ILE  20          1HD1      ILE  20  -2.843  15.224  -3.409
  180   HD12  ILE  20          2HD1      ILE  20  -3.321  16.911  -3.595
  181   HD13  ILE  20          3HD1      ILE  20  -1.634  16.501  -3.288
  182    H    ALA  21           H        ALA  21  -7.026  17.724  -0.983
  183    HA   ALA  21           HA       ALA  21  -7.250  20.399  -0.360
  184    HB1  ALA  21          1HB       ALA  21  -9.832  19.248  -0.092
  185    HB2  ALA  21          2HB       ALA  21  -9.149  20.115  -1.468
  186    HB3  ALA  21          3HB       ALA  21  -8.961  18.365  -1.346
  187    H    TRP  22           H        TRP  22  -8.232  17.611   1.606
  188    HA   TRP  22           HA       TRP  22  -9.465  18.916   3.702
  189    HB2  TRP  22          2HB       TRP  22  -9.492  16.514   3.586
  190    HB3  TRP  22          3HB       TRP  22  -7.737  16.436   3.727
  191    HD1  TRP  22           HD1      TRP  22  -6.689  16.990   6.177
  192    HE1  TRP  22           HE1      TRP  22  -7.709  16.736   8.527
  193    HE3  TRP  22           HE3      TRP  22 -11.625  16.656   4.888
  194    HZ2  TRP  22           HZ2      TRP  22 -10.267  16.434   9.681
  195    HZ3  TRP  22           HZ3      TRP  22 -13.295  16.385   6.675
  196    HH2  TRP  22           HH2      TRP  22 -12.628  16.276   9.021
  197    H    PHE  23           H        PHE  23  -6.007  18.287   3.234
  198    HA   PHE  23           HA       PHE  23  -5.254  19.543   5.698
  199    HB2  PHE  23          2HB       PHE  23  -3.730  17.913   4.994
  200    HB3  PHE  23          3HB       PHE  23  -3.753  18.476   3.326
  201    HD1  PHE  23           HD1      PHE  23  -2.558  19.282   6.728
  202    HD2  PHE  23           HD2      PHE  23  -2.211  20.076   2.561
  203    HE1  PHE  23           HE1      PHE  23  -0.522  20.598   7.152
  204    HE2  PHE  23           HE2      PHE  23  -0.175  21.393   2.978
  205    HZ   PHE  23           HZ       PHE  23   0.672  21.655   5.275
  206    H    LYS  24           H        LYS  24  -5.674  20.552   2.393
  207    HA   LYS  24           HA       LYS  24  -4.189  22.934   2.440
  208    HB2  LYS  24          2HB       LYS  24  -5.040  21.936   0.370
  209    HB3  LYS  24          3HB       LYS  24  -6.691  22.275   0.874
  210    HG2  LYS  24          2HG       LYS  24  -6.364  24.055  -0.486
  211    HG3  LYS  24          3HG       LYS  24  -5.739  24.746   1.014
  212    HD2  LYS  24          2HD       LYS  24  -3.460  23.883   0.271
  213    HD3  LYS  24          3HD       LYS  24  -4.198  23.619  -1.311
  214    HE2  LYS  24          2HE       LYS  24  -4.256  26.267   0.121
  215    HE3  LYS  24          3HE       LYS  24  -2.986  25.812  -1.013
  216    HZ1  LYS  24          1HZ       LYS  24  -4.295  26.289  -2.722
  217    HZ2  LYS  24          2HZ       LYS  24  -5.388  26.979  -1.631
  218    HZ3  LYS  24          3HZ       LYS  24  -5.575  25.367  -2.110
  219    H    ASN  25           H        ASN  25  -7.345  22.135   3.681
  220    HA   ASN  25           HA       ASN  25  -8.155  24.868   4.075
  221    HB2  ASN  25          2HB       ASN  25  -9.298  22.250   5.067
  222    HB3  ASN  25          3HB       ASN  25 -10.030  23.821   5.382
  223   HD21  ASN  25          1HD2      ASN  25 -10.138  21.199   3.435
  224   HD22  ASN  25          2HD2      ASN  25 -10.878  21.897   2.039
  225    H    LYS  26           H        LYS  26  -6.069  22.770   5.665
  226    HA   LYS  26           HA       LYS  26  -6.503  23.942   8.303
  227    HB2  LYS  26          2HB       LYS  26  -4.385  21.932   7.556
  228    HB3  LYS  26          3HB       LYS  26  -5.043  22.271   9.151
  229    HG2  LYS  26          2HG       LYS  26  -6.602  21.050   6.884
  230    HG3  LYS  26          3HG       LYS  26  -5.836  20.141   8.188
  231    HD2  LYS  26          2HD       LYS  26  -7.244  21.180   9.825
  232    HD3  LYS  26          3HD       LYS  26  -7.896  22.299   8.626
  233    HE2  LYS  26          2HE       LYS  26  -8.402  19.843   7.507
  234    HE3  LYS  26          3HE       LYS  26  -8.643  19.541   9.227
  235    HZ1  LYS  26          1HZ       LYS  26 -10.068  21.443   7.476
  236    HZ2  LYS  26          2HZ       LYS  26 -10.061  21.645   9.155
  237    HZ3  LYS  26          3HZ       LYS  26 -10.710  20.239   8.475
  238    H    HIS  27           H        HIS  27  -4.258  24.030   5.631
  239    HA   HIS  27           HA       HIS  27  -2.886  26.274   6.916
  240    HB2  HIS  27          2HB       HIS  27  -1.422  24.004   5.554
  241    HB3  HIS  27          3HB       HIS  27  -0.691  25.434   6.278
  242    HD1  HIS  27           HD1      HIS  27  -2.497  22.264   7.236
  243    HD2  HIS  27           HD2      HIS  27  -0.231  25.275   8.986
  244    HE1  HIS  27           HE1      HIS  27  -2.033  21.480   9.580
  245    H    GLY  28           H        GLY  28  -3.264  24.363   3.942
  246    HA2  GLY  28          2HA       GLY  28  -4.006  25.324   1.894
  247    HA3  GLY  28          3HA       GLY  28  -3.409  26.883   2.443
  248    H    TYR  29           H        TYR  29  -1.482  23.998   2.753
  249    HA   TYR  29           HA       TYR  29   0.194  24.907   0.508
  250    HB2  TYR  29          2HB       TYR  29   1.008  24.084   3.285
  251    HB3  TYR  29          3HB       TYR  29   2.132  23.970   1.936
  252    HD1  TYR  29           HD1      TYR  29   3.476  25.791   1.452
  253    HD2  TYR  29           HD2      TYR  29  -0.160  26.426   3.568
  254    HE1  TYR  29           HE1      TYR  29   4.061  28.163   1.734
  255    HE2  TYR  29           HE2      TYR  29   0.414  28.800   3.854
  256    HH   TYR  29           HH       TYR  29   1.917  30.499   2.570
  257    H    TYR  30           H        TYR  30   2.027  22.962   0.359
  258    HA   TYR  30           HA       TYR  30   0.688  20.375   0.398
  259    HB2  TYR  30          2HB       TYR  30   1.984  21.219  -2.172
  260    HB3  TYR  30          3HB       TYR  30   0.796  19.951  -1.891
  261    HD1  TYR  30           HD1      TYR  30  -1.534  20.402  -2.014
  262    HD2  TYR  30           HD2      TYR  30   1.261  23.606  -2.174
  263    HE1  TYR  30           HE1      TYR  30  -3.335  21.931  -2.702
  264    HE2  TYR  30           HE2      TYR  30  -0.532  25.144  -2.860
  265    HH   TYR  30           HH       TYR  30  -2.663  25.264  -3.622
  266    HA   PRO  31           HA       PRO  31   5.392  19.777  -0.538
  267    HB2  PRO  31          2HB       PRO  31   6.911  22.016  -0.759
  268    HB3  PRO  31          3HB       PRO  31   6.099  21.266  -2.138
  269    HG2  PRO  31          2HG       PRO  31   5.259  23.627  -0.500
  270    HG3  PRO  31          3HG       PRO  31   5.207  23.410  -2.259
  271    HD2  PRO  31          2HD       PRO  31   3.020  23.115  -0.690
  272    HD3  PRO  31          3HD       PRO  31   3.263  22.175  -2.176
  273    H    TRP  32           H        TRP  32   7.607  20.757   0.610
  274    HA   TRP  32           HA       TRP  32   6.962  20.629   3.422
  275    HB2  TRP  32          2HB       TRP  32   9.222  20.171   3.787
  276    HB3  TRP  32          3HB       TRP  32   8.938  19.482   2.191
  277    HD1  TRP  32           HD1      TRP  32  10.948  22.133   3.978
  278    HE1  TRP  32           HE1      TRP  32  12.565  23.245   2.312
  279    HE3  TRP  32           HE3      TRP  32   9.126  20.149  -0.367
  280    HZ2  TRP  32           HZ2      TRP  32  13.008  23.277  -0.476
  281    HZ3  TRP  32           HZ3      TRP  32  10.202  20.772  -2.490
  282    HH2  TRP  32           HH2      TRP  32  12.103  22.304  -2.541
  283    H    GLU  33           H        GLU  33   6.858  23.093   1.347
  284    HA   GLU  33           HA       GLU  33   8.271  25.075   2.925
  285    HB2  GLU  33          2HB       GLU  33   6.437  25.587   0.587
  286    HB3  GLU  33          3HB       GLU  33   7.703  26.633   1.213
  287    HG2  GLU  33          2HG       GLU  33   9.406  25.138   0.435
  288    HG3  GLU  33          3HG       GLU  33   8.199  23.947  -0.046
  289    H    ILE  34           H        ILE  34   6.414  23.879   4.504
  290    HA   ILE  34           HA       ILE  34   4.062  25.614   4.559
  291    HB   ILE  34           HB       ILE  34   4.726  23.219   6.275
  292   HG12  ILE  34          2HG1      ILE  34   2.531  23.233   4.257
  293   HG13  ILE  34          3HG1      ILE  34   4.184  23.063   3.674
  294   HG21  ILE  34          1HG2      ILE  34   3.234  24.867   7.351
  295   HG22  ILE  34          2HG2      ILE  34   2.124  24.713   5.990
  296   HG23  ILE  34          3HG2      ILE  34   2.437  23.326   7.033
  297   HD11  ILE  34          1HD1      ILE  34   2.872  20.938   4.122
  298   HD12  ILE  34          2HD1      ILE  34   4.490  21.045   4.815
  299   HD13  ILE  34          3HD1      ILE  34   3.075  21.307   5.834
  300    HA   PRO  35           HA       PRO  35   5.879  28.222   7.635
  301    HB2  PRO  35          2HB       PRO  35   3.605  29.495   8.398
  302    HB3  PRO  35          3HB       PRO  35   4.437  29.843   6.878
  303    HG2  PRO  35          2HG       PRO  35   2.036  28.124   7.374
  304    HG3  PRO  35          3HG       PRO  35   2.328  29.289   6.070
  305    HD2  PRO  35          2HD       PRO  35   2.623  26.619   5.731
  306    HD3  PRO  35          3HD       PRO  35   3.616  27.807   4.864
  307    H    ARG  36           H        ARG  36   4.910  29.032   9.949
  308    HA   ARG  36           HA       ARG  36   3.607  26.945  11.438
  309    HB2  ARG  36          2HB       ARG  36   5.521  26.626  13.017
  310    HB3  ARG  36          3HB       ARG  36   5.792  25.960  11.412
  311    HG2  ARG  36          2HG       ARG  36   6.747  28.636  11.438
  312    HG3  ARG  36          3HG       ARG  36   7.388  27.794  12.851
  313    HD2  ARG  36          2HD       ARG  36   7.741  25.909  10.948
  314    HD3  ARG  36          3HD       ARG  36   7.922  27.375   9.985
  315    HE   ARG  36           HE       ARG  36   9.787  26.330  11.853
  316   HH11  ARG  36          1HH1      ARG  36   8.506  29.310  10.590
  317   HH12  ARG  36          2HH1      ARG  36   9.942  30.221  10.924
  318   HH21  ARG  36          1HH2      ARG  36  11.683  27.518  12.298
  319   HH22  ARG  36          2HH2      ARG  36  11.749  29.200  11.895
  320    H    CYS  37           H        CYS  37   3.398  27.528  13.761
  321    HA   CYS  37           HA       CYS  37   3.125  30.434  14.008
  322    HB2  CYS  37          2HB       CYS  37   1.726  28.087  15.182
  323    HB3  CYS  37          3HB       CYS  37   1.842  29.532  16.180
  324    HG   CYS  37           HG       CYS  37  -0.329  28.871  13.881
  Start of MODEL   12
    1    H    MET   1           H        MET   1   6.835  -1.262   0.410
    2    HA   MET   1           HA       MET   1   4.311  -0.884  -0.817
    3    HB2  MET   1          2HB       MET   1   4.780  -0.858   1.658
    4    HB3  MET   1          3HB       MET   1   5.486   0.738   1.444
    5    HG2  MET   1          2HG       MET   1   3.439   1.709   0.913
    6    HG3  MET   1          3HG       MET   1   2.692   0.155   0.549
    7    HE1  MET   1          1HE       MET   1   1.150  -1.107   2.379
    8    HE2  MET   1          2HE       MET   1   2.789  -1.756   2.450
    9    HE3  MET   1          3HE       MET   1   1.921  -1.387   3.941
   10    H    LYS   2           H        LYS   2   3.367   1.005  -1.652
   11    HA   LYS   2           HA       LYS   2   3.301   2.826  -3.017
   12    HB2  LYS   2          2HB       LYS   2   5.613   3.755  -1.303
   13    HB3  LYS   2          3HB       LYS   2   4.593   4.776  -2.309
   14    HG2  LYS   2          2HG       LYS   2   2.918   3.292  -0.557
   15    HG3  LYS   2          3HG       LYS   2   4.217   4.022   0.389
   16    HD2  LYS   2          2HD       LYS   2   3.614   6.184  -0.218
   17    HD3  LYS   2          3HD       LYS   2   2.722   5.639  -1.641
   18    HE2  LYS   2          2HE       LYS   2   0.841   5.609  -0.464
   19    HE3  LYS   2          3HE       LYS   2   1.549   4.452   0.662
   20    HZ1  LYS   2          1HZ       LYS   2   2.555   6.390   1.827
   21    HZ2  LYS   2          2HZ       LYS   2   0.866   6.343   1.896
   22    HZ3  LYS   2          3HZ       LYS   2   1.639   7.412   0.837
   23    H    PHE   3           H        PHE   3   4.128   1.249  -4.665
   24    HA   PHE   3           HA       PHE   3   6.878   1.372  -5.434
   25    HB2  PHE   3          2HB       PHE   3   4.393   0.181  -6.602
   26    HB3  PHE   3          3HB       PHE   3   5.826   0.334  -7.613
   27    HD1  PHE   3           HD1      PHE   3   5.274  -0.626  -4.048
   28    HD2  PHE   3           HD2      PHE   3   6.880  -1.685  -7.845
   29    HE1  PHE   3           HE1      PHE   3   6.169  -2.707  -3.086
   30    HE2  PHE   3           HE2      PHE   3   7.776  -3.767  -6.889
   31    HZ   PHE   3           HZ       PHE   3   7.420  -4.281  -4.507
   32    H    LYS   4           H        LYS   4   7.393   1.944  -7.807
   33    HA   LYS   4           HA       LYS   4   6.166   4.556  -8.411
   34    HB2  LYS   4          2HB       LYS   4   8.981   3.721  -9.111
   35    HB3  LYS   4          3HB       LYS   4   8.284   5.333  -9.211
   36    HG2  LYS   4          2HG       LYS   4   9.350   5.629  -7.260
   37    HG3  LYS   4          3HG       LYS   4   7.928   4.825  -6.590
   38    HD2  LYS   4          2HD       LYS   4   9.129   2.660  -6.778
   39    HD3  LYS   4          3HD       LYS   4  10.562   3.540  -7.313
   40    HE2  LYS   4          2HE       LYS   4   9.685   4.804  -4.960
   41    HE3  LYS   4          3HE       LYS   4   9.604   3.070  -4.650
   42    HZ1  LYS   4          1HZ       LYS   4  11.945   4.725  -5.318
   43    HZ2  LYS   4          2HZ       LYS   4  11.954   3.074  -5.683
   44    HZ3  LYS   4          3HZ       LYS   4  11.760   3.584  -4.082
   45    H    PHE   5           H        PHE   5   7.278   1.498  -9.670
   46    HA   PHE   5           HA       PHE   5   6.718   2.252 -12.418
   47    HB2  PHE   5          2HB       PHE   5   7.591  -0.384 -11.218
   48    HB3  PHE   5          3HB       PHE   5   7.422  -0.069 -12.941
   49    HD1  PHE   5           HD1      PHE   5   9.679  -0.206 -10.295
   50    HD2  PHE   5           HD2      PHE   5   8.761   2.071 -13.771
   51    HE1  PHE   5           HE1      PHE   5  11.997   0.616 -10.365
   52    HE2  PHE   5           HE2      PHE   5  11.077   2.896 -13.848
   53    HZ   PHE   5           HZ       PHE   5  12.699   2.168 -12.143
   54    H    ASN   6           H        ASN   6   5.280   0.387  -9.826
   55    HA   ASN   6           HA       ASN   6   3.390  -1.096 -11.189
   56    HB2  ASN   6          2HB       ASN   6   3.672  -0.035  -8.457
   57    HB3  ASN   6          3HB       ASN   6   2.012  -0.368  -8.942
   58   HD21  ASN   6          1HD2      ASN   6   5.238  -1.830  -8.989
   59   HD22  ASN   6          2HD2      ASN   6   4.700  -3.441  -8.670
   60    HA   PRO   7           HA       PRO   7   0.391   1.639 -12.853
   61    HB2  PRO   7          2HB       PRO   7  -1.938   0.341 -12.340
   62    HB3  PRO   7          3HB       PRO   7  -0.775  -0.214 -13.551
   63    HG2  PRO   7          2HG       PRO   7  -1.190  -1.171 -10.745
   64    HG3  PRO   7          3HG       PRO   7  -0.913  -2.116 -12.220
   65    HD2  PRO   7          2HD       PRO   7   1.052  -1.600 -10.430
   66    HD3  PRO   7          3HD       PRO   7   1.364  -1.761 -12.171
   67    H    THR   8           H        THR   8  -0.195   0.559  -9.545
   68    HA   THR   8           HA       THR   8  -2.201   2.367  -8.833
   69    HB   THR   8           HB       THR   8  -1.349   0.390  -7.474
   70    HG1  THR   8           HG1      THR   8  -1.834   1.539  -5.478
   71   HG21  THR   8          1HG2      THR   8   0.420   0.804  -5.874
   72   HG22  THR   8          2HG2      THR   8   0.629   2.446  -6.482
   73   HG23  THR   8          3HG2      THR   8   1.036   1.068  -7.505
   74    H    GLY   9           H        GLY   9   1.125   2.894  -9.474
   75    HA2  GLY   9          2HA       GLY   9   1.796   5.038  -7.869
   76    HA3  GLY   9          3HA       GLY   9   2.371   4.824  -9.516
   77    H    THR  10           H        THR  10  -0.072   5.074 -10.877
   78    HA   THR  10           HA       THR  10  -0.304   7.929 -10.928
   79    HB   THR  10           HB       THR  10  -1.937   5.867 -12.421
   80    HG1  THR  10           HG1      THR  10  -0.176   5.628 -13.555
   81   HG21  THR  10          1HG2      THR  10  -2.341   8.614 -12.166
   82   HG22  THR  10          2HG2      THR  10  -3.036   7.552 -13.390
   83   HG23  THR  10          3HG2      THR  10  -1.537   8.418 -13.723
   84    H    ILE  11           H        ILE  11  -2.578   5.282 -10.210
   85    HA   ILE  11           HA       ILE  11  -4.804   6.808  -9.580
   86    HB   ILE  11           HB       ILE  11  -3.947   4.195  -8.333
   87   HG12  ILE  11          2HG1      ILE  11  -6.016   3.698 -10.086
   88   HG13  ILE  11          3HG1      ILE  11  -5.093   4.940 -10.925
   89   HG21  ILE  11          1HG2      ILE  11  -6.327   3.905  -7.793
   90   HG22  ILE  11          2HG2      ILE  11  -5.620   5.291  -6.964
   91   HG23  ILE  11          3HG2      ILE  11  -6.646   5.538  -8.378
   92   HD11  ILE  11          1HD1      ILE  11  -4.324   2.165 -10.203
   93   HD12  ILE  11          2HD1      ILE  11  -4.078   3.056 -11.705
   94   HD13  ILE  11          3HD1      ILE  11  -3.067   3.397 -10.301
   95    H    VAL  12           H        VAL  12  -2.366   5.524  -7.314
   96    HA   VAL  12           HA       VAL  12  -3.334   6.671  -4.986
   97    HB   VAL  12           HB       VAL  12  -0.459   6.154  -5.757
   98   HG11  VAL  12          1HG1      VAL  12  -0.026   6.147  -3.325
   99   HG12  VAL  12          2HG1      VAL  12  -0.531   7.728  -3.924
  100   HG13  VAL  12          3HG1      VAL  12  -1.676   6.707  -3.053
  101   HG21  VAL  12          1HG2      VAL  12  -0.724   4.010  -5.077
  102   HG22  VAL  12          2HG2      VAL  12  -1.912   4.431  -3.843
  103   HG23  VAL  12          3HG2      VAL  12  -2.400   4.317  -5.534
  104    H    LYS  13           H        LYS  13  -1.493   8.110  -7.582
  105    HA   LYS  13           HA       LYS  13  -0.828  10.503  -6.146
  106    HB2  LYS  13          2HB       LYS  13   0.549  10.834  -7.873
  107    HB3  LYS  13          3HB       LYS  13  -0.022   9.311  -8.543
  108    HG2  LYS  13          2HG       LYS  13  -1.771  10.503  -9.765
  109    HG3  LYS  13          3HG       LYS  13  -1.193  12.031  -9.096
  110    HD2  LYS  13          2HD       LYS  13   0.868  10.398 -10.406
  111    HD3  LYS  13          3HD       LYS  13  -0.404  10.988 -11.480
  112    HE2  LYS  13          2HE       LYS  13   0.021  13.267 -10.333
  113    HE3  LYS  13          3HE       LYS  13   1.543  12.544  -9.816
  114    HZ1  LYS  13          1HZ       LYS  13   1.713  11.952 -12.335
  115    HZ2  LYS  13          2HZ       LYS  13   2.152  13.490 -11.787
  116    HZ3  LYS  13          3HZ       LYS  13   0.645  13.251 -12.517
  117    H    LYS  14           H        LYS  14  -3.405   9.466  -8.285
  118    HA   LYS  14           HA       LYS  14  -4.526  12.091  -8.600
  119    HB2  LYS  14          2HB       LYS  14  -5.636   9.344  -9.197
  120    HB3  LYS  14          3HB       LYS  14  -6.454  10.847  -9.600
  121    HG2  LYS  14          2HG       LYS  14  -3.810   9.887 -10.671
  122    HG3  LYS  14          3HG       LYS  14  -5.339   9.998 -11.547
  123    HD2  LYS  14          2HD       LYS  14  -5.316  12.449 -11.188
  124    HD3  LYS  14          3HD       LYS  14  -3.733  12.293 -10.422
  125    HE2  LYS  14          2HE       LYS  14  -2.935  12.661 -12.486
  126    HE3  LYS  14          3HE       LYS  14  -3.336  10.968 -12.765
  127    HZ1  LYS  14          1HZ       LYS  14  -5.019  11.507 -14.118
  128    HZ2  LYS  14          2HZ       LYS  14  -4.240  13.002 -14.254
  129    HZ3  LYS  14          3HZ       LYS  14  -5.523  12.814 -13.169
  130    H    LEU  15           H        LEU  15  -5.427   9.184  -6.759
  131    HA   LEU  15           HA       LEU  15  -7.723  10.181  -5.543
  132    HB2  LEU  15          2HB       LEU  15  -5.732   8.080  -4.826
  133    HB3  LEU  15          3HB       LEU  15  -6.952   8.544  -3.642
  134    HG   LEU  15           HG       LEU  15  -7.417   6.506  -5.119
  135   HD11  LEU  15          1HD1      LEU  15  -9.270   7.066  -3.948
  136   HD12  LEU  15          2HD1      LEU  15  -9.844   7.532  -5.549
  137   HD13  LEU  15          3HD1      LEU  15  -9.213   8.756  -4.447
  138   HD21  LEU  15          1HD2      LEU  15  -8.389   6.969  -7.297
  139   HD22  LEU  15          2HD2      LEU  15  -6.717   7.528  -7.236
  140   HD23  LEU  15          3HD2      LEU  15  -8.040   8.688  -7.106
  141    H    THR  16           H        THR  16  -4.349  10.665  -4.765
  142    HA   THR  16           HA       THR  16  -4.806  11.815  -2.187
  143    HB   THR  16           HB       THR  16  -2.386  11.994  -3.992
  144    HG1  THR  16           HG1      THR  16  -1.607  10.323  -2.673
  145   HG21  THR  16          1HG2      THR  16  -1.560  12.292  -1.370
  146   HG22  THR  16          2HG2      THR  16  -3.027  13.268  -1.455
  147   HG23  THR  16          3HG2      THR  16  -1.696  13.578  -2.569
  148    H    GLN  17           H        GLN  17  -4.688  13.016  -5.455
  149    HA   GLN  17           HA       GLN  17  -4.195  15.714  -5.032
  150    HB2  GLN  17          2HB       GLN  17  -4.633  14.290  -7.224
  151    HB3  GLN  17          3HB       GLN  17  -6.262  14.925  -7.035
  152    HG2  GLN  17          2HG       GLN  17  -5.672  16.978  -7.689
  153    HG3  GLN  17          3HG       GLN  17  -4.159  16.940  -6.785
  154   HE21  GLN  17          1HE2      GLN  17  -2.387  15.704  -7.735
  155   HE22  GLN  17          2HE2      GLN  17  -2.239  15.649  -9.455
  156    H    TYR  18           H        TYR  18  -7.011  13.834  -4.311
  157    HA   TYR  18           HA       TYR  18  -8.630  16.222  -3.848
  158    HB2  TYR  18          2HB       TYR  18  -9.347  13.288  -3.677
  159    HB3  TYR  18          3HB       TYR  18 -10.473  14.620  -3.442
  160    HD1  TYR  18           HD1      TYR  18  -8.165  13.134  -5.955
  161    HD2  TYR  18           HD2      TYR  18 -11.608  15.536  -5.266
  162    HE1  TYR  18           HE1      TYR  18  -8.614  13.171  -8.373
  163    HE2  TYR  18           HE2      TYR  18 -12.068  15.579  -7.682
  164    HH   TYR  18           HH       TYR  18 -10.659  13.502  -9.860
  165    H    GLU  19           H        GLU  19  -6.891  13.741  -2.146
  166    HA   GLU  19           HA       GLU  19  -8.107  14.173   0.401
  167    HB2  GLU  19          2HB       GLU  19  -5.454  12.908  -0.311
  168    HB3  GLU  19          3HB       GLU  19  -6.212  12.846   1.275
  169    HG2  GLU  19          2HG       GLU  19  -7.550  11.789  -1.194
  170    HG3  GLU  19          3HG       GLU  19  -6.474  10.810  -0.199
  171    H    ILE  20           H        ILE  20  -5.264  15.433  -1.249
  172    HA   ILE  20           HA       ILE  20  -3.970  16.699   0.844
  173    HB   ILE  20           HB       ILE  20  -4.249  17.711  -1.989
  174   HG12  ILE  20          2HG1      ILE  20  -1.783  16.354  -1.084
  175   HG13  ILE  20          3HG1      ILE  20  -3.202  15.324  -1.236
  176   HG21  ILE  20          1HG2      ILE  20  -3.085  19.477  -1.316
  177   HG22  ILE  20          2HG2      ILE  20  -2.962  18.823   0.316
  178   HG23  ILE  20          3HG2      ILE  20  -1.755  18.397  -0.898
  179   HD11  ILE  20          1HD1      ILE  20  -1.502  16.441  -3.280
  180   HD12  ILE  20          2HD1      ILE  20  -2.694  15.146  -3.383
  181   HD13  ILE  20          3HD1      ILE  20  -3.200  16.826  -3.561
  182    H    ALA  21           H        ALA  21  -6.852  17.656  -0.896
  183    HA   ALA  21           HA       ALA  21  -7.057  20.330  -0.260
  184    HB1  ALA  21          1HB       ALA  21  -9.103  18.184  -0.651
  185    HB2  ALA  21          2HB       ALA  21  -9.595  19.815  -0.196
  186    HB3  ALA  21          3HB       ALA  21  -8.700  19.550  -1.692
  187    H    TRP  22           H        TRP  22  -8.023  17.539   1.708
  188    HA   TRP  22           HA       TRP  22  -9.223  18.840   3.825
  189    HB2  TRP  22          2HB       TRP  22  -9.226  16.421   3.654
  190    HB3  TRP  22          3HB       TRP  22  -7.479  16.369   3.871
  191    HD1  TRP  22           HD1      TRP  22  -6.544  16.917   6.362
  192    HE1  TRP  22           HE1      TRP  22  -7.660  16.657   8.666
  193    HE3  TRP  22           HE3      TRP  22 -11.419  16.561   4.866
  194    HZ2  TRP  22           HZ2      TRP  22 -10.263  16.342   9.712
  195    HZ3  TRP  22           HZ3      TRP  22 -13.161  16.281   6.580
  196    HH2  TRP  22           HH2      TRP  22 -12.594  16.173   8.953
  197    H    PHE  23           H        PHE  23  -5.775  18.200   3.309
  198    HA   PHE  23           HA       PHE  23  -4.984  19.443   5.768
  199    HB2  PHE  23          2HB       PHE  23  -3.476  17.810   5.037
  200    HB3  PHE  23          3HB       PHE  23  -3.519  18.380   3.372
  201    HD1  PHE  23           HD1      PHE  23  -1.980  19.974   2.592
  202    HD2  PHE  23           HD2      PHE  23  -2.275  19.170   6.761
  203    HE1  PHE  23           HE1      PHE  23   0.067  21.281   2.985
  204    HE2  PHE  23           HE2      PHE  23  -0.229  20.476   7.161
  205    HZ   PHE  23           HZ       PHE  23   0.944  21.535   5.272
  206    H    LYS  24           H        LYS  24  -5.444  20.466   2.473
  207    HA   LYS  24           HA       LYS  24  -3.949  22.842   2.509
  208    HB2  LYS  24          2HB       LYS  24  -4.832  21.855   0.447
  209    HB3  LYS  24          3HB       LYS  24  -6.474  22.199   0.974
  210    HG2  LYS  24          2HG       LYS  24  -6.159  23.983  -0.383
  211    HG3  LYS  24          3HG       LYS  24  -5.512  24.666   1.111
  212    HD2  LYS  24          2HD       LYS  24  -3.246  23.798   0.334
  213    HD3  LYS  24          3HD       LYS  24  -4.005  23.543  -1.239
  214    HE2  LYS  24          2HE       LYS  24  -4.034  26.185   0.204
  215    HE3  LYS  24          3HE       LYS  24  -2.782  25.729  -0.950
  216    HZ1  LYS  24          1HZ       LYS  24  -5.642  26.248  -1.437
  217    HZ2  LYS  24          2HZ       LYS  24  -4.755  25.286  -2.509
  218    HZ3  LYS  24          3HZ       LYS  24  -4.293  26.890  -2.232
  219    H    ASN  25           H        ASN  25  -7.091  22.051   3.789
  220    HA   ASN  25           HA       ASN  25  -7.885  24.786   4.205
  221    HB2  ASN  25          2HB       ASN  25  -9.023  22.160   5.177
  222    HB3  ASN  25          3HB       ASN  25  -9.737  23.725   5.553
  223   HD21  ASN  25          1HD2      ASN  25  -9.998  21.162   3.589
  224   HD22  ASN  25          2HD2      ASN  25 -10.734  21.901   2.211
  225    H    LYS  26           H        LYS  26  -5.785  22.674   5.758
  226    HA   LYS  26           HA       LYS  26  -6.180  23.836   8.406
  227    HB2  LYS  26          2HB       LYS  26  -4.078  21.823   7.623
  228    HB3  LYS  26          3HB       LYS  26  -4.715  22.157   9.228
  229    HG2  LYS  26          2HG       LYS  26  -6.304  20.949   6.974
  230    HG3  LYS  26          3HG       LYS  26  -5.527  20.034   8.268
  231    HD2  LYS  26          2HD       LYS  26  -6.911  21.089   9.923
  232    HD3  LYS  26          3HD       LYS  26  -7.585  22.192   8.721
  233    HE2  LYS  26          2HE       LYS  26  -9.192  20.723   8.293
  234    HE3  LYS  26          3HE       LYS  26  -7.977  19.558   7.769
  235    HZ1  LYS  26          1HZ       LYS  26  -9.462  19.688  10.247
  236    HZ2  LYS  26          2HZ       LYS  26  -7.817  19.343  10.432
  237    HZ3  LYS  26          3HZ       LYS  26  -8.784  18.353   9.459
  238    H    HIS  27           H        HIS  27  -3.971  23.928   5.704
  239    HA   HIS  27           HA       HIS  27  -2.574  26.163   6.979
  240    HB2  HIS  27          2HB       HIS  27  -1.136  23.893   5.590
  241    HB3  HIS  27          3HB       HIS  27  -0.391  25.317   6.308
  242    HD1  HIS  27           HD1      HIS  27  -2.194  22.150   7.279
  243    HD2  HIS  27           HD2      HIS  27   0.105  25.146   9.010
  244    HE1  HIS  27           HE1      HIS  27  -1.701  21.355   9.613
  245    H    GLY  28           H        GLY  28  -2.998  24.264   4.004
  246    HA2  GLY  28          2HA       GLY  28  -3.765  25.236   1.969
  247    HA3  GLY  28          3HA       GLY  28  -3.154  26.790   2.516
  248    H    TYR  29           H        TYR  29  -1.234  23.897   2.790
  249    HA   TYR  29           HA       TYR  29   0.415  24.808   0.525
  250    HB2  TYR  29          2HB       TYR  29   1.263  23.972   3.287
  251    HB3  TYR  29          3HB       TYR  29   2.369  23.859   1.922
  252    HD1  TYR  29           HD1      TYR  29   3.713  25.676   1.427
  253    HD2  TYR  29           HD2      TYR  29   0.108  26.317   3.595
  254    HE1  TYR  29           HE1      TYR  29   4.311  28.045   1.710
  255    HE2  TYR  29           HE2      TYR  29   0.695  28.688   3.882
  256    HH   TYR  29           HH       TYR  29   2.203  30.269   3.511
  257    H    TYR  30           H        TYR  30   2.238  22.857   0.343
  258    HA   TYR  30           HA       TYR  30   0.890  20.275   0.391
  259    HB2  TYR  30          2HB       TYR  30   2.154  21.123  -2.193
  260    HB3  TYR  30          3HB       TYR  30   0.965  19.859  -1.900
  261    HD1  TYR  30           HD1      TYR  30  -1.365  20.320  -1.991
  262    HD2  TYR  30           HD2      TYR  30   1.441  23.513  -2.176
  263    HE1  TYR  30           HE1      TYR  30  -3.168  21.858  -2.648
  264    HE2  TYR  30           HE2      TYR  30  -0.355  25.060  -2.833
  265    HH   TYR  30           HH       TYR  30  -3.200  24.176  -4.020
  266    HA   PRO  31           HA       PRO  31   5.579  19.662  -0.610
  267    HB2  PRO  31          2HB       PRO  31   7.103  21.896  -0.844
  268    HB3  PRO  31          3HB       PRO  31   6.270  21.154  -2.215
  269    HG2  PRO  31          2HG       PRO  31   5.461  23.512  -0.557
  270    HG3  PRO  31          3HG       PRO  31   5.384  23.302  -2.316
  271    HD2  PRO  31          2HD       PRO  31   3.218  23.010  -0.718
  272    HD3  PRO  31          3HD       PRO  31   3.436  22.074  -2.211
  273    H    TRP  32           H        TRP  32   7.812  20.629   0.511
  274    HA   TRP  32           HA       TRP  32   7.205  20.494   3.331
  275    HB2  TRP  32          2HB       TRP  32   9.468  20.026   3.663
  276    HB3  TRP  32          3HB       TRP  32   9.159  19.342   2.070
  277    HD1  TRP  32           HD1      TRP  32  11.205  21.980   3.836
  278    HE1  TRP  32           HE1      TRP  32  12.802  23.090   2.151
  279    HE3  TRP  32           HE3      TRP  32   9.315  20.016  -0.489
  280    HZ2  TRP  32           HZ2      TRP  32  13.207  23.129  -0.642
  281    HZ3  TRP  32           HZ3      TRP  32  10.364  20.641  -2.625
  282    HH2  TRP  32           HH2      TRP  32  12.269  22.166  -2.698
  283    H    GLU  33           H        GLU  33   7.083  22.965   1.266
  284    HA   GLU  33           HA       GLU  33   8.525  24.936   2.831
  285    HB2  GLU  33          2HB       GLU  33   6.661  25.463   0.520
  286    HB3  GLU  33          3HB       GLU  33   7.940  26.503   1.133
  287    HG2  GLU  33          2HG       GLU  33   9.626  25.003   0.326
  288    HG3  GLU  33          3HG       GLU  33   8.407  23.819  -0.143
  289    H    ILE  34           H        ILE  34   6.686  23.742   4.431
  290    HA   ILE  34           HA       ILE  34   4.341  25.486   4.525
  291    HB   ILE  34           HB       ILE  34   5.019  23.082   6.224
  292   HG12  ILE  34          2HG1      ILE  34   2.797  23.112   4.236
  293   HG13  ILE  34          3HG1      ILE  34   4.440  22.938   3.629
  294   HG21  ILE  34          1HG2      ILE  34   2.741  23.195   7.013
  295   HG22  ILE  34          2HG2      ILE  34   3.549  24.731   7.326
  296   HG23  ILE  34          3HG2      ILE  34   2.419  24.587   5.980
  297   HD11  ILE  34          1HD1      ILE  34   4.715  20.878   4.580
  298   HD12  ILE  34          2HD1      ILE  34   3.532  21.184   5.852
  299   HD13  ILE  34          3HD1      ILE  34   2.992  20.846   4.208
  300    HA   PRO  35           HA       PRO  35   6.210  28.076   7.585
  301    HB2  PRO  35          2HB       PRO  35   3.952  29.355   8.384
  302    HB3  PRO  35          3HB       PRO  35   4.764  29.705   6.853
  303    HG2  PRO  35          2HG       PRO  35   2.364  27.994   7.377
  304    HG3  PRO  35          3HG       PRO  35   2.642  29.162   6.072
  305    HD2  PRO  35          2HD       PRO  35   2.922  26.492   5.721
  306    HD3  PRO  35          3HD       PRO  35   3.908  27.679   4.843
  307    H    ARG  36           H        ARG  36   5.282  28.880   9.915
  308    HA   ARG  36           HA       ARG  36   5.406  26.560  11.555
  309    HB2  ARG  36          2HB       ARG  36   4.679  29.377  12.375
  310    HB3  ARG  36          3HB       ARG  36   5.258  28.091  13.425
  311    HG2  ARG  36          2HG       ARG  36   7.249  29.068  13.149
  312    HG3  ARG  36          3HG       ARG  36   7.262  28.220  11.602
  313    HD2  ARG  36          2HD       ARG  36   7.525  30.231  10.669
  314    HD3  ARG  36          3HD       ARG  36   5.826  30.502  11.053
  315    HE   ARG  36           HE       ARG  36   7.185  31.214  13.321
  316   HH11  ARG  36          1HH1      ARG  36   7.260  32.169   9.974
  317   HH12  ARG  36          2HH1      ARG  36   7.759  33.793  10.313
  318   HH21  ARG  36          1HH2      ARG  36   7.841  33.349  13.781
  319   HH22  ARG  36          2HH2      ARG  36   8.090  34.463  12.479
  320    H    CYS  37           H        CYS  37   3.829  26.006  13.234
  321    HA   CYS  37           HA       CYS  37   1.267  25.557  12.150
  322    HB2  CYS  37          2HB       CYS  37   2.225  25.340  15.012
  323    HB3  CYS  37          3HB       CYS  37   0.697  24.706  14.412
  324    HG   CYS  37           HG       CYS  37   1.755  22.735  12.859
  Start of MODEL   13
    1    H    MET   1           H        MET   1   5.482  -2.125  -0.834
    2    HA   MET   1           HA       MET   1   4.214  -0.239  -0.124
    3    HB2  MET   1          2HB       MET   1   7.102   0.324   0.572
    4    HB3  MET   1          3HB       MET   1   5.694   0.945   1.422
    5    HG2  MET   1          2HG       MET   1   5.255  -1.745   1.492
    6    HG3  MET   1          3HG       MET   1   7.011  -1.652   1.607
    7    HE1  MET   1          1HE       MET   1   7.652   0.804   4.238
    8    HE2  MET   1          2HE       MET   1   8.038  -0.871   4.630
    9    HE3  MET   1          3HE       MET   1   8.233  -0.284   2.978
   10    H    LYS   2           H        LYS   2   3.385   1.005  -1.758
   11    HA   LYS   2           HA       LYS   2   3.122   2.808  -3.119
   12    HB2  LYS   2          2HB       LYS   2   5.445   3.983  -1.585
   13    HB3  LYS   2          3HB       LYS   2   4.235   4.867  -2.505
   14    HG2  LYS   2          2HG       LYS   2   2.613   3.601  -0.814
   15    HG3  LYS   2          3HG       LYS   2   4.066   3.656   0.186
   16    HD2  LYS   2          2HD       LYS   2   4.075   5.962   0.278
   17    HD3  LYS   2          3HD       LYS   2   3.156   6.129  -1.220
   18    HE2  LYS   2          2HE       LYS   2   1.485   4.740   0.543
   19    HE3  LYS   2          3HE       LYS   2   2.223   6.021   1.503
   20    HZ1  LYS   2          1HZ       LYS   2   0.870   7.476   0.560
   21    HZ2  LYS   2          2HZ       LYS   2   0.131   6.239  -0.325
   22    HZ3  LYS   2          3HZ       LYS   2   1.446   7.077  -0.980
   23    H    PHE   3           H        PHE   3   4.201   1.002  -4.556
   24    HA   PHE   3           HA       PHE   3   6.816   1.271  -5.485
   25    HB2  PHE   3          2HB       PHE   3   4.304   0.126  -6.640
   26    HB3  PHE   3          3HB       PHE   3   5.727   0.279  -7.665
   27    HD1  PHE   3           HD1      PHE   3   6.811  -1.718  -7.926
   28    HD2  PHE   3           HD2      PHE   3   5.147  -0.764  -4.126
   29    HE1  PHE   3           HE1      PHE   3   7.693  -3.826  -7.014
   30    HE2  PHE   3           HE2      PHE   3   6.028  -2.869  -3.208
   31    HZ   PHE   3           HZ       PHE   3   7.303  -4.403  -4.651
   32    H    LYS   4           H        LYS   4   7.366   1.920  -7.797
   33    HA   LYS   4           HA       LYS   4   6.123   4.529  -8.374
   34    HB2  LYS   4          2HB       LYS   4   8.948   3.709  -9.054
   35    HB3  LYS   4          3HB       LYS   4   8.248   5.319  -9.160
   36    HG2  LYS   4          2HG       LYS   4   9.272   5.621  -7.191
   37    HG3  LYS   4          3HG       LYS   4   7.858   4.787  -6.542
   38    HD2  LYS   4          2HD       LYS   4   9.123   2.638  -6.789
   39    HD3  LYS   4          3HD       LYS   4  10.547   3.594  -7.207
   40    HE2  LYS   4          2HE       LYS   4   9.606   4.771  -4.884
   41    HE3  LYS   4          3HE       LYS   4   9.366   3.046  -4.611
   42    HZ1  LYS   4          1HZ       LYS   4  11.937   4.024  -5.659
   43    HZ2  LYS   4          2HZ       LYS   4  11.608   2.619  -4.776
   44    HZ3  LYS   4          3HZ       LYS   4  11.613   4.123  -4.002
   45    H    PHE   5           H        PHE   5   7.183   1.478  -9.659
   46    HA   PHE   5           HA       PHE   5   6.673   2.283 -12.406
   47    HB2  PHE   5          2HB       PHE   5   7.535  -0.363 -11.222
   48    HB3  PHE   5          3HB       PHE   5   7.344  -0.056 -12.945
   49    HD1  PHE   5           HD1      PHE   5   9.706  -0.415 -10.523
   50    HD2  PHE   5           HD2      PHE   5   8.607   2.305 -13.607
   51    HE1  PHE   5           HE1      PHE   5  12.026   0.399 -10.627
   52    HE2  PHE   5           HE2      PHE   5  10.924   3.123 -13.716
   53    HZ   PHE   5           HZ       PHE   5  12.638   2.170 -12.226
   54    H    ASN   6           H        ASN   6   5.198   0.393  -9.854
   55    HA   ASN   6           HA       ASN   6   3.309  -1.057 -11.249
   56    HB2  ASN   6          2HB       ASN   6   3.574  -0.028  -8.505
   57    HB3  ASN   6          3HB       ASN   6   1.914  -0.331  -9.010
   58   HD21  ASN   6          1HD2      ASN   6   1.253  -2.233  -8.353
   59   HD22  ASN   6          2HD2      ASN   6   2.187  -3.686  -8.322
   60    HA   PRO   7           HA       PRO   7   0.351   1.718 -12.922
   61    HB2  PRO   7          2HB       PRO   7  -1.994   0.435 -12.446
   62    HB3  PRO   7          3HB       PRO   7  -0.823  -0.119 -13.649
   63    HG2  PRO   7          2HG       PRO   7  -1.277  -1.098 -10.857
   64    HG3  PRO   7          3HG       PRO   7  -0.991  -2.031 -12.337
   65    HD2  PRO   7          2HD       PRO   7   0.958  -1.548 -10.521
   66    HD3  PRO   7          3HD       PRO   7   1.288  -1.696 -12.259
   67    H    THR   8           H        THR   8  -0.278   0.615  -9.629
   68    HA   THR   8           HA       THR   8  -2.277   2.432  -8.923
   69    HB   THR   8           HB       THR   8  -1.453   0.437  -7.572
   70    HG1  THR   8           HG1      THR   8  -2.823   1.449  -6.311
   71   HG21  THR   8          1HG2      THR   8   0.528   2.471  -6.543
   72   HG22  THR   8          2HG2      THR   8   0.936   1.098  -7.573
   73   HG23  THR   8          3HG2      THR   8   0.301   0.826  -5.951
   74    H    GLY   9           H        GLY   9   1.059   2.939  -9.527
   75    HA2  GLY   9          2HA       GLY   9   1.729   5.065  -7.897
   76    HA3  GLY   9          3HA       GLY   9   2.319   4.860  -9.540
   77    H    THR  10           H        THR  10  -0.109   5.140 -10.922
   78    HA   THR  10           HA       THR  10  -0.319   7.997 -10.952
   79    HB   THR  10           HB       THR  10  -1.953   5.960 -12.478
   80    HG1  THR  10           HG1      THR  10   0.024   5.671 -13.284
   81   HG21  THR  10          1HG2      THR  10  -2.339   8.707 -12.204
   82   HG22  THR  10          2HG2      THR  10  -3.029   7.661 -13.445
   83   HG23  THR  10          3HG2      THR  10  -1.520   8.520 -13.754
   84    H    ILE  11           H        ILE  11  -2.620   5.361 -10.280
   85    HA   ILE  11           HA       ILE  11  -4.841   6.898  -9.658
   86    HB   ILE  11           HB       ILE  11  -4.016   4.267  -8.426
   87   HG12  ILE  11          2HG1      ILE  11  -6.070   3.800 -10.204
   88   HG13  ILE  11          3HG1      ILE  11  -5.129   5.043 -11.023
   89   HG21  ILE  11          1HG2      ILE  11  -5.696   5.364  -7.065
   90   HG22  ILE  11          2HG2      ILE  11  -6.703   5.632  -8.487
   91   HG23  ILE  11          3HG2      ILE  11  -6.405   3.991  -7.914
   92   HD11  ILE  11          1HD1      ILE  11  -4.388   2.256 -10.316
   93   HD12  ILE  11          2HD1      ILE  11  -4.120   3.157 -11.808
   94   HD13  ILE  11          3HD1      ILE  11  -3.121   3.480 -10.391
   95    H    VAL  12           H        VAL  12  -2.434   5.576  -7.380
   96    HA   VAL  12           HA       VAL  12  -3.418   6.709  -5.052
   97    HB   VAL  12           HB       VAL  12  -0.539   6.179  -5.798
   98   HG11  VAL  12          1HG1      VAL  12  -0.130   6.147  -3.363
   99   HG12  VAL  12          2HG1      VAL  12  -0.619   7.738  -3.951
  100   HG13  VAL  12          3HG1      VAL  12  -1.779   6.716  -3.102
  101   HG21  VAL  12          1HG2      VAL  12  -2.121   4.469  -3.950
  102   HG22  VAL  12          2HG2      VAL  12  -2.419   4.328  -5.682
  103   HG23  VAL  12          3HG2      VAL  12  -0.803   4.037  -5.039
  104    H    LYS  13           H        LYS  13  -1.541   8.158  -7.616
  105    HA   LYS  13           HA       LYS  13  -0.876  10.534  -6.152
  106    HB2  LYS  13          2HB       LYS  13   0.521  10.871  -7.862
  107    HB3  LYS  13          3HB       LYS  13  -0.052   9.358  -8.551
  108    HG2  LYS  13          2HG       LYS  13  -1.781  10.572  -9.780
  109    HG3  LYS  13          3HG       LYS  13  -1.200  12.090  -9.092
  110    HD2  LYS  13          2HD       LYS  13   0.702  10.312 -10.557
  111    HD3  LYS  13          3HD       LYS  13  -0.414  11.331 -11.469
  112    HE2  LYS  13          2HE       LYS  13   1.097  12.956 -11.247
  113    HE3  LYS  13          3HE       LYS  13   0.610  13.038  -9.555
  114    HZ1  LYS  13          1HZ       LYS  13   2.432  11.849  -8.877
  115    HZ2  LYS  13          2HZ       LYS  13   3.091  12.708 -10.177
  116    HZ3  LYS  13          3HZ       LYS  13   2.650  11.087 -10.372
  117    H    LYS  14           H        LYS  14  -3.436   9.533  -8.327
  118    HA   LYS  14           HA       LYS  14  -4.537  12.168  -8.631
  119    HB2  LYS  14          2HB       LYS  14  -5.659   9.433  -9.261
  120    HB3  LYS  14          3HB       LYS  14  -6.463  10.945  -9.660
  121    HG2  LYS  14          2HG       LYS  14  -3.816   9.977 -10.713
  122    HG3  LYS  14          3HG       LYS  14  -5.335  10.106 -11.603
  123    HD2  LYS  14          2HD       LYS  14  -5.299  12.553 -11.222
  124    HD3  LYS  14          3HD       LYS  14  -3.725  12.380 -10.443
  125    HE2  LYS  14          2HE       LYS  14  -3.320  13.043 -12.688
  126    HE3  LYS  14          3HE       LYS  14  -2.900  11.335 -12.573
  127    HZ1  LYS  14          1HZ       LYS  14  -4.842  12.597 -14.219
  128    HZ2  LYS  14          2HZ       LYS  14  -5.558  11.390 -13.275
  129    HZ3  LYS  14          3HZ       LYS  14  -4.253  11.012 -14.283
  130    H    LEU  15           H        LEU  15  -5.475   9.252  -6.822
  131    HA   LEU  15           HA       LEU  15  -7.776  10.255  -5.621
  132    HB2  LEU  15          2HB       LEU  15  -5.806   8.136  -4.901
  133    HB3  LEU  15          3HB       LEU  15  -7.035   8.598  -3.725
  134    HG   LEU  15           HG       LEU  15  -7.498   6.575  -5.222
  135   HD11  LEU  15          1HD1      LEU  15  -9.915   7.565  -5.650
  136   HD12  LEU  15          2HD1      LEU  15  -9.304   8.845  -4.601
  137   HD13  LEU  15          3HD1      LEU  15  -9.338   7.177  -4.029
  138   HD21  LEU  15          1HD2      LEU  15  -8.089   8.776  -7.198
  139   HD22  LEU  15          2HD2      LEU  15  -8.447   7.062  -7.406
  140   HD23  LEU  15          3HD2      LEU  15  -6.772   7.610  -7.325
  141    H    THR  16           H        THR  16  -4.408  10.712  -4.806
  142    HA   THR  16           HA       THR  16  -4.883  11.844  -2.223
  143    HB   THR  16           HB       THR  16  -2.445  12.028  -4.005
  144    HG1  THR  16           HG1      THR  16  -3.113  10.314  -1.826
  145   HG21  THR  16          1HG2      THR  16  -1.716  13.562  -2.554
  146   HG22  THR  16          2HG2      THR  16  -1.687  12.285  -1.338
  147   HG23  THR  16          3HG2      THR  16  -3.107  13.318  -1.499
  148    H    GLN  17           H        GLN  17  -4.730  13.071  -5.480
  149    HA   GLN  17           HA       GLN  17  -4.227  15.763  -5.031
  150    HB2  GLN  17          2HB       GLN  17  -4.866  14.231  -7.216
  151    HB3  GLN  17          3HB       GLN  17  -6.289  15.252  -7.055
  152    HG2  GLN  17          2HG       GLN  17  -5.222  17.026  -7.850
  153    HG3  GLN  17          3HG       GLN  17  -3.843  16.770  -6.781
  154   HE21  GLN  17          1HE2      GLN  17  -2.086  16.813  -7.988
  155   HE22  GLN  17          2HE2      GLN  17  -1.851  15.957  -9.469
  156    H    TYR  18           H        TYR  18  -7.057  13.891  -4.349
  157    HA   TYR  18           HA       TYR  18  -8.670  16.284  -3.881
  158    HB2  TYR  18          2HB       TYR  18  -9.401  13.352  -3.739
  159    HB3  TYR  18          3HB       TYR  18 -10.523  14.687  -3.501
  160    HD1  TYR  18           HD1      TYR  18  -8.200  13.213  -6.009
  161    HD2  TYR  18           HD2      TYR  18 -11.642  15.619  -5.327
  162    HE1  TYR  18           HE1      TYR  18  -8.631  13.272  -8.430
  163    HE2  TYR  18           HE2      TYR  18 -12.083  15.684  -7.746
  164    HH   TYR  18           HH       TYR  18 -10.677  15.431  -9.880
  165    H    GLU  19           H        GLU  19  -6.957  13.782  -2.183
  166    HA   GLU  19           HA       GLU  19  -8.192  14.201   0.357
  167    HB2  GLU  19          2HB       GLU  19  -5.542  12.927  -0.346
  168    HB3  GLU  19          3HB       GLU  19  -6.306  12.862   1.236
  169    HG2  GLU  19          2HG       GLU  19  -7.617  11.812  -1.253
  170    HG3  GLU  19          3HG       GLU  19  -6.581  10.829  -0.220
  171    H    ILE  20           H        ILE  20  -5.330  15.460  -1.260
  172    HA   ILE  20           HA       ILE  20  -4.047  16.704   0.852
  173    HB   ILE  20           HB       ILE  20  -4.298  17.738  -1.975
  174   HG12  ILE  20          2HG1      ILE  20  -1.846  16.362  -1.061
  175   HG13  ILE  20          3HG1      ILE  20  -3.269  15.340  -1.231
  176   HG21  ILE  20          1HG2      ILE  20  -3.129  19.493  -1.280
  177   HG22  ILE  20          2HG2      ILE  20  -3.024  18.826   0.348
  178   HG23  ILE  20          3HG2      ILE  20  -1.809  18.403  -0.858
  179   HD11  ILE  20          1HD1      ILE  20  -1.567  16.525  -3.261
  180   HD12  ILE  20          2HD1      ILE  20  -2.682  15.162  -3.365
  181   HD13  ILE  20          3HD1      ILE  20  -3.284  16.810  -3.549
  182    H    ALA  21           H        ALA  21  -6.910  17.687  -0.903
  183    HA   ALA  21           HA       ALA  21  -7.107  20.358  -0.251
  184    HB1  ALA  21          1HB       ALA  21  -9.020  20.108  -1.342
  185    HB2  ALA  21          2HB       ALA  21  -8.836  18.355  -1.260
  186    HB3  ALA  21          3HB       ALA  21  -9.696  19.213   0.019
  187    H    TRP  22           H        TRP  22  -8.101  17.557   1.691
  188    HA   TRP  22           HA       TRP  22  -9.312  18.849   3.808
  189    HB2  TRP  22          2HB       TRP  22  -9.325  16.432   3.621
  190    HB3  TRP  22          3HB       TRP  22  -7.579  16.371   3.848
  191    HD1  TRP  22           HD1      TRP  22  -6.661  16.938   6.352
  192    HE1  TRP  22           HE1      TRP  22  -7.792  16.651   8.646
  193    HE3  TRP  22           HE3      TRP  22 -11.519  16.517   4.816
  194    HZ2  TRP  22           HZ2      TRP  22 -10.398  16.293   9.669
  195    HZ3  TRP  22           HZ3      TRP  22 -13.270  16.204   6.515
  196    HH2  TRP  22           HH2      TRP  22 -12.719  16.094   8.891
  197    H    PHE  23           H        PHE  23  -5.862  18.198   3.313
  198    HA   PHE  23           HA       PHE  23  -5.085  19.422   5.787
  199    HB2  PHE  23          2HB       PHE  23  -3.579  17.787   5.056
  200    HB3  PHE  23          3HB       PHE  23  -3.606  18.369   3.395
  201    HD1  PHE  23           HD1      PHE  23  -2.055  19.963   2.639
  202    HD2  PHE  23           HD2      PHE  23  -2.386  19.127   6.800
  203    HE1  PHE  23           HE1      PHE  23  -0.005  21.258   3.059
  204    HE2  PHE  23           HE2      PHE  23  -0.337  20.422   7.226
  205    HZ   PHE  23           HZ       PHE  23   0.855  21.490   5.355
  206    H    LYS  24           H        LYS  24  -5.515  20.469   2.495
  207    HA   LYS  24           HA       LYS  24  -4.011  22.838   2.558
  208    HB2  LYS  24          2HB       LYS  24  -4.881  21.869   0.483
  209    HB3  LYS  24          3HB       LYS  24  -6.526  22.215   0.999
  210    HG2  LYS  24          2HG       LYS  24  -6.194  24.007  -0.343
  211    HG3  LYS  24          3HG       LYS  24  -5.556  24.677   1.160
  212    HD2  LYS  24          2HD       LYS  24  -3.287  23.805   0.395
  213    HD3  LYS  24          3HD       LYS  24  -4.035  23.564  -1.185
  214    HE2  LYS  24          2HE       LYS  24  -4.066  26.197   0.276
  215    HE3  LYS  24          3HE       LYS  24  -2.805  25.744  -0.869
  216    HZ1  LYS  24          1HZ       LYS  24  -5.705  25.965  -1.471
  217    HZ2  LYS  24          2HZ       LYS  24  -4.513  25.489  -2.573
  218    HZ3  LYS  24          3HZ       LYS  24  -4.505  27.060  -1.945
  219    H    ASN  25           H        ASN  25  -7.167  22.052   3.808
  220    HA   ASN  25           HA       ASN  25  -7.952  24.787   4.236
  221    HB2  ASN  25          2HB       ASN  25  -9.108  22.154   5.161
  222    HB3  ASN  25          3HB       ASN  25  -9.812  23.713   5.577
  223   HD21  ASN  25          1HD2      ASN  25  -9.749  21.221   3.353
  224   HD22  ASN  25          2HD2      ASN  25 -10.613  21.991   2.071
  225    H    LYS  26           H        LYS  26  -5.875  22.655   5.791
  226    HA   LYS  26           HA       LYS  26  -6.285  23.802   8.444
  227    HB2  LYS  26          2HB       LYS  26  -4.187  21.784   7.664
  228    HB3  LYS  26          3HB       LYS  26  -4.833  22.111   9.266
  229    HG2  LYS  26          2HG       LYS  26  -6.415  20.927   6.995
  230    HG3  LYS  26          3HG       LYS  26  -5.648  19.998   8.285
  231    HD2  LYS  26          2HD       LYS  26  -7.088  20.857   9.916
  232    HD3  LYS  26          3HD       LYS  26  -7.581  22.211   8.897
  233    HE2  LYS  26          2HE       LYS  26  -8.957  20.866   7.575
  234    HE3  LYS  26          3HE       LYS  26  -8.168  19.380   8.102
  235    HZ1  LYS  26          1HZ       LYS  26 -10.026  19.269   9.363
  236    HZ2  LYS  26          2HZ       LYS  26 -10.251  20.944   9.414
  237    HZ3  LYS  26          3HZ       LYS  26  -9.099  20.215  10.416
  238    H    HIS  27           H        HIS  27  -4.054  23.901   5.761
  239    HA   HIS  27           HA       HIS  27  -2.657  26.121   7.062
  240    HB2  HIS  27          2HB       HIS  27  -1.218  23.854   5.669
  241    HB3  HIS  27          3HB       HIS  27  -0.472  25.270   6.403
  242    HD1  HIS  27           HD1      HIS  27  -2.298  22.104   7.337
  243    HD2  HIS  27           HD2      HIS  27  -0.000  25.079   9.108
  244    HE1  HIS  27           HE1      HIS  27  -1.828  21.292   9.671
  245    H    GLY  28           H        GLY  28  -3.065  24.243   4.070
  246    HA2  GLY  28          2HA       GLY  28  -3.811  25.232   2.036
  247    HA3  GLY  28          3HA       GLY  28  -3.198  26.780   2.598
  248    H    TYR  29           H        TYR  29  -1.293  23.876   2.868
  249    HA   TYR  29           HA       TYR  29   0.378  24.795   0.623
  250    HB2  TYR  29          2HB       TYR  29   1.200  23.937   3.387
  251    HB3  TYR  29          3HB       TYR  29   2.317  23.828   2.031
  252    HD1  TYR  29           HD1      TYR  29   0.051  26.285   3.700
  253    HD2  TYR  29           HD2      TYR  29   3.671  25.644   1.558
  254    HE1  TYR  29           HE1      TYR  29   0.647  28.652   4.009
  255    HE2  TYR  29           HE2      TYR  29   4.277  28.008   1.862
  256    HH   TYR  29           HH       TYR  29   3.761  29.862   3.366
  257    H    TYR  30           H        TYR  30   2.195  22.837   0.444
  258    HA   TYR  30           HA       TYR  30   0.835  20.261   0.464
  259    HB2  TYR  30          2HB       TYR  30   2.124  21.120  -2.104
  260    HB3  TYR  30          3HB       TYR  30   0.927  19.859  -1.829
  261    HD1  TYR  30           HD1      TYR  30   1.422  23.513  -2.078
  262    HD2  TYR  30           HD2      TYR  30  -1.401  20.333  -1.931
  263    HE1  TYR  30           HE1      TYR  30  -0.361  25.073  -2.740
  264    HE2  TYR  30           HE2      TYR  30  -3.191  21.884  -2.594
  265    HH   TYR  30           HH       TYR  30  -2.703  24.783  -3.956
  266    HA   PRO  31           HA       PRO  31   5.529  19.634  -0.503
  267    HB2  PRO  31          2HB       PRO  31   7.065  21.863  -0.710
  268    HB3  PRO  31          3HB       PRO  31   6.239  21.133  -2.092
  269    HG2  PRO  31          2HG       PRO  31   5.427  23.484  -0.426
  270    HG3  PRO  31          3HG       PRO  31   5.364  23.285  -2.187
  271    HD2  PRO  31          2HD       PRO  31   3.183  22.993  -0.609
  272    HD3  PRO  31          3HD       PRO  31   3.410  22.066  -2.105
  273    H    TRP  32           H        TRP  32   7.758  20.585   0.642
  274    HA   TRP  32           HA       TRP  32   7.128  20.433   3.456
  275    HB2  TRP  32          2HB       TRP  32   9.385  19.954   3.804
  276    HB3  TRP  32          3HB       TRP  32   9.087  19.283   2.202
  277    HD1  TRP  32           HD1      TRP  32  11.128  21.899   4.005
  278    HE1  TRP  32           HE1      TRP  32  12.744  23.015   2.342
  279    HE3  TRP  32           HE3      TRP  32   9.267  19.974  -0.350
  280    HZ2  TRP  32           HZ2      TRP  32  13.173  23.072  -0.448
  281    HZ3  TRP  32           HZ3      TRP  32  10.337  20.610  -2.472
  282    HH2  TRP  32           HH2      TRP  32  12.249  22.127  -2.518
  283    H    GLU  33           H        GLU  33   7.032  22.918   1.406
  284    HA   GLU  33           HA       GLU  33   8.470  24.873   2.996
  285    HB2  GLU  33          2HB       GLU  33   6.626  25.424   0.674
  286    HB3  GLU  33          3HB       GLU  33   7.905  26.454   1.303
  287    HG2  GLU  33          2HG       GLU  33   9.591  24.952   0.500
  288    HG3  GLU  33          3HG       GLU  33   8.371  23.776   0.014
  289    H    ILE  34           H        ILE  34   6.612  23.677   4.573
  290    HA   ILE  34           HA       ILE  34   4.274  25.430   4.659
  291    HB   ILE  34           HB       ILE  34   4.928  23.012   6.347
  292   HG12  ILE  34          2HG1      ILE  34   2.722  23.064   4.342
  293   HG13  ILE  34          3HG1      ILE  34   4.369  22.888   3.747
  294   HG21  ILE  34          1HG2      ILE  34   2.643  23.130   7.118
  295   HG22  ILE  34          2HG2      ILE  34   3.455  24.659   7.449
  296   HG23  ILE  34          3HG2      ILE  34   2.336  24.530   6.092
  297   HD11  ILE  34          1HD1      ILE  34   4.664  20.916   5.149
  298   HD12  ILE  34          2HD1      ILE  34   3.012  21.092   5.743
  299   HD13  ILE  34          3HD1      ILE  34   3.304  20.731   4.042
  300    HA   PRO  35           HA       PRO  35   6.128  27.991   7.752
  301    HB2  PRO  35          2HB       PRO  35   3.870  29.275   8.541
  302    HB3  PRO  35          3HB       PRO  35   4.696  29.631   7.019
  303    HG2  PRO  35          2HG       PRO  35   2.284  27.927   7.512
  304    HG3  PRO  35          3HG       PRO  35   2.578  29.103   6.217
  305    HD2  PRO  35          2HD       PRO  35   2.849  26.434   5.850
  306    HD3  PRO  35          3HD       PRO  35   3.848  27.623   4.989
  307    H    ARG  36           H        ARG  36   5.177  28.786  10.079
  308    HA   ARG  36           HA       ARG  36   4.543  26.299  11.527
  309    HB2  ARG  36          2HB       ARG  36   5.718  27.344  13.464
  310    HB3  ARG  36          3HB       ARG  36   6.762  27.030  12.085
  311    HG2  ARG  36          2HG       ARG  36   5.519  29.714  12.282
  312    HG3  ARG  36          3HG       ARG  36   6.817  29.319  13.410
  313    HD2  ARG  36          2HD       ARG  36   8.304  29.748  11.820
  314    HD3  ARG  36          3HD       ARG  36   7.633  28.433  10.856
  315    HE   ARG  36           HE       ARG  36   6.066  30.770  10.567
  316   HH11  ARG  36          1HH1      ARG  36   9.113  29.378   9.619
  317   HH12  ARG  36          2HH1      ARG  36   9.215  30.282   8.144
  318   HH21  ARG  36          1HH2      ARG  36   6.189  31.965   8.628
  319   HH22  ARG  36          2HH2      ARG  36   7.552  31.753   7.582
  320    H    CYS  37           H        CYS  37   3.515  26.742  13.720
  321    HA   CYS  37           HA       CYS  37   1.249  28.522  13.282
  322    HB2  CYS  37          2HB       CYS  37   1.766  26.105  14.901
  323    HB3  CYS  37          3HB       CYS  37   0.707  27.297  15.643
  324    HG   CYS  37           HG       CYS  37  -1.188  27.267  13.629
  Start of MODEL   14
    1    H    MET   1           H        MET   1   5.973  -2.464  -0.376
    2    HA   MET   1           HA       MET   1   4.065  -0.889  -0.594
    3    HB2  MET   1          2HB       MET   1   5.942  -1.000   1.509
    4    HB3  MET   1          3HB       MET   1   5.572   0.703   1.268
    5    HG2  MET   1          2HG       MET   1   3.127   0.024   1.351
    6    HG3  MET   1          3HG       MET   1   3.694  -1.531   1.953
    7    HE1  MET   1          1HE       MET   1   2.105   0.576   4.931
    8    HE2  MET   1          2HE       MET   1   1.649   0.002   3.326
    9    HE3  MET   1          3HE       MET   1   2.290  -1.129   4.519
   10    H    LYS   2           H        LYS   2   3.383   0.857  -1.653
   11    HA   LYS   2           HA       LYS   2   3.390   2.736  -2.936
   12    HB2  LYS   2          2HB       LYS   2   5.559   3.389  -0.949
   13    HB3  LYS   2          3HB       LYS   2   5.043   4.536  -2.178
   14    HG2  LYS   2          2HG       LYS   2   2.825   3.396  -0.675
   15    HG3  LYS   2          3HG       LYS   2   3.976   4.278   0.332
   16    HD2  LYS   2          2HD       LYS   2   3.800   6.115  -1.473
   17    HD3  LYS   2          3HD       LYS   2   2.333   5.270  -1.973
   18    HE2  LYS   2          2HE       LYS   2   1.647   6.960  -0.467
   19    HE3  LYS   2          3HE       LYS   2   1.564   5.441   0.424
   20    HZ1  LYS   2          1HZ       LYS   2   3.104   7.759   0.979
   21    HZ2  LYS   2          2HZ       LYS   2   4.109   6.407   0.834
   22    HZ3  LYS   2          3HZ       LYS   2   2.836   6.398   1.948
   23    H    PHE   3           H        PHE   3   4.131   1.275  -4.683
   24    HA   PHE   3           HA       PHE   3   6.912   1.343  -5.420
   25    HB2  PHE   3          2HB       PHE   3   4.425   0.166  -6.597
   26    HB3  PHE   3          3HB       PHE   3   5.856   0.332  -7.608
   27    HD1  PHE   3           HD1      PHE   3   5.286  -0.686  -4.062
   28    HD2  PHE   3           HD2      PHE   3   6.934  -1.671  -7.860
   29    HE1  PHE   3           HE1      PHE   3   6.181  -2.778  -3.127
   30    HE2  PHE   3           HE2      PHE   3   7.831  -3.766  -6.932
   31    HZ   PHE   3           HZ       PHE   3   7.455  -4.322  -4.562
   32    H    LYS   4           H        LYS   4   7.455   1.970  -7.754
   33    HA   LYS   4           HA       LYS   4   6.207   4.575  -8.340
   34    HB2  LYS   4          2HB       LYS   4   9.036   3.761  -9.011
   35    HB3  LYS   4          3HB       LYS   4   8.330   5.368  -9.129
   36    HG2  LYS   4          2HG       LYS   4   9.342   5.691  -7.158
   37    HG3  LYS   4          3HG       LYS   4   7.938   4.844  -6.507
   38    HD2  LYS   4          2HD       LYS   4   9.665   3.669  -5.535
   39    HD3  LYS   4          3HD       LYS   4   9.372   2.710  -6.987
   40    HE2  LYS   4          2HE       LYS   4  11.236   3.670  -8.099
   41    HE3  LYS   4          3HE       LYS   4  11.420   4.911  -6.861
   42    HZ1  LYS   4          1HZ       LYS   4  12.988   2.907  -6.820
   43    HZ2  LYS   4          2HZ       LYS   4  11.676   2.052  -6.181
   44    HZ3  LYS   4          3HZ       LYS   4  12.290   3.397  -5.359
   45    H    PHE   5           H        PHE   5   7.346   1.541  -9.630
   46    HA   PHE   5           HA       PHE   5   6.808   2.328 -12.372
   47    HB2  PHE   5          2HB       PHE   5   7.647  -0.344 -11.227
   48    HB3  PHE   5          3HB       PHE   5   7.556   0.051 -12.940
   49    HD1  PHE   5           HD1      PHE   5   8.981   2.105 -13.695
   50    HD2  PHE   5           HD2      PHE   5   9.652  -0.111 -10.123
   51    HE1  PHE   5           HE1      PHE   5  11.303   2.916 -13.632
   52    HE2  PHE   5           HE2      PHE   5  11.975   0.698 -10.054
   53    HZ   PHE   5           HZ       PHE   5  12.803   2.214 -11.809
   54    H    ASN   6           H        ASN   6   5.352   0.429  -9.817
   55    HA   ASN   6           HA       ASN   6   3.484  -1.052 -11.207
   56    HB2  ASN   6          2HB       ASN   6   3.716   0.012  -8.469
   57    HB3  ASN   6          3HB       ASN   6   2.069  -0.344  -8.982
   58   HD21  ASN   6          1HD2      ASN   6   1.519  -2.213  -8.126
   59   HD22  ASN   6          2HD2      ASN   6   2.470  -3.656  -8.143
   60    HA   PRO   7           HA       PRO   7   0.497   1.674 -12.908
   61    HB2  PRO   7          2HB       PRO   7  -1.833   0.366 -12.430
   62    HB3  PRO   7          3HB       PRO   7  -0.652  -0.181 -13.625
   63    HG2  PRO   7          2HG       PRO   7  -1.102  -1.147 -10.828
   64    HG3  PRO   7          3HG       PRO   7  -0.800  -2.087 -12.301
   65    HD2  PRO   7          2HD       PRO   7   1.138  -1.567 -10.482
   66    HD3  PRO   7          3HD       PRO   7   1.474  -1.723 -12.219
   67    H    THR   8           H        THR   8  -0.130   0.586  -9.610
   68    HA   THR   8           HA       THR   8  -2.153   2.384  -8.923
   69    HB   THR   8           HB       THR   8  -1.312   0.407  -7.556
   70    HG1  THR   8           HG1      THR   8  -2.835   1.959  -6.757
   71   HG21  THR   8          1HG2      THR   8   0.643   2.469  -6.532
   72   HG22  THR   8          2HG2      THR   8   1.070   1.095  -7.551
   73   HG23  THR   8          3HG2      THR   8   0.431   0.826  -5.930
   74    H    GLY   9           H        GLY   9   1.179   2.925  -9.516
   75    HA2  GLY   9          2HA       GLY   9   1.819   5.069  -7.897
   76    HA3  GLY   9          3HA       GLY   9   2.418   4.860  -9.536
   77    H    THR  10           H        THR  10  -0.007   5.104 -10.931
   78    HA   THR  10           HA       THR  10  -0.249   7.958 -10.979
   79    HB   THR  10           HB       THR  10  -1.853   5.892 -12.500
   80    HG1  THR  10           HG1      THR  10   0.595   7.224 -13.052
   81   HG21  THR  10          1HG2      THR  10  -1.447   8.447 -13.792
   82   HG22  THR  10          2HG2      THR  10  -2.270   8.638 -12.244
   83   HG23  THR  10          3HG2      THR  10  -2.946   7.575 -13.477
   84    H    ILE  11           H        ILE  11  -2.523   5.300 -10.300
   85    HA   ILE  11           HA       ILE  11  -4.764   6.816  -9.697
   86    HB   ILE  11           HB       ILE  11  -3.913   4.202  -8.445
   87   HG12  ILE  11          2HG1      ILE  11  -5.955   3.700 -10.227
   88   HG13  ILE  11          3HG1      ILE  11  -5.028   4.950 -11.050
   89   HG21  ILE  11          1HG2      ILE  11  -5.609   5.288  -7.096
   90   HG22  ILE  11          2HG2      ILE  11  -6.615   5.538  -8.522
   91   HG23  ILE  11          3HG2      ILE  11  -6.301   3.903  -7.940
   92   HD11  ILE  11          1HD1      ILE  11  -4.257   2.176 -10.330
   93   HD12  ILE  11          2HD1      ILE  11  -3.989   3.077 -11.823
   94   HD13  ILE  11          3HD1      ILE  11  -3.003   3.414 -10.400
   95    H    VAL  12           H        VAL  12  -2.351   5.537  -7.400
   96    HA   VAL  12           HA       VAL  12  -3.357   6.673  -5.084
   97    HB   VAL  12           HB       VAL  12  -0.470   6.171  -5.815
   98   HG11  VAL  12          1HG1      VAL  12  -1.728   6.713  -3.128
   99   HG12  VAL  12          2HG1      VAL  12  -0.070   6.160  -3.377
  100   HG13  VAL  12          3HG1      VAL  12  -0.574   7.740  -3.979
  101   HG21  VAL  12          1HG2      VAL  12  -2.639   4.425  -5.240
  102   HG22  VAL  12          2HG2      VAL  12  -0.952   4.019  -5.554
  103   HG23  VAL  12          3HG2      VAL  12  -1.489   4.341  -3.906
  104    H    LYS  13           H        LYS  13  -1.487   8.127  -7.650
  105    HA   LYS  13           HA       LYS  13  -0.854  10.519  -6.198
  106    HB2  LYS  13          2HB       LYS  13   0.546  10.861  -7.905
  107    HB3  LYS  13          3HB       LYS  13  -0.007   9.337  -8.586
  108    HG2  LYS  13          2HG       LYS  13  -1.745  10.524  -9.830
  109    HG3  LYS  13          3HG       LYS  13  -1.183  12.053  -9.149
  110    HD2  LYS  13          2HD       LYS  13   0.527  10.200 -10.804
  111    HD3  LYS  13          3HD       LYS  13  -0.343  11.591 -11.452
  112    HE2  LYS  13          2HE       LYS  13   1.414  12.849 -10.933
  113    HE3  LYS  13          3HE       LYS  13   1.062  12.550  -9.231
  114    HZ1  LYS  13          1HZ       LYS  13   3.053  11.282 -10.968
  115    HZ2  LYS  13          2HZ       LYS  13   2.382  10.364  -9.716
  116    HZ3  LYS  13          3HZ       LYS  13   3.198  11.803  -9.365
  117    H    LYS  14           H        LYS  14  -3.394   9.476  -8.377
  118    HA   LYS  14           HA       LYS  14  -4.523  12.096  -8.702
  119    HB2  LYS  14          2HB       LYS  14  -5.611   9.345  -9.320
  120    HB3  LYS  14          3HB       LYS  14  -6.431  10.846  -9.731
  121    HG2  LYS  14          2HG       LYS  14  -3.768   9.900 -10.768
  122    HG3  LYS  14          3HG       LYS  14  -5.285  10.006 -11.665
  123    HD2  LYS  14          2HD       LYS  14  -5.278  12.457 -11.299
  124    HD3  LYS  14          3HD       LYS  14  -3.705  12.306 -10.513
  125    HE2  LYS  14          2HE       LYS  14  -2.629  12.152 -12.467
  126    HE3  LYS  14          3HE       LYS  14  -3.804  11.011 -13.120
  127    HZ1  LYS  14          1HZ       LYS  14  -3.858  13.959 -13.193
  128    HZ2  LYS  14          2HZ       LYS  14  -5.287  13.069 -13.357
  129    HZ3  LYS  14          3HZ       LYS  14  -4.029  12.862 -14.469
  130    H    LEU  15           H        LEU  15  -5.436   9.181  -6.879
  131    HA   LEU  15           HA       LEU  15  -7.753  10.166  -5.694
  132    HB2  LEU  15          2HB       LEU  15  -5.763   8.073  -4.953
  133    HB3  LEU  15          3HB       LEU  15  -7.002   8.528  -3.786
  134    HG   LEU  15           HG       LEU  15  -7.437   6.491  -5.273
  135   HD11  LEU  15          1HD1      LEU  15  -9.192   8.656  -4.437
  136   HD12  LEU  15          2HD1      LEU  15  -9.384   6.911  -4.272
  137   HD13  LEU  15          3HD1      LEU  15  -9.848   7.710  -5.774
  138   HD21  LEU  15          1HD2      LEU  15  -8.044   8.675  -7.264
  139   HD22  LEU  15          2HD2      LEU  15  -8.381   6.955  -7.464
  140   HD23  LEU  15          3HD2      LEU  15  -6.713   7.523  -7.378
  141    H    THR  16           H        THR  16  -4.393  10.663  -4.868
  142    HA   THR  16           HA       THR  16  -4.889  11.803  -2.293
  143    HB   THR  16           HB       THR  16  -2.450  12.004  -4.070
  144    HG1  THR  16           HG1      THR  16  -3.087  10.309  -1.866
  145   HG21  THR  16          1HG2      THR  16  -1.750  13.566  -2.634
  146   HG22  THR  16          2HG2      THR  16  -1.691  12.297  -1.411
  147   HG23  THR  16          3HG2      THR  16  -3.131  13.302  -1.571
  148    H    GLN  17           H        GLN  17  -4.742  13.017  -5.555
  149    HA   GLN  17           HA       GLN  17  -4.273  15.716  -5.118
  150    HB2  GLN  17          2HB       GLN  17  -4.656  14.314  -7.321
  151    HB3  GLN  17          3HB       GLN  17  -6.307  14.895  -7.146
  152    HG2  GLN  17          2HG       GLN  17  -5.769  16.888  -7.943
  153    HG3  GLN  17          3HG       GLN  17  -4.430  17.048  -6.807
  154   HE21  GLN  17          1HE2      GLN  17  -2.375  16.625  -7.473
  155   HE22  GLN  17          2HE2      GLN  17  -1.952  16.284  -9.113
  156    H    TYR  18           H        TYR  18  -7.083  13.814  -4.434
  157    HA   TYR  18           HA       TYR  18  -8.725  16.189  -3.982
  158    HB2  TYR  18          2HB       TYR  18  -9.420  13.249  -3.828
  159    HB3  TYR  18          3HB       TYR  18 -10.559  14.571  -3.597
  160    HD1  TYR  18           HD1      TYR  18  -8.212  13.118  -6.095
  161    HD2  TYR  18           HD2      TYR  18 -11.688  15.479  -5.429
  162    HE1  TYR  18           HE1      TYR  18  -8.639  13.162  -8.517
  163    HE2  TYR  18           HE2      TYR  18 -12.126  15.528  -7.849
  164    HH   TYR  18           HH       TYR  18 -10.591  13.483 -10.036
  165    H    GLU  19           H        GLU  19  -6.986  13.716  -2.267
  166    HA   GLU  19           HA       GLU  19  -8.232  14.134   0.268
  167    HB2  GLU  19          2HB       GLU  19  -5.566  12.886  -0.422
  168    HB3  GLU  19          3HB       GLU  19  -6.334  12.820   1.158
  169    HG2  GLU  19          2HG       GLU  19  -7.623  11.743  -1.331
  170    HG3  GLU  19          3HG       GLU  19  -6.582  10.777  -0.287
  171    H    ILE  20           H        ILE  20  -5.379  15.415  -1.348
  172    HA   ILE  20           HA       ILE  20  -4.116  16.685   0.761
  173    HB   ILE  20           HB       ILE  20  -4.369  17.700  -2.073
  174   HG12  ILE  20          2HG1      ILE  20  -1.906  16.355  -1.142
  175   HG13  ILE  20          3HG1      ILE  20  -3.317  15.317  -1.312
  176   HG21  ILE  20          1HG2      ILE  20  -3.222  19.471  -1.384
  177   HG22  ILE  20          2HG2      ILE  20  -3.114  18.815   0.248
  178   HG23  ILE  20          3HG2      ILE  20  -1.891  18.398  -0.951
  179   HD11  ILE  20          1HD1      ILE  20  -3.338  16.772  -3.638
  180   HD12  ILE  20          2HD1      ILE  20  -1.620  16.507  -3.341
  181   HD13  ILE  20          3HD1      ILE  20  -2.720  15.133  -3.442
  182    H    ALA  21           H        ALA  21  -6.983  17.627  -1.010
  183    HA   ALA  21           HA       ALA  21  -7.212  20.299  -0.373
  184    HB1  ALA  21          1HB       ALA  21  -9.652  18.603  -0.207
  185    HB2  ALA  21          2HB       ALA  21  -9.404  20.150  -1.016
  186    HB3  ALA  21          3HB       ALA  21  -8.766  18.670  -1.730
  187    H    TRP  22           H        TRP  22  -8.184  17.499   1.580
  188    HA   TRP  22           HA       TRP  22  -9.416  18.791   3.685
  189    HB2  TRP  22          2HB       TRP  22  -9.429  16.385   3.544
  190    HB3  TRP  22          3HB       TRP  22  -7.676  16.319   3.708
  191    HD1  TRP  22           HD1      TRP  22  -6.664  16.862   6.174
  192    HE1  TRP  22           HE1      TRP  22  -7.713  16.595   8.509
  193    HE3  TRP  22           HE3      TRP  22 -11.582  16.518   4.820
  194    HZ2  TRP  22           HZ2      TRP  22 -10.284  16.280   9.629
  195    HZ3  TRP  22           HZ3      TRP  22 -13.273  16.235   6.584
  196    HH2  TRP  22           HH2      TRP  22 -12.636  16.117   8.938
  197    H    PHE  23           H        PHE  23  -5.958  18.172   3.207
  198    HA   PHE  23           HA       PHE  23  -5.203  19.416   5.677
  199    HB2  PHE  23          2HB       PHE  23  -3.677  17.794   4.961
  200    HB3  PHE  23          3HB       PHE  23  -3.704  18.366   3.296
  201    HD1  PHE  23           HD1      PHE  23  -2.167  19.972   2.537
  202    HD2  PHE  23           HD2      PHE  23  -2.504  19.156   6.701
  203    HE1  PHE  23           HE1      PHE  23  -0.133  21.291   2.956
  204    HE2  PHE  23           HE2      PHE  23  -0.471  20.474   7.127
  205    HZ   PHE  23           HZ       PHE  23   0.717  21.544   5.254
  206    H    LYS  24           H        LYS  24  -5.632  20.442   2.378
  207    HA   LYS  24           HA       LYS  24  -4.152  22.827   2.435
  208    HB2  LYS  24          2HB       LYS  24  -5.005  21.838   0.361
  209    HB3  LYS  24          3HB       LYS  24  -6.655  22.170   0.869
  210    HG2  LYS  24          2HG       LYS  24  -6.335  23.959  -0.481
  211    HG3  LYS  24          3HG       LYS  24  -5.709  24.643   1.021
  212    HD2  LYS  24          2HD       LYS  24  -3.429  23.790   0.269
  213    HD3  LYS  24          3HD       LYS  24  -4.169  23.532  -1.312
  214    HE2  LYS  24          2HE       LYS  24  -4.231  26.173   0.133
  215    HE3  LYS  24          3HE       LYS  24  -2.962  25.725  -1.006
  216    HZ1  LYS  24          1HZ       LYS  24  -4.460  26.874  -2.311
  217    HZ2  LYS  24          2HZ       LYS  24  -5.817  26.236  -1.527
  218    HZ3  LYS  24          3HZ       LYS  24  -4.920  25.269  -2.586
  219    H    ASN  25           H        ASN  25  -7.304  22.014   3.677
  220    HA   ASN  25           HA       ASN  25  -8.119  24.743   4.087
  221    HB2  ASN  25          2HB       ASN  25  -9.250  22.099   5.011
  222    HB3  ASN  25          3HB       ASN  25  -9.969  23.650   5.436
  223   HD21  ASN  25          1HD2      ASN  25  -9.874  21.172   3.193
  224   HD22  ASN  25          2HD2      ASN  25 -10.752  21.941   1.919
  225    H    LYS  26           H        LYS  26  -6.026  22.642   5.662
  226    HA   LYS  26           HA       LYS  26  -6.457  23.799   8.307
  227    HB2  LYS  26          2HB       LYS  26  -4.336  21.798   7.545
  228    HB3  LYS  26          3HB       LYS  26  -4.992  22.128   9.144
  229    HG2  LYS  26          2HG       LYS  26  -6.552  20.915   6.872
  230    HG3  LYS  26          3HG       LYS  26  -5.781  20.000   8.171
  231    HD2  LYS  26          2HD       LYS  26  -7.236  21.874   9.546
  232    HD3  LYS  26          3HD       LYS  26  -8.279  21.521   8.166
  233    HE2  LYS  26          2HE       LYS  26  -8.986  19.824   9.470
  234    HE3  LYS  26          3HE       LYS  26  -7.538  19.023   8.863
  235    HZ1  LYS  26          1HZ       LYS  26  -6.462  19.267  10.834
  236    HZ2  LYS  26          2HZ       LYS  26  -8.046  19.189  11.420
  237    HZ3  LYS  26          3HZ       LYS  26  -7.279  20.687  11.255
  238    H    HIS  27           H        HIS  27  -4.218  23.906   5.631
  239    HA   HIS  27           HA       HIS  27  -2.849  26.147   6.925
  240    HB2  HIS  27          2HB       HIS  27  -1.382  23.888   5.549
  241    HB3  HIS  27          3HB       HIS  27  -0.653  25.316   6.278
  242    HD1  HIS  27           HD1      HIS  27  -2.449  22.136   7.224
  243    HD2  HIS  27           HD2      HIS  27  -0.188  25.144   8.985
  244    HE1  HIS  27           HE1      HIS  27  -1.979  21.341   9.563
  245    H    GLY  28           H        GLY  28  -3.227  24.250   3.942
  246    HA2  GLY  28          2HA       GLY  28  -3.976  25.220   1.900
  247    HA3  GLY  28          3HA       GLY  28  -3.381  26.777   2.456
  248    H    TYR  29           H        TYR  29  -1.447  23.896   2.748
  249    HA   TYR  29           HA       TYR  29   0.223  24.820   0.504
  250    HB2  TYR  29          2HB       TYR  29   1.044  23.986   3.276
  251    HB3  TYR  29          3HB       TYR  29   2.166  23.881   1.924
  252    HD1  TYR  29           HD1      TYR  29   3.504  25.708   1.446
  253    HD2  TYR  29           HD2      TYR  29  -0.129  26.323   3.573
  254    HE1  TYR  29           HE1      TYR  29   4.084  28.080   1.739
  255    HE2  TYR  29           HE2      TYR  29   0.440  28.697   3.870
  256    HH   TYR  29           HH       TYR  29   2.421  30.126   3.889
  257    H    TYR  30           H        TYR  30   2.061  22.881   0.342
  258    HA   TYR  30           HA       TYR  30   0.728  20.290   0.371
  259    HB2  TYR  30          2HB       TYR  30   2.017  21.149  -2.197
  260    HB3  TYR  30          3HB       TYR  30   0.832  19.877  -1.920
  261    HD1  TYR  30           HD1      TYR  30  -1.500  20.324  -2.036
  262    HD2  TYR  30           HD2      TYR  30   1.288  23.535  -2.186
  263    HE1  TYR  30           HE1      TYR  30  -3.305  21.852  -2.713
  264    HE2  TYR  30           HE2      TYR  30  -0.509  25.072  -2.862
  265    HH   TYR  30           HH       TYR  30  -3.736  23.910  -3.609
  266    HA   PRO  31           HA       PRO  31   5.432  19.708  -0.577
  267    HB2  PRO  31          2HB       PRO  31   6.945  21.952  -0.789
  268    HB3  PRO  31          3HB       PRO  31   6.132  21.207  -2.171
  269    HG2  PRO  31          2HG       PRO  31   5.289  23.557  -0.520
  270    HG3  PRO  31          3HG       PRO  31   5.234  23.349  -2.280
  271    HD2  PRO  31          2HD       PRO  31   3.051  23.042  -0.708
  272    HD3  PRO  31          3HD       PRO  31   3.293  22.109  -2.199
  273    H    TRP  32           H        TRP  32   7.646  20.688   0.572
  274    HA   TRP  32           HA       TRP  32   7.008  20.545   3.385
  275    HB2  TRP  32          2HB       TRP  32   9.268  20.090   3.742
  276    HB3  TRP  32          3HB       TRP  32   8.984  19.409   2.143
  277    HD1  TRP  32           HD1      TRP  32  10.991  22.055   3.941
  278    HE1  TRP  32           HE1      TRP  32  12.601  23.180   2.278
  279    HE3  TRP  32           HE3      TRP  32   9.166  20.090  -0.412
  280    HZ2  TRP  32           HZ2      TRP  32  13.039  23.229  -0.510
  281    HZ3  TRP  32           HZ3      TRP  32  10.237  20.727  -2.533
  282    HH2  TRP  32           HH2      TRP  32  12.133  22.265  -2.579
  283    H    GLU  33           H        GLU  33   6.893  23.018   1.321
  284    HA   GLU  33           HA       GLU  33   8.304  24.996   2.906
  285    HB2  GLU  33          2HB       GLU  33   6.464  25.515   0.574
  286    HB3  GLU  33          3HB       GLU  33   7.729  26.562   1.203
  287    HG2  GLU  33          2HG       GLU  33   9.435  25.074   0.414
  288    HG3  GLU  33          3HG       GLU  33   8.229  23.883  -0.070
  289    H    ILE  34           H        ILE  34   6.453  23.788   4.482
  290    HA   ILE  34           HA       ILE  34   4.097  25.517   4.551
  291    HB   ILE  34           HB       ILE  34   4.770  23.114   6.254
  292   HG12  ILE  34          2HG1      ILE  34   2.571  23.134   4.239
  293   HG13  ILE  34          3HG1      ILE  34   4.223  22.970   3.653
  294   HG21  ILE  34          1HG2      ILE  34   3.276  24.753   7.341
  295   HG22  ILE  34          2HG2      ILE  34   2.164  24.604   5.981
  296   HG23  ILE  34          3HG2      ILE  34   2.482  23.213   7.017
  297   HD11  ILE  34          1HD1      ILE  34   3.046  21.194   5.769
  298   HD12  ILE  34          2HD1      ILE  34   2.991  20.828   4.044
  299   HD13  ILE  34          3HD1      ILE  34   4.545  20.966   4.868
  300    HA   PRO  35           HA       PRO  35   5.913  28.113   7.637
  301    HB2  PRO  35          2HB       PRO  35   3.639  29.377   8.411
  302    HB3  PRO  35          3HB       PRO  35   4.466  29.734   6.891
  303    HG2  PRO  35          2HG       PRO  35   2.071  28.008   7.383
  304    HG3  PRO  35          3HG       PRO  35   2.357  29.180   6.084
  305    HD2  PRO  35          2HD       PRO  35   2.657  26.512   5.731
  306    HD3  PRO  35          3HD       PRO  35   3.647  27.707   4.868
  307    H    ARG  36           H        ARG  36   4.948  28.909   9.957
  308    HA   ARG  36           HA       ARG  36   4.002  26.530  11.397
  309    HB2  ARG  36          2HB       ARG  36   5.625  27.076  13.225
  310    HB3  ARG  36          3HB       ARG  36   6.372  26.511  11.737
  311    HG2  ARG  36          2HG       ARG  36   6.116  29.394  11.786
  312    HG3  ARG  36          3HG       ARG  36   7.035  28.783  13.163
  313    HD2  ARG  36          2HD       ARG  36   8.705  27.929  11.844
  314    HD3  ARG  36          3HD       ARG  36   7.641  27.705  10.457
  315    HE   ARG  36           HE       ARG  36   8.244  29.780   9.739
  316   HH11  ARG  36          1HH1      ARG  36   8.877  29.565  13.156
  317   HH12  ARG  36          2HH1      ARG  36   9.627  31.124  13.247
  318   HH21  ARG  36          1HH2      ARG  36   9.230  31.834   9.847
  319   HH22  ARG  36          2HH2      ARG  36   9.827  32.414  11.365
  320    H    CYS  37           H        CYS  37   3.714  27.305  13.863
  321    HA   CYS  37           HA       CYS  37   1.505  29.006  13.881
  322    HB2  CYS  37          2HB       CYS  37   3.115  27.589  15.852
  323    HB3  CYS  37          3HB       CYS  37   2.507  29.120  16.470
  324    HG   CYS  37           HG       CYS  37   0.833  26.303  15.706
  Start of MODEL   15
    1    H    MET   1           H        MET   1   1.322  -1.193   0.274
    2    HA   MET   1           HA       MET   1   2.677  -0.979  -1.599
    3    HB2  MET   1          2HB       MET   1   0.325   0.714  -2.446
    4    HB3  MET   1          3HB       MET   1   1.361  -0.263  -3.478
    5    HG2  MET   1          2HG       MET   1   0.396  -2.091  -1.672
    6    HG3  MET   1          3HG       MET   1  -0.976  -1.015  -1.924
    7    HE1  MET   1          1HE       MET   1  -1.696  -4.135  -3.434
    8    HE2  MET   1          2HE       MET   1  -2.279  -2.727  -2.546
    9    HE3  MET   1          3HE       MET   1  -2.648  -2.903  -4.262
   10    H    LYS   2           H        LYS   2   4.402   0.160  -2.183
   11    HA   LYS   2           HA       LYS   2   4.267   3.057  -2.384
   12    HB2  LYS   2          2HB       LYS   2   6.245   1.678  -0.558
   13    HB3  LYS   2          3HB       LYS   2   6.247   3.391  -0.956
   14    HG2  LYS   2          2HG       LYS   2   3.992   3.574   0.068
   15    HG3  LYS   2          3HG       LYS   2   4.137   1.890   0.578
   16    HD2  LYS   2          2HD       LYS   2   6.108   2.441   1.896
   17    HD3  LYS   2          3HD       LYS   2   6.026   4.117   1.346
   18    HE2  LYS   2          2HE       LYS   2   4.281   4.621   2.710
   19    HE3  LYS   2          3HE       LYS   2   3.591   3.002   2.605
   20    HZ1  LYS   2          1HZ       LYS   2   6.136   3.286   4.006
   21    HZ2  LYS   2          2HZ       LYS   2   4.832   2.258   4.330
   22    HZ3  LYS   2          3HZ       LYS   2   4.758   3.887   4.782
   23    H    PHE   3           H        PHE   3   4.459   2.055  -4.618
   24    HA   PHE   3           HA       PHE   3   7.304   1.655  -5.277
   25    HB2  PHE   3          2HB       PHE   3   4.822   0.377  -6.356
   26    HB3  PHE   3          3HB       PHE   3   6.218   0.564  -7.412
   27    HD1  PHE   3           HD1      PHE   3   5.736  -0.418  -3.841
   28    HD2  PHE   3           HD2      PHE   3   7.395  -1.384  -7.640
   29    HE1  PHE   3           HE1      PHE   3   6.723  -2.461  -2.888
   30    HE2  PHE   3           HE2      PHE   3   8.383  -3.428  -6.693
   31    HZ   PHE   3           HZ       PHE   3   8.047  -3.969  -4.314
   32    H    LYS   4           H        LYS   4   7.774   2.255  -7.628
   33    HA   LYS   4           HA       LYS   4   6.425   4.804  -8.238
   34    HB2  LYS   4          2HB       LYS   4   9.252   4.079  -9.001
   35    HB3  LYS   4          3HB       LYS   4   8.491   5.663  -9.070
   36    HG2  LYS   4          2HG       LYS   4   9.507   6.031  -7.122
   37    HG3  LYS   4          3HG       LYS   4   8.235   5.024  -6.427
   38    HD2  LYS   4          2HD       LYS   4  10.120   3.995  -5.598
   39    HD3  LYS   4          3HD       LYS   4   9.850   3.066  -7.075
   40    HE2  LYS   4          2HE       LYS   4  11.668   3.951  -8.124
   41    HE3  LYS   4          3HE       LYS   4  11.541   5.493  -7.280
   42    HZ1  LYS   4          1HZ       LYS   4  12.135   3.714  -5.308
   43    HZ2  LYS   4          2HZ       LYS   4  13.231   4.762  -6.056
   44    HZ3  LYS   4          3HZ       LYS   4  13.074   3.171  -6.607
   45    H    PHE   5           H        PHE   5   7.628   1.780  -9.495
   46    HA   PHE   5           HA       PHE   5   6.997   2.489 -12.239
   47    HB2  PHE   5          2HB       PHE   5   7.959  -0.115 -11.035
   48    HB3  PHE   5          3HB       PHE   5   7.771   0.195 -12.758
   49    HD1  PHE   5           HD1      PHE   5   9.039   2.382 -13.588
   50    HD2  PHE   5           HD2      PHE   5  10.052   0.108 -10.136
   51    HE1  PHE   5           HE1      PHE   5  11.332   3.271 -13.680
   52    HE2  PHE   5           HE2      PHE   5  12.346   0.993 -10.221
   53    HZ   PHE   5           HZ       PHE   5  12.989   2.577 -11.994
   54    H    ASN   6           H        ASN   6   5.655   0.610  -9.607
   55    HA   ASN   6           HA       ASN   6   3.793  -0.949 -10.919
   56    HB2  ASN   6          2HB       ASN   6   4.062   0.180  -8.210
   57    HB3  ASN   6          3HB       ASN   6   2.415  -0.234  -8.675
   58   HD21  ASN   6          1HD2      ASN   6   2.349  -1.897  -7.160
   59   HD22  ASN   6          2HD2      ASN   6   3.183  -3.390  -7.405
   60    HA   PRO   7           HA       PRO   7   0.694   1.663 -12.599
   61    HB2  PRO   7          2HB       PRO   7  -1.588   0.304 -12.036
   62    HB3  PRO   7          3HB       PRO   7  -0.422  -0.236 -13.250
   63    HG2  PRO   7          2HG       PRO   7  -0.777  -1.155 -10.423
   64    HG3  PRO   7          3HG       PRO   7  -0.487  -2.117 -11.884
   65    HD2  PRO   7          2HD       PRO   7   1.480  -1.509 -10.126
   66    HD3  PRO   7          3HD       PRO   7   1.778  -1.692 -11.867
   67    H    THR   8           H        THR   8   0.179   0.627  -9.265
   68    HA   THR   8           HA       THR   8  -1.875   2.385  -8.563
   69    HB   THR   8           HB       THR   8  -0.945   0.461  -7.178
   70    HG1  THR   8           HG1      THR   8  -2.493   1.939  -6.348
   71   HG21  THR   8          1HG2      THR   8   0.977   2.596  -6.246
   72   HG22  THR   8          2HG2      THR   8   1.416   1.213  -7.249
   73   HG23  THR   8          3HG2      THR   8   0.826   0.960  -5.606
   74    H    GLY   9           H        GLY   9   1.426   3.002  -9.252
   75    HA2  GLY   9          2HA       GLY   9   2.048   5.196  -7.694
   76    HA3  GLY   9          3HA       GLY   9   2.610   4.969  -9.344
   77    H    THR  10           H        THR  10   0.145   5.118 -10.680
   78    HA   THR  10           HA       THR  10  -0.176   7.963 -10.781
   79    HB   THR  10           HB       THR  10  -1.762   5.824 -12.216
   80    HG1  THR  10           HG1      THR  10   0.456   7.353 -13.149
   81   HG21  THR  10          1HG2      THR  10  -2.922   7.457 -13.204
   82   HG22  THR  10          2HG2      THR  10  -1.454   8.363 -13.569
   83   HG23  THR  10          3HG2      THR  10  -2.247   8.561 -12.007
   84    H    ILE  11           H        ILE  11  -2.358   5.261  -9.988
   85    HA   ILE  11           HA       ILE  11  -4.624   6.729  -9.359
   86    HB   ILE  11           HB       ILE  11  -3.671   4.166  -8.075
   87   HG12  ILE  11          2HG1      ILE  11  -5.743   3.572  -9.794
   88   HG13  ILE  11          3HG1      ILE  11  -4.870   4.828 -10.666
   89   HG21  ILE  11          1HG2      ILE  11  -6.035   3.813  -7.502
   90   HG22  ILE  11          2HG2      ILE  11  -5.363   5.235  -6.707
   91   HG23  ILE  11          3HG2      ILE  11  -6.411   5.424  -8.112
   92   HD11  ILE  11          1HD1      ILE  11  -2.789   3.360 -10.039
   93   HD12  ILE  11          2HD1      ILE  11  -4.007   2.091  -9.908
   94   HD13  ILE  11          3HD1      ILE  11  -3.803   2.965 -11.426
   95    H    VAL  12           H        VAL  12  -2.120   5.563  -7.099
   96    HA   VAL  12           HA       VAL  12  -3.097   6.722  -4.781
   97    HB   VAL  12           HB       VAL  12  -0.217   6.281  -5.576
   98   HG11  VAL  12          1HG1      VAL  12  -0.317   7.885  -3.772
   99   HG12  VAL  12          2HG1      VAL  12  -1.419   6.845  -2.868
  100   HG13  VAL  12          3HG1      VAL  12   0.245   6.333  -3.152
  101   HG21  VAL  12          1HG2      VAL  12  -1.684   4.562  -3.645
  102   HG22  VAL  12          2HG2      VAL  12  -2.028   4.366  -5.364
  103   HG23  VAL  12          3HG2      VAL  12  -0.384   4.151  -4.764
  104    H    LYS  13           H        LYS  13  -1.333   8.169  -7.424
  105    HA   LYS  13           HA       LYS  13  -0.728  10.608  -6.040
  106    HB2  LYS  13          2HB       LYS  13   0.618  10.950  -7.789
  107    HB3  LYS  13          3HB       LYS  13   0.089   9.398  -8.424
  108    HG2  LYS  13          2HG       LYS  13  -1.711  10.512  -9.647
  109    HG3  LYS  13          3HG       LYS  13  -1.174  12.069  -9.012
  110    HD2  LYS  13          2HD       LYS  13   0.572  10.234 -10.647
  111    HD3  LYS  13          3HD       LYS  13  -0.389  11.545 -11.337
  112    HE2  LYS  13          2HE       LYS  13   1.710  11.890  -9.198
  113    HE3  LYS  13          3HE       LYS  13   1.979  12.161 -10.919
  114    HZ1  LYS  13          1HZ       LYS  13   0.158  13.662  -9.124
  115    HZ2  LYS  13          2HZ       LYS  13   0.143  13.825 -10.808
  116    HZ3  LYS  13          3HZ       LYS  13   1.525  14.248  -9.929
  117    H    LYS  14           H        LYS  14  -3.294   9.452  -8.130
  118    HA   LYS  14           HA       LYS  14  -4.501  12.034  -8.479
  119    HB2  LYS  14          2HB       LYS  14  -5.530   9.242  -9.012
  120    HB3  LYS  14          3HB       LYS  14  -6.400  10.712  -9.433
  121    HG2  LYS  14          2HG       LYS  14  -3.740   9.816 -10.518
  122    HG3  LYS  14          3HG       LYS  14  -5.281   9.863 -11.378
  123    HD2  LYS  14          2HD       LYS  14  -5.331  12.319 -11.064
  124    HD3  LYS  14          3HD       LYS  14  -3.736  12.227 -10.314
  125    HE2  LYS  14          2HE       LYS  14  -3.169  12.742 -12.478
  126    HE3  LYS  14          3HE       LYS  14  -3.104  10.981 -12.529
  127    HZ1  LYS  14          1HZ       LYS  14  -5.702  12.080 -13.121
  128    HZ2  LYS  14          2HZ       LYS  14  -4.820  10.887 -13.934
  129    HZ3  LYS  14          3HZ       LYS  14  -4.507  12.522 -14.234
  130    H    LEU  15           H        LEU  15  -5.288   9.135  -6.574
  131    HA   LEU  15           HA       LEU  15  -7.601  10.083  -5.350
  132    HB2  LEU  15          2HB       LEU  15  -5.538   8.058  -4.619
  133    HB3  LEU  15          3HB       LEU  15  -6.758   8.505  -3.429
  134    HG   LEU  15           HG       LEU  15  -7.177   6.427  -4.862
  135   HD11  LEU  15          1HD1      LEU  15  -9.105   6.826  -3.813
  136   HD12  LEU  15          2HD1      LEU  15  -9.631   7.562  -5.327
  137   HD13  LEU  15          3HD1      LEU  15  -8.971   8.570  -4.039
  138   HD21  LEU  15          1HD2      LEU  15  -8.186   6.820  -7.037
  139   HD22  LEU  15          2HD2      LEU  15  -6.531   7.428  -7.006
  140   HD23  LEU  15          3HD2      LEU  15  -7.886   8.551  -6.883
  141    H    THR  16           H        THR  16  -4.235  10.685  -4.621
  142    HA   THR  16           HA       THR  16  -4.698  11.867  -2.058
  143    HB   THR  16           HB       THR  16  -2.307  12.087  -3.896
  144    HG1  THR  16           HG1      THR  16  -1.452  10.507  -2.445
  145   HG21  THR  16          1HG2      THR  16  -1.473  12.459  -1.280
  146   HG22  THR  16          2HG2      THR  16  -2.959  13.403  -1.389
  147   HG23  THR  16          3HG2      THR  16  -1.635  13.710  -2.512
  148    H    GLN  17           H        GLN  17  -4.657  13.012  -5.348
  149    HA   GLN  17           HA       GLN  17  -4.244  15.730  -4.980
  150    HB2  GLN  17          2HB       GLN  17  -4.756  14.185  -7.126
  151    HB3  GLN  17          3HB       GLN  17  -6.325  14.958  -6.942
  152    HG2  GLN  17          2HG       GLN  17  -4.671  17.090  -6.722
  153    HG3  GLN  17          3HG       GLN  17  -3.765  16.067  -7.836
  154   HE21  GLN  17          1HE2      GLN  17  -5.242  15.061  -9.578
  155   HE22  GLN  17          2HE2      GLN  17  -6.318  16.165 -10.357
  156    H    TYR  18           H        TYR  18  -6.990  13.777  -4.189
  157    HA   TYR  18           HA       TYR  18  -8.678  16.122  -3.747
  158    HB2  TYR  18          2HB       TYR  18  -9.300  13.170  -3.515
  159    HB3  TYR  18          3HB       TYR  18 -10.464  14.471  -3.289
  160    HD1  TYR  18           HD1      TYR  18  -8.141  13.012  -5.805
  161    HD2  TYR  18           HD2      TYR  18 -11.651  15.316  -5.114
  162    HE1  TYR  18           HE1      TYR  18  -8.622  12.991  -8.217
  163    HE2  TYR  18           HE2      TYR  18 -12.142  15.301  -7.524
  164    HH   TYR  18           HH       TYR  18 -10.406  14.969  -9.753
  165    H    GLU  19           H        GLU  19  -6.840  13.728  -2.024
  166    HA   GLU  19           HA       GLU  19  -8.038  14.169   0.531
  167    HB2  GLU  19          2HB       GLU  19  -5.357  12.973  -0.195
  168    HB3  GLU  19          3HB       GLU  19  -6.089  12.919   1.403
  169    HG2  GLU  19          2HG       GLU  19  -7.417  11.767  -1.030
  170    HG3  GLU  19          3HG       GLU  19  -6.313  10.844  -0.012
  171    H    ILE  20           H        ILE  20  -5.257  15.486  -1.179
  172    HA   ILE  20           HA       ILE  20  -3.977  16.830   0.873
  173    HB   ILE  20           HB       ILE  20  -4.323  17.781  -1.973
  174   HG12  ILE  20          2HG1      ILE  20  -1.805  16.517  -1.077
  175   HG13  ILE  20          3HG1      ILE  20  -3.193  15.441  -1.191
  176   HG21  ILE  20          1HG2      ILE  20  -1.837  18.562  -0.926
  177   HG22  ILE  20          2HG2      ILE  20  -3.203  19.592  -1.350
  178   HG23  ILE  20          3HG2      ILE  20  -3.042  18.975   0.294
  179   HD11  ILE  20          1HD1      ILE  20  -1.574  16.625  -3.285
  180   HD12  ILE  20          2HD1      ILE  20  -2.654  15.231  -3.334
  181   HD13  ILE  20          3HD1      ILE  20  -3.302  16.857  -3.544
  182    H    ALA  21           H        ALA  21  -6.909  17.665  -0.845
  183    HA   ALA  21           HA       ALA  21  -7.190  20.342  -0.255
  184    HB1  ALA  21          1HB       ALA  21  -9.640  18.739   0.061
  185    HB2  ALA  21          2HB       ALA  21  -9.309  20.117  -0.990
  186    HB3  ALA  21          3HB       ALA  21  -8.759  18.505  -1.449
  187    H    TRP  22           H        TRP  22  -8.043  17.559   1.776
  188    HA   TRP  22           HA       TRP  22  -9.256  18.861   3.885
  189    HB2  TRP  22          2HB       TRP  22  -9.180  16.438   3.751
  190    HB3  TRP  22          3HB       TRP  22  -7.431  16.450   3.959
  191    HD1  TRP  22           HD1      TRP  22  -6.529  17.232   6.442
  192    HE1  TRP  22           HE1      TRP  22  -7.616  16.917   8.754
  193    HE3  TRP  22           HE3      TRP  22 -11.335  16.311   4.962
  194    HZ2  TRP  22           HZ2      TRP  22 -10.172  16.352   9.810
  195    HZ3  TRP  22           HZ3      TRP  22 -13.040  15.892   6.685
  196    HH2  TRP  22           HH2      TRP  22 -12.469  15.912   9.059
  197    H    PHE  23           H        PHE  23  -5.796  18.320   3.334
  198    HA   PHE  23           HA       PHE  23  -5.013  19.632   5.760
  199    HB2  PHE  23          2HB       PHE  23  -3.465  18.034   5.039
  200    HB3  PHE  23          3HB       PHE  23  -3.547  18.571   3.364
  201    HD1  PHE  23           HD1      PHE  23  -2.285  19.461   6.722
  202    HD2  PHE  23           HD2      PHE  23  -2.069  20.201   2.536
  203    HE1  PHE  23           HE1      PHE  23  -0.277  20.838   7.072
  204    HE2  PHE  23           HE2      PHE  23  -0.060  21.578   2.880
  205    HZ   PHE  23           HZ       PHE  23   0.839  21.898   5.150
  206    H    LYS  24           H        LYS  24  -5.547  20.580   2.453
  207    HA   LYS  24           HA       LYS  24  -4.128  23.001   2.426
  208    HB2  LYS  24          2HB       LYS  24  -5.005  21.950   0.394
  209    HB3  LYS  24          3HB       LYS  24  -6.651  22.251   0.937
  210    HG2  LYS  24          2HG       LYS  24  -6.409  24.019  -0.457
  211    HG3  LYS  24          3HG       LYS  24  -5.765  24.749   1.016
  212    HD2  LYS  24          2HD       LYS  24  -3.483  23.938   0.225
  213    HD3  LYS  24          3HD       LYS  24  -4.254  23.631  -1.333
  214    HE2  LYS  24          2HE       LYS  24  -4.349  26.297   0.063
  215    HE3  LYS  24          3HE       LYS  24  -3.096  25.860  -1.098
  216    HZ1  LYS  24          1HZ       LYS  24  -5.822  25.430  -1.985
  217    HZ2  LYS  24          2HZ       LYS  24  -4.499  26.072  -2.821
  218    HZ3  LYS  24          3HZ       LYS  24  -5.386  27.050  -1.762
  219    H    ASN  25           H        ASN  25  -7.227  22.136   3.762
  220    HA   ASN  25           HA       ASN  25  -8.101  24.852   4.138
  221    HB2  ASN  25          2HB       ASN  25  -9.143  22.204   5.153
  222    HB3  ASN  25          3HB       ASN  25  -9.894  23.748   5.545
  223   HD21  ASN  25          1HD2      ASN  25  -9.742  21.212   3.356
  224   HD22  ASN  25          2HD2      ASN  25 -10.677  21.915   2.085
  225    H    LYS  26           H        LYS  26  -5.917  22.835   5.702
  226    HA   LYS  26           HA       LYS  26  -6.314  24.034   8.333
  227    HB2  LYS  26          2HB       LYS  26  -4.161  22.072   7.559
  228    HB3  LYS  26          3HB       LYS  26  -4.786  22.417   9.166
  229    HG2  LYS  26          2HG       LYS  26  -6.369  21.120   6.958
  230    HG3  LYS  26          3HG       LYS  26  -5.544  20.252   8.255
  231    HD2  LYS  26          2HD       LYS  26  -7.145  22.307   9.410
  232    HD3  LYS  26          3HD       LYS  26  -8.138  21.396   8.270
  233    HE2  LYS  26          2HE       LYS  26  -7.630  19.336   9.376
  234    HE3  LYS  26          3HE       LYS  26  -6.427  20.120  10.398
  235    HZ1  LYS  26          1HZ       LYS  26  -8.031  20.441  11.871
  236    HZ2  LYS  26          2HZ       LYS  26  -9.215  19.864  10.810
  237    HZ3  LYS  26          3HZ       LYS  26  -8.787  21.500  10.790
  238    H    HIS  27           H        HIS  27  -4.143  24.144   5.601
  239    HA   HIS  27           HA       HIS  27  -2.801  26.445   6.818
  240    HB2  HIS  27          2HB       HIS  27  -1.311  24.195   5.451
  241    HB3  HIS  27          3HB       HIS  27  -0.601  25.655   6.134
  242    HD1  HIS  27           HD1      HIS  27  -2.292  22.451   7.184
  243    HD2  HIS  27           HD2      HIS  27  -0.068  25.550   8.831
  244    HE1  HIS  27           HE1      HIS  27  -1.746  21.716   9.526
  245    H    GLY  28           H        GLY  28  -3.203  24.478   3.883
  246    HA2  GLY  28          2HA       GLY  28  -4.025  25.387   1.841
  247    HA3  GLY  28          3HA       GLY  28  -3.456  26.970   2.351
  248    H    TYR  29           H        TYR  29  -1.443  24.143   2.652
  249    HA   TYR  29           HA       TYR  29   0.148  25.063   0.350
  250    HB2  TYR  29          2HB       TYR  29   1.056  24.306   3.116
  251    HB3  TYR  29          3HB       TYR  29   2.148  24.201   1.740
  252    HD1  TYR  29           HD1      TYR  29  -0.169  26.619   3.395
  253    HD2  TYR  29           HD2      TYR  29   3.426  26.051   1.192
  254    HE1  TYR  29           HE1      TYR  29   0.347  29.012   3.632
  255    HE2  TYR  29           HE2      TYR  29   3.953  28.442   1.424
  256    HH   TYR  29           HH       TYR  29   2.785  30.553   1.832
  257    H    TYR  30           H        TYR  30   2.029  23.167   0.181
  258    HA   TYR  30           HA       TYR  30   0.764  20.546   0.293
  259    HB2  TYR  30          2HB       TYR  30   1.969  21.384  -2.322
  260    HB3  TYR  30          3HB       TYR  30   0.823  20.089  -1.991
  261    HD1  TYR  30           HD1      TYR  30   1.181  23.751  -2.340
  262    HD2  TYR  30           HD2      TYR  30  -1.522  20.478  -2.056
  263    HE1  TYR  30           HE1      TYR  30  -0.670  25.230  -3.002
  264    HE2  TYR  30           HE2      TYR  30  -3.380  21.946  -2.719
  265    HH   TYR  30           HH       TYR  30  -3.949  23.970  -3.469
  266    HA   PRO  31           HA       PRO  31   5.456  20.060  -0.757
  267    HB2  PRO  31          2HB       PRO  31   6.907  22.336  -1.051
  268    HB3  PRO  31          3HB       PRO  31   6.080  21.543  -2.398
  269    HG2  PRO  31          2HG       PRO  31   5.218  23.905  -0.773
  270    HG3  PRO  31          3HG       PRO  31   5.127  23.660  -2.527
  271    HD2  PRO  31          2HD       PRO  31   2.990  23.331  -0.896
  272    HD3  PRO  31          3HD       PRO  31   3.220  22.375  -2.374
  273    H    TRP  32           H        TRP  32   7.672  21.118   0.317
  274    HA   TRP  32           HA       TRP  32   7.105  21.016   3.147
  275    HB2  TRP  32          2HB       TRP  32   9.385  20.625   3.458
  276    HB3  TRP  32          3HB       TRP  32   9.078  19.904   1.880
  277    HD1  TRP  32           HD1      TRP  32  11.060  22.636   3.575
  278    HE1  TRP  32           HE1      TRP  32  12.602  23.766   1.851
  279    HE3  TRP  32           HE3      TRP  32   9.182  20.536  -0.691
  280    HZ2  TRP  32           HZ2      TRP  32  12.972  23.767  -0.947
  281    HZ3  TRP  32           HZ3      TRP  32  10.186  21.155  -2.851
  282    HH2  TRP  32           HH2      TRP  32  12.041  22.738  -2.974
  283    H    GLU  33           H        GLU  33   6.879  23.443   1.039
  284    HA   GLU  33           HA       GLU  33   8.277  25.487   2.550
  285    HB2  GLU  33          2HB       GLU  33   6.369  25.913   0.253
  286    HB3  GLU  33          3HB       GLU  33   7.622  27.003   0.831
  287    HG2  GLU  33          2HG       GLU  33   9.345  25.543   0.030
  288    HG3  GLU  33          3HG       GLU  33   8.159  24.313  -0.402
  289    H    ILE  34           H        ILE  34   6.496  24.266   4.194
  290    HA   ILE  34           HA       ILE  34   4.099  25.937   4.286
  291    HB   ILE  34           HB       ILE  34   4.873  23.588   6.019
  292   HG12  ILE  34          2HG1      ILE  34   2.627  23.510   4.060
  293   HG13  ILE  34          3HG1      ILE  34   4.267  23.378   3.435
  294   HG21  ILE  34          1HG2      ILE  34   3.364  25.211   7.109
  295   HG22  ILE  34          2HG2      ILE  34   2.224  25.006   5.780
  296   HG23  ILE  34          3HG2      ILE  34   2.602  23.645   6.835
  297   HD11  ILE  34          1HD1      ILE  34   2.840  21.266   4.136
  298   HD12  ILE  34          2HD1      ILE  34   4.591  21.327   4.344
  299   HD13  ILE  34          3HD1      ILE  34   3.528  21.641   5.716
  300    HA   PRO  35           HA       PRO  35   5.922  28.641   7.275
  301    HB2  PRO  35          2HB       PRO  35   3.635  29.863   8.079
  302    HB3  PRO  35          3HB       PRO  35   4.416  30.210   6.532
  303    HG2  PRO  35          2HG       PRO  35   2.078  28.434   7.117
  304    HG3  PRO  35          3HG       PRO  35   2.303  29.586   5.788
  305    HD2  PRO  35          2HD       PRO  35   2.663  26.920   5.481
  306    HD3  PRO  35          3HD       PRO  35   3.601  28.121   4.571
  307    H    ARG  36           H        ARG  36   4.989  29.460   9.601
  308    HA   ARG  36           HA       ARG  36   4.726  26.988  11.156
  309    HB2  ARG  36          2HB       ARG  36   5.405  29.725  12.222
  310    HB3  ARG  36          3HB       ARG  36   5.659  28.169  13.000
  311    HG2  ARG  36          2HG       ARG  36   7.095  29.186  10.557
  312    HG3  ARG  36          3HG       ARG  36   7.752  29.084  12.191
  313    HD2  ARG  36          2HD       ARG  36   7.085  26.563  11.979
  314    HD3  ARG  36          3HD       ARG  36   7.136  26.902  10.249
  315    HE   ARG  36           HE       ARG  36   9.414  26.945  10.373
  316   HH11  ARG  36          1HH1      ARG  36   8.109  27.342  13.576
  317   HH12  ARG  36          2HH1      ARG  36   9.654  27.258  14.357
  318   HH21  ARG  36          1HH2      ARG  36  11.453  26.832  11.389
  319   HH22  ARG  36          2HH2      ARG  36  11.555  26.968  13.112
  320    H    CYS  37           H        CYS  37   3.394  27.095  13.146
  321    HA   CYS  37           HA       CYS  37   0.999  28.762  12.734
  322    HB2  CYS  37          2HB       CYS  37   0.872  26.183  12.345
  323    HB3  CYS  37          3HB       CYS  37   0.879  26.095  14.102
  324    HG   CYS  37           HG       CYS  37  -1.754  25.839  13.312
  Start of MODEL   16
    1    H    MET   1           H        MET   1   6.643  -0.889  -1.629
    2    HA   MET   1           HA       MET   1   4.733  -0.106   0.138
    3    HB2  MET   1          2HB       MET   1   7.188   0.016   1.460
    4    HB3  MET   1          3HB       MET   1   6.828   1.685   1.042
    5    HG2  MET   1          2HG       MET   1   5.522   1.784   2.819
    6    HG3  MET   1          3HG       MET   1   4.438   0.641   2.028
    7    HE1  MET   1          1HE       MET   1   4.777  -2.559   3.879
    8    HE2  MET   1          2HE       MET   1   3.600  -1.304   3.492
    9    HE3  MET   1          3HE       MET   1   4.658  -1.940   2.231
   10    H    LYS   2           H        LYS   2   3.697   1.028  -1.376
   11    HA   LYS   2           HA       LYS   2   3.217   2.595  -2.955
   12    HB2  LYS   2          2HB       LYS   2   5.179   3.978  -1.171
   13    HB3  LYS   2          3HB       LYS   2   4.654   4.780  -2.645
   14    HG2  LYS   2          2HG       LYS   2   2.363   4.718  -1.930
   15    HG3  LYS   2          3HG       LYS   2   2.790   3.748  -0.518
   16    HD2  LYS   2          2HD       LYS   2   4.139   5.597   0.345
   17    HD3  LYS   2          3HD       LYS   2   3.727   6.564  -1.073
   18    HE2  LYS   2          2HE       LYS   2   2.032   7.341   0.160
   19    HE3  LYS   2          3HE       LYS   2   1.267   5.782  -0.145
   20    HZ1  LYS   2          1HZ       LYS   2   1.802   5.011   1.932
   21    HZ2  LYS   2          2HZ       LYS   2   1.536   6.647   2.270
   22    HZ3  LYS   2          3HZ       LYS   2   3.116   6.060   2.123
   23    H    PHE   3           H        PHE   3   4.217   0.980  -4.456
   24    HA   PHE   3           HA       PHE   3   6.836   1.227  -5.421
   25    HB2  PHE   3          2HB       PHE   3   4.303   0.066  -6.523
   26    HB3  PHE   3          3HB       PHE   3   5.718   0.199  -7.562
   27    HD1  PHE   3           HD1      PHE   3   6.784  -1.810  -7.805
   28    HD2  PHE   3           HD2      PHE   3   5.175  -0.782  -4.000
   29    HE1  PHE   3           HE1      PHE   3   7.668  -3.907  -6.869
   30    HE2  PHE   3           HE2      PHE   3   6.058  -2.877  -3.058
   31    HZ   PHE   3           HZ       PHE   3   7.306  -4.442  -4.492
   32    H    LYS   4           H        LYS   4   7.393   1.903  -7.690
   33    HA   LYS   4           HA       LYS   4   6.089   4.474  -8.298
   34    HB2  LYS   4          2HB       LYS   4   8.919   3.710  -9.012
   35    HB3  LYS   4          3HB       LYS   4   8.189   5.309  -9.071
   36    HG2  LYS   4          2HG       LYS   4   9.124   5.645  -7.084
   37    HG3  LYS   4          3HG       LYS   4   7.871   4.583  -6.439
   38    HD2  LYS   4          2HD       LYS   4   9.813   3.622  -5.618
   39    HD3  LYS   4          3HD       LYS   4   9.511   2.676  -7.077
   40    HE2  LYS   4          2HE       LYS   4  11.066   5.001  -7.717
   41    HE3  LYS   4          3HE       LYS   4  11.829   4.114  -6.399
   42    HZ1  LYS   4          1HZ       LYS   4  12.527   3.402  -8.656
   43    HZ2  LYS   4          2HZ       LYS   4  10.951   2.857  -8.939
   44    HZ3  LYS   4          3HZ       LYS   4  11.883   2.151  -7.717
   45    H    PHE   5           H        PHE   5   7.220   1.437  -9.570
   46    HA   PHE   5           HA       PHE   5   6.697   2.206 -12.320
   47    HB2  PHE   5          2HB       PHE   5   7.577  -0.411 -11.088
   48    HB3  PHE   5          3HB       PHE   5   7.354  -0.159 -12.816
   49    HD1  PHE   5           HD1      PHE   5   8.884   1.255 -14.075
   50    HD2  PHE   5           HD2      PHE   5   9.465   0.505  -9.926
   51    HE1  PHE   5           HE1      PHE   5  11.194   2.083 -14.253
   52    HE2  PHE   5           HE2      PHE   5  11.776   1.333 -10.097
   53    HZ   PHE   5           HZ       PHE   5  12.643   2.124 -12.262
   54    H    ASN   6           H        ASN   6   5.217   0.331  -9.758
   55    HA   ASN   6           HA       ASN   6   3.332  -1.129 -11.149
   56    HB2  ASN   6          2HB       ASN   6   3.584  -0.077  -8.410
   57    HB3  ASN   6          3HB       ASN   6   1.929  -0.400  -8.920
   58   HD21  ASN   6          1HD2      ASN   6   1.529  -2.172  -7.720
   59   HD22  ASN   6          2HD2      ASN   6   2.380  -3.667  -7.879
   60    HA   PRO   7           HA       PRO   7   0.375   1.633 -12.845
   61    HB2  PRO   7          2HB       PRO   7  -1.969   0.350 -12.367
   62    HB3  PRO   7          3HB       PRO   7  -0.795  -0.209 -13.564
   63    HG2  PRO   7          2HG       PRO   7  -1.254  -1.172 -10.767
   64    HG3  PRO   7          3HG       PRO   7  -0.964  -2.114 -12.241
   65    HD2  PRO   7          2HD       PRO   7   0.981  -1.618 -10.423
   66    HD3  PRO   7          3HD       PRO   7   1.314  -1.776 -12.160
   67    H    THR   8           H        THR   8  -0.261   0.548  -9.547
   68    HA   THR   8           HA       THR   8  -2.264   2.367  -8.857
   69    HB   THR   8           HB       THR   8  -1.442   0.381  -7.492
   70    HG1  THR   8           HG1      THR   8  -2.882   2.191  -6.773
   71   HG21  THR   8          1HG2      THR   8   0.948   1.045  -7.491
   72   HG22  THR   8          2HG2      THR   8   0.309   0.779  -5.869
   73   HG23  THR   8          3HG2      THR   8   0.536   2.421  -6.470
   74    H    GLY   9           H        GLY   9   1.074   2.874  -9.454
   75    HA2  GLY   9          2HA       GLY   9   1.738   5.010  -7.834
   76    HA3  GLY   9          3HA       GLY   9   2.333   4.795  -9.474
   77    H    THR  10           H        THR  10  -0.092   5.065 -10.865
   78    HA   THR  10           HA       THR  10  -0.304   7.921 -10.913
   79    HB   THR  10           HB       THR  10  -1.931   5.873 -12.431
   80    HG1  THR  10           HG1      THR  10  -0.401   6.372 -14.113
   81   HG21  THR  10          1HG2      THR  10  -2.319   8.624 -12.174
   82   HG22  THR  10          2HG2      THR  10  -3.012   7.567 -13.405
   83   HG23  THR  10          3HG2      THR  10  -1.504   8.423 -13.724
   84    H    ILE  11           H        ILE  11  -2.605   5.289 -10.230
   85    HA   ILE  11           HA       ILE  11  -4.828   6.829  -9.623
   86    HB   ILE  11           HB       ILE  11  -4.005   4.206  -8.372
   87   HG12  ILE  11          2HG1      ILE  11  -6.053   3.726 -10.153
   88   HG13  ILE  11          3HG1      ILE  11  -5.112   4.965 -10.977
   89   HG21  ILE  11          1HG2      ILE  11  -6.394   3.931  -7.864
   90   HG22  ILE  11          2HG2      ILE  11  -5.689   5.311  -7.024
   91   HG23  ILE  11          3HG2      ILE  11  -6.694   5.567  -8.450
   92   HD11  ILE  11          1HD1      ILE  11  -4.101   3.075 -11.749
   93   HD12  ILE  11          2HD1      ILE  11  -3.104   3.407 -10.332
   94   HD13  ILE  11          3HD1      ILE  11  -4.371   2.183 -10.253
   95    H    VAL  12           H        VAL  12  -2.426   5.522  -7.331
   96    HA   VAL  12           HA       VAL  12  -3.415   6.669  -5.012
   97    HB   VAL  12           HB       VAL  12  -0.535   6.136  -5.749
   98   HG11  VAL  12          1HG1      VAL  12  -0.132   6.119  -3.312
   99   HG12  VAL  12          2HG1      VAL  12  -0.620   7.705  -3.911
  100   HG13  VAL  12          3HG1      VAL  12  -1.781   6.687  -3.058
  101   HG21  VAL  12          1HG2      VAL  12  -2.472   4.305  -5.574
  102   HG22  VAL  12          2HG2      VAL  12  -0.815   3.992  -5.057
  103   HG23  VAL  12          3HG2      VAL  12  -2.045   4.420  -3.867
  104    H    LYS  13           H        LYS  13  -1.533   8.103  -7.581
  105    HA   LYS  13           HA       LYS  13  -0.871  10.488  -6.130
  106    HB2  LYS  13          2HB       LYS  13   0.529  10.815  -7.839
  107    HB3  LYS  13          3HB       LYS  13  -0.042   9.297  -8.519
  108    HG2  LYS  13          2HG       LYS  13  -1.768  10.503  -9.760
  109    HG3  LYS  13          3HG       LYS  13  -1.189  12.025  -9.080
  110    HD2  LYS  13          2HD       LYS  13   0.416  10.146 -10.814
  111    HD3  LYS  13          3HD       LYS  13  -0.328  11.656 -11.346
  112    HE2  LYS  13          2HE       LYS  13   1.060  12.661  -9.353
  113    HE3  LYS  13          3HE       LYS  13   2.038  11.213  -9.586
  114    HZ1  LYS  13          1HZ       LYS  13   3.073  12.369 -11.159
  115    HZ2  LYS  13          2HZ       LYS  13   1.896  13.584 -11.179
  116    HZ3  LYS  13          3HZ       LYS  13   1.683  12.185 -12.106
  117    H    LYS  14           H        LYS  14  -3.426   9.473  -8.305
  118    HA   LYS  14           HA       LYS  14  -4.527  12.105  -8.628
  119    HB2  LYS  14          2HB       LYS  14  -5.647   9.366  -9.243
  120    HB3  LYS  14          3HB       LYS  14  -6.451  10.876  -9.653
  121    HG2  LYS  14          2HG       LYS  14  -3.801   9.903 -10.695
  122    HG3  LYS  14          3HG       LYS  14  -5.318  10.025 -11.589
  123    HD2  LYS  14          2HD       LYS  14  -5.285  12.475 -11.223
  124    HD3  LYS  14          3HD       LYS  14  -3.712  12.307 -10.439
  125    HE2  LYS  14          2HE       LYS  14  -3.027  12.809 -12.557
  126    HE3  LYS  14          3HE       LYS  14  -3.126  11.054 -12.693
  127    HZ1  LYS  14          1HZ       LYS  14  -4.686  11.242 -14.237
  128    HZ2  LYS  14          2HZ       LYS  14  -4.427  12.913 -14.253
  129    HZ3  LYS  14          3HZ       LYS  14  -5.633  12.253 -13.266
  130    H    LEU  15           H        LEU  15  -5.469   9.201  -6.802
  131    HA   LEU  15           HA       LEU  15  -7.773  10.212  -5.613
  132    HB2  LEU  15          2HB       LEU  15  -5.806   8.095  -4.877
  133    HB3  LEU  15          3HB       LEU  15  -7.038   8.565  -3.707
  134    HG   LEU  15           HG       LEU  15  -7.497   6.533  -5.195
  135   HD11  LEU  15          1HD1      LEU  15  -9.629   6.819  -4.619
  136   HD12  LEU  15          2HD1      LEU  15  -9.793   8.262  -5.620
  137   HD13  LEU  15          3HD1      LEU  15  -9.136   8.391  -3.989
  138   HD21  LEU  15          1HD2      LEU  15  -8.087   8.725  -7.182
  139   HD22  LEU  15          2HD2      LEU  15  -8.441   7.009  -7.383
  140   HD23  LEU  15          3HD2      LEU  15  -6.767   7.561  -7.300
  141    H    THR  16           H        THR  16  -4.406  10.670  -4.793
  142    HA   THR  16           HA       THR  16  -4.885  11.816  -2.217
  143    HB   THR  16           HB       THR  16  -2.444  11.984  -3.995
  144    HG1  THR  16           HG1      THR  16  -1.728  10.416  -2.296
  145   HG21  THR  16          1HG2      THR  16  -3.106  13.267  -1.471
  146   HG22  THR  16          2HG2      THR  16  -1.748  13.554  -2.560
  147   HG23  THR  16          3HG2      THR  16  -1.657  12.270  -1.355
  148    H    GLN  17           H        GLN  17  -4.722  13.026  -5.480
  149    HA   GLN  17           HA       GLN  17  -4.217  15.719  -5.044
  150    HB2  GLN  17          2HB       GLN  17  -4.551  14.382  -7.254
  151    HB3  GLN  17          3HB       GLN  17  -6.241  14.834  -7.075
  152    HG2  GLN  17          2HG       GLN  17  -5.829  17.063  -7.431
  153    HG3  GLN  17          3HG       GLN  17  -4.148  16.945  -6.911
  154   HE21  GLN  17          1HE2      GLN  17  -2.612  16.054  -8.348
  155   HE22  GLN  17          2HE2      GLN  17  -2.893  16.038 -10.052
  156    H    TYR  18           H        TYR  18  -7.053  13.855  -4.360
  157    HA   TYR  18           HA       TYR  18  -8.662  16.252  -3.908
  158    HB2  TYR  18          2HB       TYR  18  -9.399  13.323  -3.754
  159    HB3  TYR  18          3HB       TYR  18 -10.519  14.661  -3.527
  160    HD1  TYR  18           HD1      TYR  18 -11.632  15.583  -5.360
  161    HD2  TYR  18           HD2      TYR  18  -8.191  13.169  -6.019
  162    HE1  TYR  18           HE1      TYR  18 -12.065  15.637  -7.781
  163    HE2  TYR  18           HE2      TYR  18  -8.614  13.217  -8.441
  164    HH   TYR  18           HH       TYR  18 -10.368  15.320  -9.961
  165    H    GLU  19           H        GLU  19  -6.957  13.756  -2.194
  166    HA   GLU  19           HA       GLU  19  -8.198  14.189   0.341
  167    HB2  GLU  19          2HB       GLU  19  -5.547  12.908  -0.346
  168    HB3  GLU  19          3HB       GLU  19  -6.321  12.848   1.231
  169    HG2  GLU  19          2HG       GLU  19  -7.635  11.802  -1.256
  170    HG3  GLU  19          3HG       GLU  19  -6.583  10.815  -0.242
  171    H    ILE  20           H        ILE  20  -5.329  15.434  -1.274
  172    HA   ILE  20           HA       ILE  20  -4.051  16.686   0.836
  173    HB   ILE  20           HB       ILE  20  -4.290  17.707  -1.997
  174   HG12  ILE  20          2HG1      ILE  20  -1.844  16.331  -1.068
  175   HG13  ILE  20          3HG1      ILE  20  -3.269  15.311  -1.238
  176   HG21  ILE  20          1HG2      ILE  20  -1.804  18.371  -0.874
  177   HG22  ILE  20          2HG2      ILE  20  -3.119  19.461  -1.309
  178   HG23  ILE  20          3HG2      ILE  20  -3.022  18.806   0.325
  179   HD11  ILE  20          1HD1      ILE  20  -2.702  15.125  -3.373
  180   HD12  ILE  20          2HD1      ILE  20  -3.251  16.791  -3.561
  181   HD13  ILE  20          3HD1      ILE  20  -1.547  16.453  -3.263
  182    H    ALA  21           H        ALA  21  -6.905  17.667  -0.935
  183    HA   ALA  21           HA       ALA  21  -7.100  20.341  -0.295
  184    HB1  ALA  21          1HB       ALA  21  -9.381  18.370  -0.369
  185    HB2  ALA  21          2HB       ALA  21  -9.494  20.118  -0.576
  186    HB3  ALA  21          3HB       ALA  21  -8.655  19.140  -1.780
  187    H    TRP  22           H        TRP  22  -8.108  17.552   1.655
  188    HA   TRP  22           HA       TRP  22  -9.324  18.856   3.761
  189    HB2  TRP  22          2HB       TRP  22  -9.327  16.430   3.566
  190    HB3  TRP  22          3HB       TRP  22  -7.588  16.380   3.842
  191    HD1  TRP  22           HD1      TRP  22  -6.732  16.826   6.358
  192    HE1  TRP  22           HE1      TRP  22  -7.929  16.603   8.625
  193    HE3  TRP  22           HE3      TRP  22 -11.570  16.709   4.712
  194    HZ2  TRP  22           HZ2      TRP  22 -10.575  16.403   9.588
  195    HZ3  TRP  22           HZ3      TRP  22 -13.376  16.500   6.371
  196    HH2  TRP  22           HH2      TRP  22 -12.886  16.349   8.758
  197    H    PHE  23           H        PHE  23  -5.874  18.194   3.284
  198    HA   PHE  23           HA       PHE  23  -5.104  19.426   5.755
  199    HB2  PHE  23          2HB       PHE  23  -3.599  17.785   5.038
  200    HB3  PHE  23          3HB       PHE  23  -3.619  18.359   3.374
  201    HD1  PHE  23           HD1      PHE  23  -2.409  19.131   6.779
  202    HD2  PHE  23           HD2      PHE  23  -2.060  19.946   2.616
  203    HE1  PHE  23           HE1      PHE  23  -0.360  20.423   7.207
  204    HE2  PHE  23           HE2      PHE  23  -0.010  21.239   3.037
  205    HZ   PHE  23           HZ       PHE  23   0.844  21.478   5.335
  206    H    LYS  24           H        LYS  24  -5.518  20.460   2.456
  207    HA   LYS  24           HA       LYS  24  -4.008  22.826   2.516
  208    HB2  LYS  24          2HB       LYS  24  -4.874  21.850   0.441
  209    HB3  LYS  24          3HB       LYS  24  -6.520  22.203   0.950
  210    HG2  LYS  24          2HG       LYS  24  -6.176  23.988  -0.399
  211    HG3  LYS  24          3HG       LYS  24  -5.542  24.663   1.104
  212    HD2  LYS  24          2HD       LYS  24  -3.273  23.782   0.353
  213    HD3  LYS  24          3HD       LYS  24  -4.015  23.535  -1.230
  214    HE2  LYS  24          2HE       LYS  24  -4.044  26.175   0.218
  215    HE3  LYS  24          3HE       LYS  24  -2.781  25.713  -0.921
  216    HZ1  LYS  24          1HZ       LYS  24  -4.445  25.493  -2.644
  217    HZ2  LYS  24          2HZ       LYS  24  -4.514  27.043  -1.971
  218    HZ3  LYS  24          3HZ       LYS  24  -5.678  25.888  -1.554
  219    H    ASN  25           H        ASN  25  -7.170  22.053   3.758
  220    HA   ASN  25           HA       ASN  25  -7.950  24.792   4.170
  221    HB2  ASN  25          2HB       ASN  25  -9.113  22.146   5.030
  222    HB3  ASN  25          3HB       ASN  25  -9.792  23.682   5.562
  223   HD21  ASN  25          1HD2      ASN  25  -9.774  21.340   3.164
  224   HD22  ASN  25          2HD2      ASN  25 -10.681  22.193   1.966
  225    H    LYS  26           H        LYS  26  -5.884  22.662   5.743
  226    HA   LYS  26           HA       LYS  26  -6.301  23.821   8.389
  227    HB2  LYS  26          2HB       LYS  26  -4.206  21.794   7.625
  228    HB3  LYS  26          3HB       LYS  26  -4.857  22.130   9.224
  229    HG2  LYS  26          2HG       LYS  26  -6.433  20.940   6.951
  230    HG3  LYS  26          3HG       LYS  26  -5.674  20.014   8.248
  231    HD2  LYS  26          2HD       LYS  26  -7.138  20.827   9.856
  232    HD3  LYS  26          3HD       LYS  26  -7.566  22.243   8.892
  233    HE2  LYS  26          2HE       LYS  26  -9.231  21.162   7.867
  234    HE3  LYS  26          3HE       LYS  26  -8.232  19.741   7.568
  235    HZ1  LYS  26          1HZ       LYS  26  -9.706  18.840   9.005
  236    HZ2  LYS  26          2HZ       LYS  26 -10.046  20.304   9.779
  237    HZ3  LYS  26          3HZ       LYS  26  -8.631  19.457  10.156
  238    H    HIS  27           H        HIS  27  -4.060  23.903   5.714
  239    HA   HIS  27           HA       HIS  27  -2.663  26.125   7.011
  240    HB2  HIS  27          2HB       HIS  27  -1.225  23.849   5.632
  241    HB3  HIS  27          3HB       HIS  27  -0.478  25.266   6.363
  242    HD1  HIS  27           HD1      HIS  27  -2.314  22.109   7.304
  243    HD2  HIS  27           HD2      HIS  27  -0.015  25.085   9.070
  244    HE1  HIS  27           HE1      HIS  27  -1.855  21.305   9.642
  245    H    GLY  28           H        GLY  28  -3.065  24.236   4.025
  246    HA2  GLY  28          2HA       GLY  28  -3.801  25.218   1.985
  247    HA3  GLY  28          3HA       GLY  28  -3.185  26.767   2.543
  248    H    TYR  29           H        TYR  29  -1.289  23.860   2.832
  249    HA   TYR  29           HA       TYR  29   0.393  24.765   0.589
  250    HB2  TYR  29          2HB       TYR  29   1.202  23.917   3.359
  251    HB3  TYR  29          3HB       TYR  29   2.323  23.799   2.007
  252    HD1  TYR  29           HD1      TYR  29   3.686  25.608   1.533
  253    HD2  TYR  29           HD2      TYR  29   0.059  26.270   3.657
  254    HE1  TYR  29           HE1      TYR  29   4.297  27.972   1.828
  255    HE2  TYR  29           HE2      TYR  29   0.660  28.636   3.957
  256    HH   TYR  29           HH       TYR  29   2.100  30.252   3.426
  257    H    TYR  30           H        TYR  30   2.205  22.802   0.424
  258    HA   TYR  30           HA       TYR  30   0.839  20.230   0.450
  259    HB2  TYR  30          2HB       TYR  30   2.139  21.075  -2.117
  260    HB3  TYR  30          3HB       TYR  30   0.938  19.818  -1.841
  261    HD1  TYR  30           HD1      TYR  30  -1.388  20.295  -1.957
  262    HD2  TYR  30           HD2      TYR  30   1.441  23.470  -2.103
  263    HE1  TYR  30           HE1      TYR  30  -3.173  21.847  -2.632
  264    HE2  TYR  30           HE2      TYR  30  -0.336  25.030  -2.777
  265    HH   TYR  30           HH       TYR  30  -2.910  24.433  -4.082
  266    HA   PRO  31           HA       PRO  31   5.534  19.587  -0.498
  267    HB2  PRO  31          2HB       PRO  31   7.076  21.811  -0.708
  268    HB3  PRO  31          3HB       PRO  31   6.254  21.078  -2.091
  269    HG2  PRO  31          2HG       PRO  31   5.442  23.437  -0.437
  270    HG3  PRO  31          3HG       PRO  31   5.385  23.232  -2.197
  271    HD2  PRO  31          2HD       PRO  31   3.198  22.951  -0.625
  272    HD3  PRO  31          3HD       PRO  31   3.427  22.017  -2.118
  273    H    TRP  32           H        TRP  32   7.761  20.536   0.652
  274    HA   TRP  32           HA       TRP  32   7.120  20.399   3.464
  275    HB2  TRP  32          2HB       TRP  32   9.375  19.914   3.822
  276    HB3  TRP  32          3HB       TRP  32   9.081  19.237   2.223
  277    HD1  TRP  32           HD1      TRP  32  11.124  21.856   4.021
  278    HE1  TRP  32           HE1      TRP  32  12.748  22.960   2.358
  279    HE3  TRP  32           HE3      TRP  32   9.271  19.917  -0.332
  280    HZ2  TRP  32           HZ2      TRP  32  13.186  23.004  -0.430
  281    HZ3  TRP  32           HZ3      TRP  32  10.350  20.540  -2.453
  282    HH2  TRP  32           HH2      TRP  32  12.267  22.052  -2.499
  283    H    GLU  33           H        GLU  33   7.039  22.875   1.404
  284    HA   GLU  33           HA       GLU  33   8.476  24.833   2.991
  285    HB2  GLU  33          2HB       GLU  33   6.643  25.378   0.659
  286    HB3  GLU  33          3HB       GLU  33   7.921  26.408   1.289
  287    HG2  GLU  33          2HG       GLU  33   9.607  24.898   0.499
  288    HG3  GLU  33          3HG       GLU  33   8.386  23.724   0.013
  289    H    ILE  34           H        ILE  34   6.609  23.647   4.566
  290    HA   ILE  34           HA       ILE  34   4.276  25.407   4.636
  291    HB   ILE  34           HB       ILE  34   4.917  22.994   6.337
  292   HG12  ILE  34          2HG1      ILE  34   2.719  23.044   4.322
  293   HG13  ILE  34          3HG1      ILE  34   4.368  22.860   3.735
  294   HG21  ILE  34          1HG2      ILE  34   3.444  24.651   7.425
  295   HG22  ILE  34          2HG2      ILE  34   2.331  24.519   6.064
  296   HG23  ILE  34          3HG2      ILE  34   2.629  23.122   7.098
  297   HD11  ILE  34          1HD1      ILE  34   3.049  20.743   4.163
  298   HD12  ILE  34          2HD1      ILE  34   4.658  20.836   4.881
  299   HD13  ILE  34          3HD1      ILE  34   3.230  21.102   5.880
  300    HA   PRO  35           HA       PRO  35   6.126  27.977   7.724
  301    HB2  PRO  35          2HB       PRO  35   3.868  29.269   8.500
  302    HB3  PRO  35          3HB       PRO  35   4.700  29.617   6.979
  303    HG2  PRO  35          2HG       PRO  35   2.282  27.922   7.470
  304    HG3  PRO  35          3HG       PRO  35   2.584  29.091   6.172
  305    HD2  PRO  35          2HD       PRO  35   2.849  26.420   5.817
  306    HD3  PRO  35          3HD       PRO  35   3.854  27.602   4.955
  307    H    ARG  36           H        ARG  36   5.176  28.781  10.045
  308    HA   ARG  36           HA       ARG  36   4.606  26.293  11.511
  309    HB2  ARG  36          2HB       ARG  36   5.688  27.363  13.443
  310    HB3  ARG  36          3HB       ARG  36   6.772  27.262  12.062
  311    HG2  ARG  36          2HG       ARG  36   5.277  29.757  12.149
  312    HG3  ARG  36          3HG       ARG  36   6.286  29.497  13.573
  313    HD2  ARG  36          2HD       ARG  36   8.247  29.392  12.312
  314    HD3  ARG  36          3HD       ARG  36   7.373  29.080  10.812
  315    HE   ARG  36           HE       ARG  36   6.540  31.561  11.566
  316   HH11  ARG  36          1HH1      ARG  36   9.645  30.089  11.006
  317   HH12  ARG  36          2HH1      ARG  36  10.395  31.562  10.487
  318   HH21  ARG  36          1HH2      ARG  36   7.517  33.507  10.885
  319   HH22  ARG  36          2HH2      ARG  36   9.184  33.506  10.420
  320    H    CYS  37           H        CYS  37   3.299  26.484  13.463
  321    HA   CYS  37           HA       CYS  37   0.862  27.777  13.006
  322    HB2  CYS  37          2HB       CYS  37   2.048  26.145  15.113
  323    HB3  CYS  37          3HB       CYS  37   0.933  27.350  15.745
  324    HG   CYS  37           HG       CYS  37  -0.942  25.578  15.506
  Start of MODEL   17
    1    H    MET   1           H        MET   1   7.754  -1.698   0.418
    2    HA   MET   1           HA       MET   1   5.883  -1.233  -1.067
    3    HB2  MET   1          2HB       MET   1   4.420   0.114   0.473
    4    HB3  MET   1          3HB       MET   1   5.197  -1.276   1.218
    5    HG2  MET   1          2HG       MET   1   6.543   0.001   2.537
    6    HG3  MET   1          3HG       MET   1   6.569   1.346   1.398
    7    HE1  MET   1          1HE       MET   1   4.630   0.130   4.817
    8    HE2  MET   1          2HE       MET   1   3.042   0.209   4.055
    9    HE3  MET   1          3HE       MET   1   4.289  -0.844   3.386
   10    H    LYS   2           H        LYS   2   4.305   0.835  -1.379
   11    HA   LYS   2           HA       LYS   2   3.971   2.689  -2.658
   12    HB2  LYS   2          2HB       LYS   2   6.478   3.667  -1.280
   13    HB3  LYS   2          3HB       LYS   2   5.273   4.669  -2.077
   14    HG2  LYS   2          2HG       LYS   2   3.650   4.197  -0.423
   15    HG3  LYS   2          3HG       LYS   2   4.632   2.904   0.269
   16    HD2  LYS   2          2HD       LYS   2   5.920   4.338   1.445
   17    HD3  LYS   2          3HD       LYS   2   5.918   5.551   0.163
   18    HE2  LYS   2          2HE       LYS   2   4.762   6.430   2.083
   19    HE3  LYS   2          3HE       LYS   2   3.598   6.146   0.790
   20    HZ1  LYS   2          1HZ       LYS   2   3.836   4.867   3.380
   21    HZ2  LYS   2          2HZ       LYS   2   3.495   3.822   2.094
   22    HZ3  LYS   2          3HZ       LYS   2   2.466   5.125   2.420
   23    H    PHE   3           H        PHE   3   4.736   1.026  -4.365
   24    HA   PHE   3           HA       PHE   3   7.287   1.337  -5.550
   25    HB2  PHE   3          2HB       PHE   3   4.702   0.085  -6.391
   26    HB3  PHE   3          3HB       PHE   3   5.972   0.314  -7.589
   27    HD1  PHE   3           HD1      PHE   3   7.030  -1.669  -8.027
   28    HD2  PHE   3           HD2      PHE   3   5.978  -0.741  -4.008
   29    HE1  PHE   3           HE1      PHE   3   8.120  -3.740  -7.267
   30    HE2  PHE   3           HE2      PHE   3   7.067  -2.809  -3.242
   31    HZ   PHE   3           HZ       PHE   3   8.141  -4.312  -4.872
   32    H    LYS   4           H        LYS   4   7.608   2.103  -7.820
   33    HA   LYS   4           HA       LYS   4   6.088   4.586  -8.280
   34    HB2  LYS   4          2HB       LYS   4   8.945   4.063  -9.106
   35    HB3  LYS   4          3HB       LYS   4   8.081   5.593  -9.168
   36    HG2  LYS   4          2HG       LYS   4   9.056   6.036  -7.219
   37    HG3  LYS   4          3HG       LYS   4   7.893   4.907  -6.520
   38    HD2  LYS   4          2HD       LYS   4   9.658   3.108  -7.181
   39    HD3  LYS   4          3HD       LYS   4  10.769   4.479  -7.224
   40    HE2  LYS   4          2HE       LYS   4  10.809   4.661  -4.989
   41    HE3  LYS   4          3HE       LYS   4   9.070   4.409  -4.846
   42    HZ1  LYS   4          1HZ       LYS   4  11.243   2.455  -4.776
   43    HZ2  LYS   4          2HZ       LYS   4   9.777   1.966  -5.462
   44    HZ3  LYS   4          3HZ       LYS   4   9.820   2.520  -3.865
   45    H    PHE   5           H        PHE   5   7.301   1.643  -9.637
   46    HA   PHE   5           HA       PHE   5   6.688   2.418 -12.365
   47    HB2  PHE   5          2HB       PHE   5   7.521  -0.278 -11.275
   48    HB3  PHE   5          3HB       PHE   5   7.480   0.193 -12.971
   49    HD1  PHE   5           HD1      PHE   5   8.971   2.188 -13.650
   50    HD2  PHE   5           HD2      PHE   5   9.467  -0.034 -10.053
   51    HE1  PHE   5           HE1      PHE   5  11.296   2.975 -13.488
   52    HE2  PHE   5           HE2      PHE   5  11.793   0.751  -9.886
   53    HZ   PHE   5           HZ       PHE   5  12.710   2.258 -11.604
   54    H    ASN   6           H        ASN   6   5.293   0.525  -9.774
   55    HA   ASN   6           HA       ASN   6   3.409  -0.979 -11.114
   56    HB2  ASN   6          2HB       ASN   6   3.531   0.244  -8.395
   57    HB3  ASN   6          3HB       ASN   6   1.996  -0.434  -8.930
   58   HD21  ASN   6          1HD2      ASN   6   2.678  -2.611 -10.320
   59   HD22  ASN   6          2HD2      ASN   6   3.520  -3.743  -9.322
   60    HA   PRO   7           HA       PRO   7   0.381   1.710 -12.800
   61    HB2  PRO   7          2HB       PRO   7  -1.934   0.393 -12.273
   62    HB3  PRO   7          3HB       PRO   7  -0.767  -0.161 -13.480
   63    HG2  PRO   7          2HG       PRO   7  -1.169  -1.097 -10.665
   64    HG3  PRO   7          3HG       PRO   7  -0.884  -2.052 -12.132
   65    HD2  PRO   7          2HD       PRO   7   1.078  -1.499 -10.349
   66    HD3  PRO   7          3HD       PRO   7   1.389  -1.673 -12.088
   67    H    THR   8           H        THR   8  -0.190   0.655  -9.481
   68    HA   THR   8           HA       THR   8  -2.214   2.448  -8.784
   69    HB   THR   8           HB       THR   8  -1.338   0.493  -7.407
   70    HG1  THR   8           HG1      THR   8  -2.489   1.390  -5.876
   71   HG21  THR   8          1HG2      THR   8   0.429   0.941  -5.814
   72   HG22  THR   8          2HG2      THR   8   0.618   2.580  -6.438
   73   HG23  THR   8          3HG2      THR   8   1.039   1.197  -7.448
   74    H    GLY   9           H        GLY   9   1.106   3.004  -9.435
   75    HA2  GLY   9          2HA       GLY   9   1.755   5.171  -7.851
   76    HA3  GLY   9          3HA       GLY   9   2.330   4.947  -9.497
   77    H    THR  10           H        THR  10  -0.118   5.157 -10.855
   78    HA   THR  10           HA       THR  10  -0.380   8.009 -10.935
   79    HB   THR  10           HB       THR  10  -1.996   5.915 -12.403
   80    HG1  THR  10           HG1      THR  10  -0.223   5.677 -13.521
   81   HG21  THR  10          1HG2      THR  10  -2.428   8.660 -12.175
   82   HG22  THR  10          2HG2      THR  10  -3.113   7.579 -13.389
   83   HG23  THR  10          3HG2      THR  10  -1.623   8.458 -13.731
   84    H    ILE  11           H        ILE  11  -2.625   5.346 -10.186
   85    HA   ILE  11           HA       ILE  11  -4.866   6.854  -9.566
   86    HB   ILE  11           HB       ILE  11  -3.979   4.262  -8.294
   87   HG12  ILE  11          2HG1      ILE  11  -6.045   3.728 -10.041
   88   HG13  ILE  11          3HG1      ILE  11  -5.131   4.968 -10.893
   89   HG21  ILE  11          1HG2      ILE  11  -6.355   3.953  -7.748
   90   HG22  ILE  11          2HG2      ILE  11  -5.664   5.356  -6.936
   91   HG23  ILE  11          3HG2      ILE  11  -6.693   5.575  -8.352
   92   HD11  ILE  11          1HD1      ILE  11  -4.111   3.073 -11.651
   93   HD12  ILE  11          2HD1      ILE  11  -3.093   3.453 -10.262
   94   HD13  ILE  11          3HD1      ILE  11  -4.336   2.209 -10.130
   95    H    VAL  12           H        VAL  12  -2.408   5.619  -7.293
   96    HA   VAL  12           HA       VAL  12  -3.384   6.778  -4.974
   97    HB   VAL  12           HB       VAL  12  -0.505   6.285  -5.746
   98   HG11  VAL  12          1HG1      VAL  12  -0.067   6.306  -3.316
   99   HG12  VAL  12          2HG1      VAL  12  -0.591   7.876  -3.928
  100   HG13  VAL  12          3HG1      VAL  12  -1.722   6.849  -3.045
  101   HG21  VAL  12          1HG2      VAL  12  -1.482   4.473  -3.798
  102   HG22  VAL  12          2HG2      VAL  12  -2.654   4.531  -5.115
  103   HG23  VAL  12          3HG2      VAL  12  -0.969   4.133  -5.451
  104    H    LYS  13           H        LYS  13  -1.564   8.211  -7.588
  105    HA   LYS  13           HA       LYS  13  -0.923  10.625  -6.176
  106    HB2  LYS  13          2HB       LYS  13   0.446  10.955  -7.910
  107    HB3  LYS  13          3HB       LYS  13  -0.108   9.419  -8.563
  108    HG2  LYS  13          2HG       LYS  13  -1.873  10.579  -9.793
  109    HG3  LYS  13          3HG       LYS  13  -1.311  12.120  -9.141
  110    HD2  LYS  13          2HD       LYS  13   0.428  10.266 -10.760
  111    HD3  LYS  13          3HD       LYS  13  -0.518  11.578 -11.468
  112    HE2  LYS  13          2HE       LYS  13   1.074  12.433  -9.185
  113    HE3  LYS  13          3HE       LYS  13   2.055  11.764 -10.488
  114    HZ1  LYS  13          1HZ       LYS  13   0.493  13.320 -11.908
  115    HZ2  LYS  13          2HZ       LYS  13   1.908  13.901 -11.186
  116    HZ3  LYS  13          3HZ       LYS  13   0.409  14.177 -10.452
  117    H    LYS  14           H        LYS  14  -3.492   9.539  -8.301
  118    HA   LYS  14           HA       LYS  14  -4.643  12.148  -8.640
  119    HB2  LYS  14          2HB       LYS  14  -5.723   9.382  -9.205
  120    HB3  LYS  14          3HB       LYS  14  -6.560  10.872  -9.622
  121    HG2  LYS  14          2HG       LYS  14  -3.908   9.931 -10.690
  122    HG3  LYS  14          3HG       LYS  14  -5.440  10.017 -11.563
  123    HD2  LYS  14          2HD       LYS  14  -5.443  12.471 -11.227
  124    HD3  LYS  14          3HD       LYS  14  -3.856  12.340 -10.466
  125    HE2  LYS  14          2HE       LYS  14  -2.944  12.524 -12.484
  126    HE3  LYS  14          3HE       LYS  14  -3.649  10.961 -12.893
  127    HZ1  LYS  14          1HZ       LYS  14  -4.450  12.352 -14.535
  128    HZ2  LYS  14          2HZ       LYS  14  -4.671  13.661 -13.487
  129    HZ3  LYS  14          3HZ       LYS  14  -5.730  12.344 -13.429
  130    H    LEU  15           H        LEU  15  -5.507   9.251  -6.765
  131    HA   LEU  15           HA       LEU  15  -7.811  10.237  -5.555
  132    HB2  LEU  15          2HB       LEU  15  -5.797   8.164  -4.822
  133    HB3  LEU  15          3HB       LEU  15  -7.020   8.627  -3.640
  134    HG   LEU  15           HG       LEU  15  -7.466   6.569  -5.096
  135   HD11  LEU  15          1HD1      LEU  15  -9.229   8.746  -4.281
  136   HD12  LEU  15          2HD1      LEU  15  -9.386   7.006  -4.044
  137   HD13  LEU  15          3HD1      LEU  15  -9.895   7.738  -5.565
  138   HD21  LEU  15          1HD2      LEU  15  -8.449   7.002  -7.275
  139   HD22  LEU  15          2HD2      LEU  15  -6.784   7.581  -7.224
  140   HD23  LEU  15          3HD2      LEU  15  -8.121   8.726  -7.101
  141    H    THR  16           H        THR  16  -4.441  10.763  -4.790
  142    HA   THR  16           HA       THR  16  -4.902  11.933  -2.222
  143    HB   THR  16           HB       THR  16  -2.490  12.121  -4.038
  144    HG1  THR  16           HG1      THR  16  -1.738  10.598  -2.287
  145   HG21  THR  16          1HG2      THR  16  -1.664  12.455  -1.418
  146   HG22  THR  16          2HG2      THR  16  -3.137  13.419  -1.517
  147   HG23  THR  16          3HG2      THR  16  -1.807  13.724  -2.634
  148    H    GLN  17           H        GLN  17  -4.808  13.105  -5.501
  149    HA   GLN  17           HA       GLN  17  -4.344  15.811  -5.106
  150    HB2  GLN  17          2HB       GLN  17  -4.943  14.251  -7.261
  151    HB3  GLN  17          3HB       GLN  17  -6.424  15.186  -7.095
  152    HG2  GLN  17          2HG       GLN  17  -5.412  17.154  -7.627
  153    HG3  GLN  17          3HG       GLN  17  -3.843  16.644  -7.004
  154   HE21  GLN  17          1HE2      GLN  17  -2.465  15.466  -8.311
  155   HE22  GLN  17          2HE2      GLN  17  -2.701  15.320 -10.016
  156    H    TYR  18           H        TYR  18  -7.136  13.907  -4.358
  157    HA   TYR  18           HA       TYR  18  -8.781  16.281  -3.912
  158    HB2  TYR  18          2HB       TYR  18  -9.463  13.341  -3.710
  159    HB3  TYR  18          3HB       TYR  18 -10.604  14.662  -3.483
  160    HD1  TYR  18           HD1      TYR  18 -11.760  15.541  -5.312
  161    HD2  TYR  18           HD2      TYR  18  -8.285  13.181  -5.991
  162    HE1  TYR  18           HE1      TYR  18 -12.229  15.556  -7.726
  163    HE2  TYR  18           HE2      TYR  18  -8.744  13.191  -8.407
  164    HH   TYR  18           HH       TYR  18 -11.353  13.646  -9.781
  165    H    GLU  19           H        GLU  19  -7.008  13.836  -2.192
  166    HA   GLU  19           HA       GLU  19  -8.220  14.280   0.355
  167    HB2  GLU  19          2HB       GLU  19  -5.557  13.037  -0.355
  168    HB3  GLU  19          3HB       GLU  19  -6.306  12.984   1.235
  169    HG2  GLU  19          2HG       GLU  19  -7.633  11.879  -1.220
  170    HG3  GLU  19          3HG       GLU  19  -6.558  10.926  -0.199
  171    H    ILE  20           H        ILE  20  -5.395  15.553  -1.316
  172    HA   ILE  20           HA       ILE  20  -4.109  16.855   0.760
  173    HB   ILE  20           HB       ILE  20  -4.405  17.834  -2.082
  174   HG12  ILE  20          2HG1      ILE  20  -1.924  16.510  -1.168
  175   HG13  ILE  20          3HG1      ILE  20  -3.333  15.465  -1.308
  176   HG21  ILE  20          1HG2      ILE  20  -3.256  19.617  -1.432
  177   HG22  ILE  20          2HG2      ILE  20  -3.124  18.983   0.207
  178   HG23  ILE  20          3HG2      ILE  20  -1.915  18.555  -1.004
  179   HD11  ILE  20          1HD1      ILE  20  -3.342  16.949  -3.647
  180   HD12  ILE  20          2HD1      ILE  20  -1.643  16.566  -3.364
  181   HD13  ILE  20          3HD1      ILE  20  -2.836  15.270  -3.454
  182    H    ALA  21           H        ALA  21  -7.004  17.763  -0.984
  183    HA   ALA  21           HA       ALA  21  -7.236  20.442  -0.377
  184    HB1  ALA  21          1HB       ALA  21  -9.807  19.283  -0.062
  185    HB2  ALA  21          2HB       ALA  21  -9.146  20.133  -1.459
  186    HB3  ALA  21          3HB       ALA  21  -8.951  18.386  -1.317
  187    H    TRP  22           H        TRP  22  -8.170  17.662   1.623
  188    HA   TRP  22           HA       TRP  22  -9.379  18.974   3.729
  189    HB2  TRP  22          2HB       TRP  22  -9.379  16.564   3.610
  190    HB3  TRP  22          3HB       TRP  22  -7.625  16.512   3.767
  191    HD1  TRP  22           HD1      TRP  22  -6.605  17.095   6.221
  192    HE1  TRP  22           HE1      TRP  22  -7.641  16.851   8.564
  193    HE3  TRP  22           HE3      TRP  22 -11.526  16.697   4.894
  194    HZ2  TRP  22           HZ2      TRP  22 -10.205  16.531   9.700
  195    HZ3  TRP  22           HZ3      TRP  22 -13.208  16.424   6.670
  196    HH2  TRP  22           HH2      TRP  22 -12.559  16.342   9.022
  197    H    PHE  23           H        PHE  23  -5.925  18.364   3.212
  198    HA   PHE  23           HA       PHE  23  -5.142  19.642   5.656
  199    HB2  PHE  23          2HB       PHE  23  -3.620  18.017   4.940
  200    HB3  PHE  23          3HB       PHE  23  -3.672  18.568   3.269
  201    HD1  PHE  23           HD1      PHE  23  -2.151  20.170   2.469
  202    HD2  PHE  23           HD2      PHE  23  -2.430  19.406   6.647
  203    HE1  PHE  23           HE1      PHE  23  -0.117  21.502   2.845
  204    HE2  PHE  23           HE2      PHE  23  -0.396  20.737   7.030
  205    HZ   PHE  23           HZ       PHE  23   0.762  21.788   5.128
  206    H    LYS  24           H        LYS  24  -5.619  20.624   2.351
  207    HA   LYS  24           HA       LYS  24  -4.149  23.016   2.358
  208    HB2  LYS  24          2HB       LYS  24  -5.026  21.998   0.308
  209    HB3  LYS  24          3HB       LYS  24  -6.670  22.330   0.835
  210    HG2  LYS  24          2HG       LYS  24  -6.376  24.103  -0.541
  211    HG3  LYS  24          3HG       LYS  24  -5.733  24.808   0.943
  212    HD2  LYS  24          2HD       LYS  24  -3.460  23.955   0.171
  213    HD3  LYS  24          3HD       LYS  24  -4.221  23.675  -1.397
  214    HE2  LYS  24          2HE       LYS  24  -4.274  26.333   0.017
  215    HE3  LYS  24          3HE       LYS  24  -3.018  25.877  -1.132
  216    HZ1  LYS  24          1HZ       LYS  24  -4.602  25.720  -2.863
  217    HZ2  LYS  24          2HZ       LYS  24  -4.901  27.188  -2.079
  218    HZ3  LYS  24          3HZ       LYS  24  -5.907  25.858  -1.796
  219    H    ASN  25           H        ASN  25  -7.281  22.207   3.653
  220    HA   ASN  25           HA       ASN  25  -8.102  24.937   4.040
  221    HB2  ASN  25          2HB       ASN  25  -9.211  22.308   5.036
  222    HB3  ASN  25          3HB       ASN  25  -9.938  23.869   5.408
  223   HD21  ASN  25          1HD2      ASN  25 -10.082  21.292   3.398
  224   HD22  ASN  25          2HD2      ASN  25 -10.871  22.018   2.044
  225    H    LYS  26           H        LYS  26  -5.978  22.864   5.612
  226    HA   LYS  26           HA       LYS  26  -6.379  24.051   8.248
  227    HB2  LYS  26          2HB       LYS  26  -4.260  22.050   7.482
  228    HB3  LYS  26          3HB       LYS  26  -4.895  22.396   9.085
  229    HG2  LYS  26          2HG       LYS  26  -6.481  21.149   6.850
  230    HG3  LYS  26          3HG       LYS  26  -5.689  20.254   8.149
  231    HD2  LYS  26          2HD       LYS  26  -7.303  22.377   9.231
  232    HD3  LYS  26          3HD       LYS  26  -8.266  21.356   8.159
  233    HE2  LYS  26          2HE       LYS  26  -8.494  20.231  10.147
  234    HE3  LYS  26          3HE       LYS  26  -7.091  19.412   9.464
  235    HZ1  LYS  26          1HZ       LYS  26  -7.120  20.360  11.918
  236    HZ2  LYS  26          2HZ       LYS  26  -6.580  21.754  11.126
  237    HZ3  LYS  26          3HZ       LYS  26  -5.706  20.311  10.991
  238    H    HIS  27           H        HIS  27  -4.176  24.136   5.541
  239    HA   HIS  27           HA       HIS  27  -2.800  26.398   6.790
  240    HB2  HIS  27          2HB       HIS  27  -1.341  24.128   5.422
  241    HB3  HIS  27          3HB       HIS  27  -0.609  25.567   6.125
  242    HD1  HIS  27           HD1      HIS  27  -2.379  22.392   7.132
  243    HD2  HIS  27           HD2      HIS  27  -0.108  25.430   8.827
  244    HE1  HIS  27           HE1      HIS  27  -1.875  21.628   9.474
  245    H    GLY  28           H        GLY  28  -3.210  24.462   3.836
  246    HA2  GLY  28          2HA       GLY  28  -3.989  25.404   1.792
  247    HA3  GLY  28          3HA       GLY  28  -3.393  26.970   2.321
  248    H    TYR  29           H        TYR  29  -1.444  24.099   2.623
  249    HA   TYR  29           HA       TYR  29   0.192  25.002   0.345
  250    HB2  TYR  29          2HB       TYR  29   1.053  24.205   3.115
  251    HB3  TYR  29          3HB       TYR  29   2.158  24.088   1.750
  252    HD1  TYR  29           HD1      TYR  29  -0.127  26.542   3.397
  253    HD2  TYR  29           HD2      TYR  29   3.481  25.914   1.232
  254    HE1  TYR  29           HE1      TYR  29   0.437  28.922   3.659
  255    HE2  TYR  29           HE2      TYR  29   4.056  28.292   1.488
  256    HH   TYR  29           HH       TYR  29   2.784  30.461   1.871
  257    H    TYR  30           H        TYR  30   2.035  23.068   0.182
  258    HA   TYR  30           HA       TYR  30   0.713  20.474   0.260
  259    HB2  TYR  30          2HB       TYR  30   1.964  21.306  -2.335
  260    HB3  TYR  30          3HB       TYR  30   0.788  20.033  -2.026
  261    HD1  TYR  30           HD1      TYR  30  -1.547  20.469  -2.117
  262    HD2  TYR  30           HD2      TYR  30   1.226  23.688  -2.343
  263    HE1  TYR  30           HE1      TYR  30  -3.366  21.982  -2.788
  264    HE2  TYR  30           HE2      TYR  30  -0.586  25.210  -3.013
  265    HH   TYR  30           HH       TYR  30  -3.760  24.047  -3.815
  266    HA   PRO  31           HA       PRO  31   5.406  19.897  -0.743
  267    HB2  PRO  31          2HB       PRO  31   6.907  22.144  -1.003
  268    HB3  PRO  31          3HB       PRO  31   6.079  21.379  -2.365
  269    HG2  PRO  31          2HG       PRO  31   5.249  23.746  -0.731
  270    HG3  PRO  31          3HG       PRO  31   5.171  23.516  -2.488
  271    HD2  PRO  31          2HD       PRO  31   3.011  23.220  -0.883
  272    HD3  PRO  31          3HD       PRO  31   3.236  22.270  -2.365
  273    H    TRP  32           H        TRP  32   7.632  20.900   0.364
  274    HA   TRP  32           HA       TRP  32   7.031  20.789   3.186
  275    HB2  TRP  32          2HB       TRP  32   9.299  20.348   3.519
  276    HB3  TRP  32          3HB       TRP  32   8.995  19.645   1.933
  277    HD1  TRP  32           HD1      TRP  32  11.015  22.321   3.670
  278    HE1  TRP  32           HE1      TRP  32  12.599  23.431   1.971
  279    HE3  TRP  32           HE3      TRP  32   9.140  20.294  -0.632
  280    HZ2  TRP  32           HZ2      TRP  32  12.999  23.446  -0.823
  281    HZ3  TRP  32           HZ3      TRP  32  10.179  20.908  -2.776
  282    HH2  TRP  32           HH2      TRP  32  12.068  22.452  -2.867
  283    H    GLU  33           H        GLU  33   6.879  23.236   1.095
  284    HA   GLU  33           HA       GLU  33   8.304  25.239   2.636
  285    HB2  GLU  33          2HB       GLU  33   6.431  25.722   0.323
  286    HB3  GLU  33          3HB       GLU  33   7.699  26.781   0.922
  287    HG2  GLU  33          2HG       GLU  33   9.400  25.290   0.129
  288    HG3  GLU  33          3HG       GLU  33   8.193  24.089  -0.325
  289    H    ILE  34           H        ILE  34   6.478  24.043   4.252
  290    HA   ILE  34           HA       ILE  34   4.116  25.764   4.330
  291    HB   ILE  34           HB       ILE  34   4.822  23.385   6.054
  292   HG12  ILE  34          2HG1      ILE  34   2.596  23.369   4.070
  293   HG13  ILE  34          3HG1      ILE  34   4.240  23.208   3.462
  294   HG21  ILE  34          1HG2      ILE  34   3.335  25.032   7.140
  295   HG22  ILE  34          2HG2      ILE  34   2.206  24.861   5.796
  296   HG23  ILE  34          3HG2      ILE  34   2.543  23.484   6.845
  297   HD11  ILE  34          1HD1      ILE  34   2.783  21.114   4.104
  298   HD12  ILE  34          2HD1      ILE  34   4.524  21.151   4.389
  299   HD13  ILE  34          3HD1      ILE  34   3.407  21.469   5.715
  300    HA   PRO  35           HA       PRO  35   5.963  28.405   7.360
  301    HB2  PRO  35          2HB       PRO  35   3.693  29.669   8.148
  302    HB3  PRO  35          3HB       PRO  35   4.499  30.011   6.613
  303    HG2  PRO  35          2HG       PRO  35   2.118  28.281   7.158
  304    HG3  PRO  35          3HG       PRO  35   2.382  29.438   5.841
  305    HD2  PRO  35          2HD       PRO  35   2.688  26.768   5.517
  306    HD3  PRO  35          3HD       PRO  35   3.661  27.955   4.626
  307    H    ARG  36           H        ARG  36   5.023  29.226   9.682
  308    HA   ARG  36           HA       ARG  36   4.481  26.751  11.183
  309    HB2  ARG  36          2HB       ARG  36   5.777  29.235  12.296
  310    HB3  ARG  36          3HB       ARG  36   5.740  27.625  13.001
  311    HG2  ARG  36          2HG       ARG  36   7.231  28.445  10.517
  312    HG3  ARG  36          3HG       ARG  36   7.932  28.119  12.104
  313    HD2  ARG  36          2HD       ARG  36   6.494  26.149  10.330
  314    HD3  ARG  36          3HD       ARG  36   8.226  26.202  10.652
  315    HE   ARG  36           HE       ARG  36   6.758  25.951  13.064
  316   HH11  ARG  36          1HH1      ARG  36   7.815  24.150  10.278
  317   HH12  ARG  36          2HH1      ARG  36   7.822  22.626  11.103
  318   HH21  ARG  36          1HH2      ARG  36   6.763  23.951  14.161
  319   HH22  ARG  36          2HH2      ARG  36   7.223  22.514  13.312
  320    H    CYS  37           H        CYS  37   3.293  27.046  13.238
  321    HA   CYS  37           HA       CYS  37   0.864  28.435  12.793
  322    HB2  CYS  37          2HB       CYS  37   1.959  26.616  14.795
  323    HB3  CYS  37          3HB       CYS  37   0.911  27.841  15.501
  324    HG   CYS  37           HG       CYS  37  -0.847  25.858  15.187
  Start of MODEL   18
    1    H    MET   1           H        MET   1   6.957  -2.677  -0.045
    2    HA   MET   1           HA       MET   1   5.030  -1.677  -1.300
    3    HB2  MET   1          2HB       MET   1   5.852  -0.872   1.433
    4    HB3  MET   1          3HB       MET   1   4.557   0.062   0.696
    5    HG2  MET   1          2HG       MET   1   3.815  -2.532   0.183
    6    HG3  MET   1          3HG       MET   1   4.534  -2.629   1.789
    7    HE1  MET   1          1HE       MET   1   2.276  -0.897  -0.544
    8    HE2  MET   1          2HE       MET   1   0.771  -0.671   0.347
    9    HE3  MET   1          3HE       MET   1   2.026   0.567   0.407
   10    H    LYS   2           H        LYS   2   3.975   0.560  -1.513
   11    HA   LYS   2           HA       LYS   2   3.956   2.539  -2.639
   12    HB2  LYS   2          2HB       LYS   2   6.298   2.813  -0.789
   13    HB3  LYS   2          3HB       LYS   2   5.951   4.089  -1.949
   14    HG2  LYS   2          2HG       LYS   2   4.002   4.696  -0.911
   15    HG3  LYS   2          3HG       LYS   2   3.751   3.096  -0.207
   16    HD2  LYS   2          2HD       LYS   2   5.901   3.643   1.146
   17    HD3  LYS   2          3HD       LYS   2   5.539   5.315   0.712
   18    HE2  LYS   2          2HE       LYS   2   3.147   4.702   1.580
   19    HE3  LYS   2          3HE       LYS   2   4.003   3.419   2.434
   20    HZ1  LYS   2          1HZ       LYS   2   5.296   5.951   2.713
   21    HZ2  LYS   2          2HZ       LYS   2   4.791   4.864   3.906
   22    HZ3  LYS   2          3HZ       LYS   2   3.702   5.996   3.279
   23    H    PHE   3           H        PHE   3   4.532   0.910  -4.464
   24    HA   PHE   3           HA       PHE   3   7.161   1.105  -5.580
   25    HB2  PHE   3          2HB       PHE   3   4.565  -0.104  -6.447
   26    HB3  PHE   3          3HB       PHE   3   5.846   0.117  -7.635
   27    HD1  PHE   3           HD1      PHE   3   5.811  -0.966  -4.063
   28    HD2  PHE   3           HD2      PHE   3   6.882  -1.877  -8.081
   29    HE1  PHE   3           HE1      PHE   3   6.866  -3.056  -3.305
   30    HE2  PHE   3           HE2      PHE   3   7.937  -3.968  -7.329
   31    HZ   PHE   3           HZ       PHE   3   7.930  -4.560  -4.938
   32    H    LYS   4           H        LYS   4   7.509   1.884  -7.841
   33    HA   LYS   4           HA       LYS   4   6.027   4.392  -8.292
   34    HB2  LYS   4          2HB       LYS   4   8.886   3.829  -9.088
   35    HB3  LYS   4          3HB       LYS   4   8.044   5.371  -9.171
   36    HG2  LYS   4          2HG       LYS   4   9.007   5.806  -7.213
   37    HG3  LYS   4          3HG       LYS   4   7.807   4.711  -6.523
   38    HD2  LYS   4          2HD       LYS   4   9.520   2.858  -7.108
   39    HD3  LYS   4          3HD       LYS   4  10.677   4.188  -7.207
   40    HE2  LYS   4          2HE       LYS   4   8.910   3.718  -4.816
   41    HE3  LYS   4          3HE       LYS   4  10.517   3.012  -4.974
   42    HZ1  LYS   4          1HZ       LYS   4  11.073   4.906  -3.904
   43    HZ2  LYS   4          2HZ       LYS   4   9.743   5.777  -4.480
   44    HZ3  LYS   4          3HZ       LYS   4  11.091   5.537  -5.473
   45    H    PHE   5           H        PHE   5   7.208   1.442  -9.663
   46    HA   PHE   5           HA       PHE   5   6.625   2.247 -12.389
   47    HB2  PHE   5          2HB       PHE   5   7.414  -0.469 -11.314
   48    HB3  PHE   5          3HB       PHE   5   7.391   0.016 -13.007
   49    HD1  PHE   5           HD1      PHE   5   9.231   0.074  -9.897
   50    HD2  PHE   5           HD2      PHE   5   9.036   1.662 -13.841
   51    HE1  PHE   5           HE1      PHE   5  11.566   0.826  -9.706
   52    HE2  PHE   5           HE2      PHE   5  11.370   2.416 -13.657
   53    HZ   PHE   5           HZ       PHE   5  12.639   1.997 -11.588
   54    H    ASN   6           H        ASN   6   5.186   0.353  -9.823
   55    HA   ASN   6           HA       ASN   6   3.291  -1.114 -11.187
   56    HB2  ASN   6          2HB       ASN   6   3.411   0.086  -8.458
   57    HB3  ASN   6          3HB       ASN   6   1.871  -0.566  -9.009
   58   HD21  ASN   6          1HD2      ASN   6   2.533  -2.742 -10.411
   59   HD22  ASN   6          2HD2      ASN   6   3.352  -3.893  -9.416
   60    HA   PRO   7           HA       PRO   7   0.312   1.628 -12.874
   61    HB2  PRO   7          2HB       PRO   7  -2.024   0.339 -12.373
   62    HB3  PRO   7          3HB       PRO   7  -0.857  -0.221 -13.576
   63    HG2  PRO   7          2HG       PRO   7  -1.291  -1.173 -10.771
   64    HG3  PRO   7          3HG       PRO   7  -1.008  -2.121 -12.243
   65    HD2  PRO   7          2HD       PRO   7   0.948  -1.609 -10.443
   66    HD3  PRO   7          3HD       PRO   7   1.269  -1.773 -12.181
   67    H    THR   8           H        THR   8  -0.296   0.556  -9.567
   68    HA   THR   8           HA       THR   8  -2.300   2.371  -8.870
   69    HB   THR   8           HB       THR   8  -1.460   0.395  -7.502
   70    HG1  THR   8           HG1      THR   8  -2.067   1.452  -5.560
   71   HG21  THR   8          1HG2      THR   8   0.927   1.068  -7.522
   72   HG22  THR   8          2HG2      THR   8   0.301   0.808  -5.894
   73   HG23  THR   8          3HG2      THR   8   0.517   2.448  -6.504
   74    H    GLY   9           H        GLY   9   1.031   2.888  -9.495
   75    HA2  GLY   9          2HA       GLY   9   1.698   5.034  -7.891
   76    HA3  GLY   9          3HA       GLY   9   2.281   4.815  -9.534
   77    H    THR  10           H        THR  10  -0.156   5.068 -10.907
   78    HA   THR  10           HA       THR  10  -0.380   7.923 -10.967
   79    HB   THR  10           HB       THR  10  -2.011   5.861 -12.461
   80    HG1  THR  10           HG1      THR  10  -0.426   5.850 -13.913
   81   HG21  THR  10          1HG2      THR  10  -1.604   8.406 -13.772
   82   HG22  THR  10          2HG2      THR  10  -2.408   8.611 -12.215
   83   HG23  THR  10          3HG2      THR  10  -3.106   7.545 -13.434
   84    H    ILE  11           H        ILE  11  -2.664   5.284 -10.252
   85    HA   ILE  11           HA       ILE  11  -4.889   6.818  -9.635
   86    HB   ILE  11           HB       ILE  11  -4.045   4.206  -8.376
   87   HG12  ILE  11          2HG1      ILE  11  -6.105   3.711 -10.142
   88   HG13  ILE  11          3HG1      ILE  11  -5.169   4.945 -10.978
   89   HG21  ILE  11          1HG2      ILE  11  -5.726   5.313  -7.023
   90   HG22  ILE  11          2HG2      ILE  11  -6.740   5.556  -8.444
   91   HG23  ILE  11          3HG2      ILE  11  -6.430   3.924  -7.850
   92   HD11  ILE  11          1HD1      ILE  11  -4.171   3.040 -11.742
   93   HD12  ILE  11          2HD1      ILE  11  -3.155   3.400 -10.346
   94   HD13  ILE  11          3HD1      ILE  11  -4.414   2.171 -10.228
   95    H    VAL  12           H        VAL  12  -2.463   5.533  -7.356
   96    HA   VAL  12           HA       VAL  12  -3.438   6.688  -5.035
   97    HB   VAL  12           HB       VAL  12  -0.562   6.162  -5.792
   98   HG11  VAL  12          1HG1      VAL  12  -1.790   6.725  -3.096
   99   HG12  VAL  12          2HG1      VAL  12  -0.139   6.159  -3.358
  100   HG13  VAL  12          3HG1      VAL  12  -0.638   7.740  -3.963
  101   HG21  VAL  12          1HG2      VAL  12  -2.485   4.323  -5.597
  102   HG22  VAL  12          2HG2      VAL  12  -0.826   4.021  -5.080
  103   HG23  VAL  12          3HG2      VAL  12  -2.056   4.451  -3.892
  104    H    LYS  13           H        LYS  13  -1.583   8.116  -7.626
  105    HA   LYS  13           HA       LYS  13  -0.919  10.511  -6.192
  106    HB2  LYS  13          2HB       LYS  13   0.466  10.835  -7.914
  107    HB3  LYS  13          3HB       LYS  13  -0.105   9.312  -8.583
  108    HG2  LYS  13          2HG       LYS  13  -1.846  10.504  -9.815
  109    HG3  LYS  13          3HG       LYS  13  -1.268  12.032  -9.147
  110    HD2  LYS  13          2HD       LYS  13   0.621  10.239 -10.617
  111    HD3  LYS  13          3HD       LYS  13  -0.492  11.271 -11.518
  112    HE2  LYS  13          2HE       LYS  13   0.529  13.000  -9.661
  113    HE3  LYS  13          3HE       LYS  13   1.913  11.962  -9.999
  114    HZ1  LYS  13          1HZ       LYS  13   1.070  14.085 -11.503
  115    HZ2  LYS  13          2HZ       LYS  13   0.558  12.737 -12.386
  116    HZ3  LYS  13          3HZ       LYS  13   2.190  12.907 -11.974
  117    H    LYS  14           H        LYS  14  -3.488   9.475  -8.341
  118    HA   LYS  14           HA       LYS  14  -4.602  12.101  -8.668
  119    HB2  LYS  14          2HB       LYS  14  -5.715   9.355  -9.261
  120    HB3  LYS  14          3HB       LYS  14  -6.529  10.859  -9.672
  121    HG2  LYS  14          2HG       LYS  14  -3.883   9.891 -10.730
  122    HG3  LYS  14          3HG       LYS  14  -5.408  10.003 -11.613
  123    HD2  LYS  14          2HD       LYS  14  -5.381  12.455 -11.259
  124    HD3  LYS  14          3HD       LYS  14  -3.801  12.297 -10.487
  125    HE2  LYS  14          2HE       LYS  14  -2.746  11.737 -12.469
  126    HE3  LYS  14          3HE       LYS  14  -4.239  11.188 -13.228
  127    HZ1  LYS  14          1HZ       LYS  14  -3.060  13.787 -13.226
  128    HZ2  LYS  14          2HZ       LYS  14  -4.669  13.835 -12.708
  129    HZ3  LYS  14          3HZ       LYS  14  -4.285  13.164 -14.212
  130    H    LEU  15           H        LEU  15  -5.517   9.202  -6.821
  131    HA   LEU  15           HA       LEU  15  -7.816  10.207  -5.619
  132    HB2  LEU  15          2HB       LEU  15  -5.832   8.106  -4.886
  133    HB3  LEU  15          3HB       LEU  15  -7.056   8.575  -3.709
  134    HG   LEU  15           HG       LEU  15  -7.518   6.533  -5.181
  135   HD11  LEU  15          1HD1      LEU  15  -9.184   8.539  -4.100
  136   HD12  LEU  15          2HD1      LEU  15  -9.570   6.846  -4.410
  137   HD13  LEU  15          3HD1      LEU  15  -9.876   8.061  -5.651
  138   HD21  LEU  15          1HD2      LEU  15  -8.133   8.711  -7.176
  139   HD22  LEU  15          2HD2      LEU  15  -8.483   6.992  -7.364
  140   HD23  LEU  15          3HD2      LEU  15  -6.811   7.550  -7.299
  141    H    THR  16           H        THR  16  -4.445  10.688  -4.828
  142    HA   THR  16           HA       THR  16  -4.908  11.845  -2.255
  143    HB   THR  16           HB       THR  16  -2.485  12.023  -4.056
  144    HG1  THR  16           HG1      THR  16  -3.047  10.364  -1.803
  145   HG21  THR  16          1HG2      THR  16  -1.638  12.333  -1.456
  146   HG22  THR  16          2HG2      THR  16  -3.129  13.274  -1.498
  147   HG23  THR  16          3HG2      THR  16  -1.829  13.630  -2.635
  148    H    GLN  17           H        GLN  17  -4.785  13.040  -5.525
  149    HA   GLN  17           HA       GLN  17  -4.295  15.739  -5.107
  150    HB2  GLN  17          2HB       GLN  17  -4.762  14.285  -7.292
  151    HB3  GLN  17          3HB       GLN  17  -6.363  14.988  -7.111
  152    HG2  GLN  17          2HG       GLN  17  -5.510  17.193  -7.302
  153    HG3  GLN  17          3HG       GLN  17  -3.846  16.625  -7.182
  154   HE21  GLN  17          1HE2      GLN  17  -2.848  16.786  -9.046
  155   HE22  GLN  17          2HE2      GLN  17  -3.525  16.458 -10.602
  156    H    TYR  18           H        TYR  18  -7.110  13.858  -4.387
  157    HA   TYR  18           HA       TYR  18  -8.732  16.246  -3.932
  158    HB2  TYR  18          2HB       TYR  18  -9.446  13.312  -3.757
  159    HB3  TYR  18          3HB       TYR  18 -10.574  14.643  -3.524
  160    HD1  TYR  18           HD1      TYR  18 -11.713  15.550  -5.350
  161    HD2  TYR  18           HD2      TYR  18  -8.261  13.158  -6.034
  162    HE1  TYR  18           HE1      TYR  18 -12.171  15.591  -7.766
  163    HE2  TYR  18           HE2      TYR  18  -8.708  13.194  -8.452
  164    HH   TYR  18           HH       TYR  18 -10.476  15.272  -9.966
  165    H    GLU  19           H        GLU  19  -6.994  13.771  -2.221
  166    HA   GLU  19           HA       GLU  19  -8.215  14.207   0.323
  167    HB2  GLU  19          2HB       GLU  19  -5.561  12.942  -0.384
  168    HB3  GLU  19          3HB       GLU  19  -6.318  12.885   1.202
  169    HG2  GLU  19          2HG       GLU  19  -7.643  11.811  -1.268
  170    HG3  GLU  19          3HG       GLU  19  -6.584  10.840  -0.247
  171    H    ILE  20           H        ILE  20  -5.370  15.466  -1.325
  172    HA   ILE  20           HA       ILE  20  -4.081  16.737   0.767
  173    HB   ILE  20           HB       ILE  20  -4.355  17.743  -2.068
  174   HG12  ILE  20          2HG1      ILE  20  -1.890  16.389  -1.156
  175   HG13  ILE  20          3HG1      ILE  20  -3.308  15.358  -1.308
  176   HG21  ILE  20          1HG2      ILE  20  -3.193  19.510  -1.398
  177   HG22  ILE  20          2HG2      ILE  20  -3.072  18.860   0.236
  178   HG23  ILE  20          3HG2      ILE  20  -1.863  18.432  -0.974
  179   HD11  ILE  20          1HD1      ILE  20  -1.604  16.469  -3.352
  180   HD12  ILE  20          2HD1      ILE  20  -2.798  15.175  -3.455
  181   HD13  ILE  20          3HD1      ILE  20  -3.301  16.856  -3.636
  182    H    ALA  21           H        ALA  21  -6.960  17.688  -0.980
  183    HA   ALA  21           HA       ALA  21  -7.168  20.364  -0.352
  184    HB1  ALA  21          1HB       ALA  21  -9.706  19.849  -0.291
  185    HB2  ALA  21          2HB       ALA  21  -8.809  19.577  -1.785
  186    HB3  ALA  21          3HB       ALA  21  -9.214  18.216  -0.740
  187    H    TRP  22           H        TRP  22  -8.135  17.577   1.622
  188    HA   TRP  22           HA       TRP  22  -9.340  18.883   3.734
  189    HB2  TRP  22          2HB       TRP  22  -9.339  16.462   3.566
  190    HB3  TRP  22          3HB       TRP  22  -7.592  16.415   3.792
  191    HD1  TRP  22           HD1      TRP  22  -6.690  17.112   6.296
  192    HE1  TRP  22           HE1      TRP  22  -7.812  16.803   8.591
  193    HE3  TRP  22           HE3      TRP  22 -11.513  16.409   4.753
  194    HZ2  TRP  22           HZ2      TRP  22 -10.400  16.323   9.613
  195    HZ3  TRP  22           HZ3      TRP  22 -13.252  16.030   6.453
  196    HH2  TRP  22           HH2      TRP  22 -12.704  15.988   8.832
  197    H    PHE  23           H        PHE  23  -5.890  18.244   3.224
  198    HA   PHE  23           HA       PHE  23  -5.104  19.495   5.681
  199    HB2  PHE  23          2HB       PHE  23  -3.594  17.861   4.957
  200    HB3  PHE  23          3HB       PHE  23  -3.634  18.426   3.290
  201    HD1  PHE  23           HD1      PHE  23  -2.096  20.021   2.509
  202    HD2  PHE  23           HD2      PHE  23  -2.397  19.224   6.680
  203    HE1  PHE  23           HE1      PHE  23  -0.050  21.330   2.903
  204    HE2  PHE  23           HE2      PHE  23  -0.352  20.533   7.081
  205    HZ   PHE  23           HZ       PHE  23   0.823  21.589   5.192
  206    H    LYS  24           H        LYS  24  -5.560  20.509   2.382
  207    HA   LYS  24           HA       LYS  24  -4.066  22.885   2.414
  208    HB2  LYS  24          2HB       LYS  24  -4.946  21.893   0.353
  209    HB3  LYS  24          3HB       LYS  24  -6.589  22.236   0.878
  210    HG2  LYS  24          2HG       LYS  24  -6.274  24.017  -0.484
  211    HG3  LYS  24          3HG       LYS  24  -5.630  24.704   1.009
  212    HD2  LYS  24          2HD       LYS  24  -3.362  23.836   0.238
  213    HD3  LYS  24          3HD       LYS  24  -4.119  23.577  -1.335
  214    HE2  LYS  24          2HE       LYS  24  -4.152  26.223   0.102
  215    HE3  LYS  24          3HE       LYS  24  -2.897  25.765  -1.047
  216    HZ1  LYS  24          1HZ       LYS  24  -4.878  27.104  -1.899
  217    HZ2  LYS  24          2HZ       LYS  24  -5.751  25.660  -1.792
  218    HZ3  LYS  24          3HZ       LYS  24  -4.397  25.756  -2.801
  219    H    ASN  25           H        ASN  25  -7.210  22.096   3.692
  220    HA   ASN  25           HA       ASN  25  -8.005  24.832   4.099
  221    HB2  ASN  25          2HB       ASN  25  -9.143  22.199   5.049
  222    HB3  ASN  25          3HB       ASN  25  -9.849  23.757   5.468
  223   HD21  ASN  25          1HD2      ASN  25  -9.989  21.239   3.362
  224   HD22  ASN  25          2HD2      ASN  25 -10.795  22.012   2.043
  225    H    LYS  26           H        LYS  26  -5.908  22.724   5.661
  226    HA   LYS  26           HA       LYS  26  -6.306  23.893   8.306
  227    HB2  LYS  26          2HB       LYS  26  -4.203  21.879   7.530
  228    HB3  LYS  26          3HB       LYS  26  -4.841  22.217   9.133
  229    HG2  LYS  26          2HG       LYS  26  -6.431  21.005   6.882
  230    HG3  LYS  26          3HG       LYS  26  -5.651  20.090   8.175
  231    HD2  LYS  26          2HD       LYS  26  -7.450  22.309   8.972
  232    HD3  LYS  26          3HD       LYS  26  -8.201  20.862   8.296
  233    HE2  LYS  26          2HE       LYS  26  -8.123  20.114  10.414
  234    HE3  LYS  26          3HE       LYS  26  -6.436  19.766  10.038
  235    HZ1  LYS  26          1HZ       LYS  26  -7.486  22.190  11.391
  236    HZ2  LYS  26          2HZ       LYS  26  -5.874  21.984  10.923
  237    HZ3  LYS  26          3HZ       LYS  26  -6.553  20.964  12.090
  238    H    HIS  27           H        HIS  27  -4.094  23.980   5.607
  239    HA   HIS  27           HA       HIS  27  -2.701  26.219   6.879
  240    HB2  HIS  27          2HB       HIS  27  -1.258  23.947   5.498
  241    HB3  HIS  27          3HB       HIS  27  -0.516  25.374   6.215
  242    HD1  HIS  27           HD1      HIS  27  -2.318  22.207   7.189
  243    HD2  HIS  27           HD2      HIS  27  -0.026  25.210   8.918
  244    HE1  HIS  27           HE1      HIS  27  -1.829  21.418   9.526
  245    H    GLY  28           H        GLY  28  -3.118  24.312   3.908
  246    HA2  GLY  28          2HA       GLY  28  -3.882  25.277   1.869
  247    HA3  GLY  28          3HA       GLY  28  -3.273  26.834   2.413
  248    H    TYR  29           H        TYR  29  -1.352  23.942   2.697
  249    HA   TYR  29           HA       TYR  29   0.300  24.848   0.433
  250    HB2  TYR  29          2HB       TYR  29   1.144  24.021   3.199
  251    HB3  TYR  29          3HB       TYR  29   2.252  23.904   1.837
  252    HD1  TYR  29           HD1      TYR  29  -0.014  26.366   3.497
  253    HD2  TYR  29           HD2      TYR  29   3.594  25.722   1.336
  254    HE1  TYR  29           HE1      TYR  29   0.572  28.738   3.780
  255    HE2  TYR  29           HE2      TYR  29   4.190  28.092   1.614
  256    HH   TYR  29           HH       TYR  29   1.964  30.383   3.117
  257    H    TYR  30           H        TYR  30   2.125  22.898   0.261
  258    HA   TYR  30           HA       TYR  30   0.779  20.315   0.313
  259    HB2  TYR  30          2HB       TYR  30   2.047  21.156  -2.271
  260    HB3  TYR  30          3HB       TYR  30   0.858  19.892  -1.976
  261    HD1  TYR  30           HD1      TYR  30   1.333  23.546  -2.263
  262    HD2  TYR  30           HD2      TYR  30  -1.473  20.353  -2.068
  263    HE1  TYR  30           HE1      TYR  30  -0.462  25.091  -2.928
  264    HE2  TYR  30           HE2      TYR  30  -3.275  21.889  -2.734
  265    HH   TYR  30           HH       TYR  30  -3.535  24.025  -3.907
  266    HA   PRO  31           HA       PRO  31   5.470  19.703  -0.679
  267    HB2  PRO  31          2HB       PRO  31   6.993  21.937  -0.916
  268    HB3  PRO  31          3HB       PRO  31   6.162  21.191  -2.286
  269    HG2  PRO  31          2HG       PRO  31   5.349  23.553  -0.637
  270    HG3  PRO  31          3HG       PRO  31   5.275  23.338  -2.395
  271    HD2  PRO  31          2HD       PRO  31   3.106  23.049  -0.800
  272    HD3  PRO  31          3HD       PRO  31   3.328  22.109  -2.290
  273    H    TRP  32           H        TRP  32   7.701  20.676   0.443
  274    HA   TRP  32           HA       TRP  32   7.090  20.548   3.263
  275    HB2  TRP  32          2HB       TRP  32   9.352  20.083   3.600
  276    HB3  TRP  32          3HB       TRP  32   9.047  19.395   2.007
  277    HD1  TRP  32           HD1      TRP  32  11.086  22.039   3.772
  278    HE1  TRP  32           HE1      TRP  32  12.686  23.148   2.087
  279    HE3  TRP  32           HE3      TRP  32   9.206  20.064  -0.553
  280    HZ2  TRP  32           HZ2      TRP  32  13.096  23.181  -0.706
  281    HZ3  TRP  32           HZ3      TRP  32  10.259  20.685  -2.688
  282    HH2  TRP  32           HH2      TRP  32  12.163  22.212  -2.761
  283    H    GLU  33           H        GLU  33   6.968  23.013   1.190
  284    HA   GLU  33           HA       GLU  33   8.406  24.990   2.753
  285    HB2  GLU  33          2HB       GLU  33   6.545  25.509   0.437
  286    HB3  GLU  33          3HB       GLU  33   7.822  26.551   1.049
  287    HG2  GLU  33          2HG       GLU  33   9.511  25.051   0.249
  288    HG3  GLU  33          3HG       GLU  33   8.294  23.865  -0.218
  289    H    ILE  34           H        ILE  34   6.564  23.799   4.353
  290    HA   ILE  34           HA       ILE  34   4.218  25.541   4.437
  291    HB   ILE  34           HB       ILE  34   4.895  23.142   6.143
  292   HG12  ILE  34          2HG1      ILE  34   2.676  23.164   4.152
  293   HG13  ILE  34          3HG1      ILE  34   4.320  22.991   3.548
  294   HG21  ILE  34          1HG2      ILE  34   2.615  23.255   6.928
  295   HG22  ILE  34          2HG2      ILE  34   3.421  24.791   7.240
  296   HG23  ILE  34          3HG2      ILE  34   2.295  24.645   5.891
  297   HD11  ILE  34          1HD1      ILE  34   4.616  20.946   4.568
  298   HD12  ILE  34          2HD1      ILE  34   3.347  21.239   5.757
  299   HD13  ILE  34          3HD1      ILE  34   2.922  20.887   4.083
  300    HA   PRO  35           HA       PRO  35   6.079  28.140   7.494
  301    HB2  PRO  35          2HB       PRO  35   3.819  29.419   8.285
  302    HB3  PRO  35          3HB       PRO  35   4.633  29.766   6.755
  303    HG2  PRO  35          2HG       PRO  35   2.234  28.054   7.279
  304    HG3  PRO  35          3HG       PRO  35   2.513  29.219   5.972
  305    HD2  PRO  35          2HD       PRO  35   2.795  26.548   5.628
  306    HD3  PRO  35          3HD       PRO  35   3.783  27.734   4.749
  307    H    ARG  36           H        ARG  36   5.149  28.949   9.820
  308    HA   ARG  36           HA       ARG  36   4.780  26.463  11.330
  309    HB2  ARG  36          2HB       ARG  36   5.587  27.746  13.268
  310    HB3  ARG  36          3HB       ARG  36   6.734  27.785  11.936
  311    HG2  ARG  36          2HG       ARG  36   4.787  30.000  12.057
  312    HG3  ARG  36          3HG       ARG  36   6.017  29.952  13.322
  313    HD2  ARG  36          2HD       ARG  36   7.452  29.435  11.031
  314    HD3  ARG  36          3HD       ARG  36   6.259  30.616  10.494
  315    HE   ARG  36           HE       ARG  36   7.356  32.212  11.707
  316   HH11  ARG  36          1HH1      ARG  36   8.361  29.066  12.809
  317   HH12  ARG  36          2HH1      ARG  36   9.601  29.683  13.849
  318   HH21  ARG  36          1HH2      ARG  36   8.986  33.037  13.073
  319   HH22  ARG  36          2HH2      ARG  36   9.956  31.942  13.999
  320    H    CYS  37           H        CYS  37   3.661  27.056  13.593
  321    HA   CYS  37           HA       CYS  37   0.991  27.969  12.853
  322    HB2  CYS  37          2HB       CYS  37   2.086  26.050  14.739
  323    HB3  CYS  37          3HB       CYS  37   0.923  27.122  15.510
  324    HG   CYS  37           HG       CYS  37   0.001  24.498  14.380
  Start of MODEL   19
    1    H    MET   1           H        MET   1   7.584  -0.377  -0.892
    2    HA   MET   1           HA       MET   1   4.757  -0.548  -0.359
    3    HB2  MET   1          2HB       MET   1   6.444   0.027   1.795
    4    HB3  MET   1          3HB       MET   1   5.803   1.587   1.296
    5    HG2  MET   1          2HG       MET   1   3.586  -0.046   1.284
    6    HG3  MET   1          3HG       MET   1   4.507  -0.607   2.678
    7    HE1  MET   1          1HE       MET   1   5.323   0.957   4.617
    8    HE2  MET   1          2HE       MET   1   4.048   1.965   5.302
    9    HE3  MET   1          3HE       MET   1   3.725   0.273   4.919
   10    H    LYS   2           H        LYS   2   3.656   0.967  -1.472
   11    HA   LYS   2           HA       LYS   2   3.248   2.640  -2.959
   12    HB2  LYS   2          2HB       LYS   2   5.225   3.821  -1.071
   13    HB3  LYS   2          3HB       LYS   2   4.873   4.711  -2.546
   14    HG2  LYS   2          2HG       LYS   2   3.342   5.617  -1.108
   15    HG3  LYS   2          3HG       LYS   2   2.388   4.325  -1.840
   16    HD2  LYS   2          2HD       LYS   2   2.032   3.454   0.173
   17    HD3  LYS   2          3HD       LYS   2   3.770   3.228   0.381
   18    HE2  LYS   2          2HE       LYS   2   2.809   5.976   0.793
   19    HE3  LYS   2          3HE       LYS   2   2.217   4.796   1.962
   20    HZ1  LYS   2          1HZ       LYS   2   4.302   4.405   2.765
   21    HZ2  LYS   2          2HZ       LYS   2   4.470   6.032   2.333
   22    HZ3  LYS   2          3HZ       LYS   2   5.078   4.822   1.320
   23    H    PHE   3           H        PHE   3   4.238   0.958  -4.462
   24    HA   PHE   3           HA       PHE   3   6.847   1.192  -5.447
   25    HB2  PHE   3          2HB       PHE   3   4.295   0.068  -6.539
   26    HB3  PHE   3          3HB       PHE   3   5.699   0.202  -7.593
   27    HD1  PHE   3           HD1      PHE   3   5.205  -0.808  -4.032
   28    HD2  PHE   3           HD2      PHE   3   6.730  -1.821  -7.875
   29    HE1  PHE   3           HE1      PHE   3   6.081  -2.921  -3.124
   30    HE2  PHE   3           HE2      PHE   3   7.608  -3.935  -6.973
   31    HZ   PHE   3           HZ       PHE   3   7.283  -4.488  -4.595
   32    H    LYS   4           H        LYS   4   7.390   1.876  -7.722
   33    HA   LYS   4           HA       LYS   4   6.109   4.466  -8.301
   34    HB2  LYS   4          2HB       LYS   4   8.935   3.699  -9.024
   35    HB3  LYS   4          3HB       LYS   4   8.211   5.302  -9.055
   36    HG2  LYS   4          2HG       LYS   4   9.119   5.613  -7.055
   37    HG3  LYS   4          3HG       LYS   4   7.902   4.497  -6.431
   38    HD2  LYS   4          2HD       LYS   4   9.869   3.559  -5.652
   39    HD3  LYS   4          3HD       LYS   4   9.598   2.661  -7.148
   40    HE2  LYS   4          2HE       LYS   4  11.867   3.249  -7.205
   41    HE3  LYS   4          3HE       LYS   4  11.075   4.414  -8.267
   42    HZ1  LYS   4          1HZ       LYS   4  12.779   5.147  -6.412
   43    HZ2  LYS   4          2HZ       LYS   4  11.383   5.147  -5.456
   44    HZ3  LYS   4          3HZ       LYS   4  11.460   6.116  -6.841
   45    H    PHE   5           H        PHE   5   7.203   1.428  -9.589
   46    HA   PHE   5           HA       PHE   5   6.692   2.226 -12.336
   47    HB2  PHE   5          2HB       PHE   5   7.534  -0.429 -11.156
   48    HB3  PHE   5          3HB       PHE   5   7.377  -0.100 -12.878
   49    HD1  PHE   5           HD1      PHE   5   8.644   2.309 -13.440
   50    HD2  PHE   5           HD2      PHE   5   9.708  -0.546 -10.468
   51    HE1  PHE   5           HE1      PHE   5  10.967   3.119 -13.498
   52    HE2  PHE   5           HE2      PHE   5  12.032   0.260 -10.521
   53    HZ   PHE   5           HZ       PHE   5  12.664   2.095 -12.037
   54    H    ASN   6           H        ASN   6   5.207   0.343  -9.785
   55    HA   ASN   6           HA       ASN   6   3.323  -1.113 -11.180
   56    HB2  ASN   6          2HB       ASN   6   3.570  -0.061  -8.441
   57    HB3  ASN   6          3HB       ASN   6   1.915  -0.378  -8.954
   58   HD21  ASN   6          1HD2      ASN   6   1.636  -2.100  -7.581
   59   HD22  ASN   6          2HD2      ASN   6   2.432  -3.617  -7.805
   60    HA   PRO   7           HA       PRO   7   0.375   1.650 -12.886
   61    HB2  PRO   7          2HB       PRO   7  -1.973   0.371 -12.414
   62    HB3  PRO   7          3HB       PRO   7  -0.796  -0.191 -13.607
   63    HG2  PRO   7          2HG       PRO   7  -1.264  -1.151 -10.811
   64    HG3  PRO   7          3HG       PRO   7  -0.971  -2.094 -12.283
   65    HD2  PRO   7          2HD       PRO   7   0.969  -1.599 -10.460
   66    HD3  PRO   7          3HD       PRO   7   1.308  -1.759 -12.196
   67    H    THR   8           H        THR   8  -0.274   0.569  -9.590
   68    HA   THR   8           HA       THR   8  -2.275   2.393  -8.908
   69    HB   THR   8           HB       THR   8  -1.464   0.405  -7.539
   70    HG1  THR   8           HG1      THR   8  -2.013   1.516  -5.565
   71   HG21  THR   8          1HG2      THR   8   0.928   1.063  -7.530
   72   HG22  THR   8          2HG2      THR   8   0.282   0.799  -5.910
   73   HG23  THR   8          3HG2      THR   8   0.515   2.440  -6.510
   74    H    GLY   9           H        GLY   9   1.065   2.891  -9.493
   75    HA2  GLY   9          2HA       GLY   9   1.729   5.025  -7.871
   76    HA3  GLY   9          3HA       GLY   9   2.329   4.810  -9.509
   77    H    THR  10           H        THR  10  -0.089   5.086 -10.909
   78    HA   THR  10           HA       THR  10  -0.295   7.943 -10.956
   79    HB   THR  10           HB       THR  10  -1.920   5.898 -12.482
   80    HG1  THR  10           HG1      THR  10   0.247   5.689 -13.026
   81   HG21  THR  10          1HG2      THR  10  -2.995   7.595 -13.457
   82   HG22  THR  10          2HG2      THR  10  -1.484   8.447 -13.774
   83   HG23  THR  10          3HG2      THR  10  -2.302   8.650 -12.226
   84    H    ILE  11           H        ILE  11  -2.605   5.315 -10.284
   85    HA   ILE  11           HA       ILE  11  -4.827   6.859  -9.686
   86    HB   ILE  11           HB       ILE  11  -4.013   4.234  -8.433
   87   HG12  ILE  11          2HG1      ILE  11  -6.057   3.759 -10.220
   88   HG13  ILE  11          3HG1      ILE  11  -5.112   4.997 -11.040
   89   HG21  ILE  11          1HG2      ILE  11  -5.699   5.341  -7.088
   90   HG22  ILE  11          2HG2      ILE  11  -6.697   5.604  -8.516
   91   HG23  ILE  11          3HG2      ILE  11  -6.406   3.965  -7.934
   92   HD11  ILE  11          1HD1      ILE  11  -4.379   2.213 -10.321
   93   HD12  ILE  11          2HD1      ILE  11  -4.095   3.112 -11.812
   94   HD13  ILE  11          3HD1      ILE  11  -3.108   3.434 -10.386
   95    H    VAL  12           H        VAL  12  -2.438   5.546  -7.384
   96    HA   VAL  12           HA       VAL  12  -3.434   6.695  -5.069
   97    HB   VAL  12           HB       VAL  12  -0.552   6.155  -5.793
   98   HG11  VAL  12          1HG1      VAL  12  -0.159   6.137  -3.355
   99   HG12  VAL  12          2HG1      VAL  12  -0.640   7.725  -3.957
  100   HG13  VAL  12          3HG1      VAL  12  -1.808   6.711  -3.108
  101   HG21  VAL  12          1HG2      VAL  12  -2.442   4.312  -5.673
  102   HG22  VAL  12          2HG2      VAL  12  -0.826   4.017  -5.032
  103   HG23  VAL  12          3HG2      VAL  12  -2.140   4.456  -3.941
  104    H    LYS  13           H        LYS  13  -1.538   8.125  -7.630
  105    HA   LYS  13           HA       LYS  13  -0.877  10.508  -6.176
  106    HB2  LYS  13          2HB       LYS  13   0.532  10.831  -7.879
  107    HB3  LYS  13          3HB       LYS  13  -0.041   9.316  -8.563
  108    HG2  LYS  13          2HG       LYS  13  -1.759  10.527  -9.810
  109    HG3  LYS  13          3HG       LYS  13  -1.180  12.048  -9.126
  110    HD2  LYS  13          2HD       LYS  13   0.798  10.310 -10.501
  111    HD3  LYS  13          3HD       LYS  13  -0.377  11.165 -11.502
  112    HE2  LYS  13          2HE       LYS  13   0.309  13.283 -10.561
  113    HE3  LYS  13          3HE       LYS  13   1.397  12.468  -9.439
  114    HZ1  LYS  13          1HZ       LYS  13   1.682  12.207 -12.373
  115    HZ2  LYS  13          2HZ       LYS  13   2.819  11.845 -11.175
  116    HZ3  LYS  13          3HZ       LYS  13   2.426  13.456 -11.507
  117    H    LYS  14           H        LYS  14  -3.426   9.500  -8.361
  118    HA   LYS  14           HA       LYS  14  -4.519  12.135  -8.686
  119    HB2  LYS  14          2HB       LYS  14  -5.643   9.400  -9.309
  120    HB3  LYS  14          3HB       LYS  14  -6.441  10.912  -9.722
  121    HG2  LYS  14          2HG       LYS  14  -3.788   9.931 -10.752
  122    HG3  LYS  14          3HG       LYS  14  -5.301  10.059 -11.653
  123    HD2  LYS  14          2HD       LYS  14  -5.261  12.508 -11.286
  124    HD3  LYS  14          3HD       LYS  14  -3.693  12.335 -10.494
  125    HE2  LYS  14          2HE       LYS  14  -3.020  12.854 -12.618
  126    HE3  LYS  14          3HE       LYS  14  -3.074  11.096 -12.731
  127    HZ1  LYS  14          1HZ       LYS  14  -4.493  11.320 -14.395
  128    HZ2  LYS  14          2HZ       LYS  14  -4.533  13.000 -14.208
  129    HZ3  LYS  14          3HZ       LYS  14  -5.616  12.028 -13.346
  130    H    LEU  15           H        LEU  15  -5.476   9.231  -6.869
  131    HA   LEU  15           HA       LEU  15  -7.782  10.245  -5.688
  132    HB2  LEU  15          2HB       LEU  15  -5.822   8.125  -4.945
  133    HB3  LEU  15          3HB       LEU  15  -7.058   8.595  -3.780
  134    HG   LEU  15           HG       LEU  15  -7.517   6.566  -5.269
  135   HD11  LEU  15          1HD1      LEU  15  -9.256   8.775  -4.477
  136   HD12  LEU  15          2HD1      LEU  15  -9.445   7.037  -4.243
  137   HD13  LEU  15          3HD1      LEU  15  -9.913   7.776  -5.774
  138   HD21  LEU  15          1HD2      LEU  15  -6.771   7.585  -7.371
  139   HD22  LEU  15          2HD2      LEU  15  -8.083   8.759  -7.263
  140   HD23  LEU  15          3HD2      LEU  15  -8.447   7.044  -7.463
  141    H    THR  16           H        THR  16  -4.418  10.696  -4.853
  142    HA   THR  16           HA       THR  16  -4.907  11.842  -2.278
  143    HB   THR  16           HB       THR  16  -2.457  12.006  -4.045
  144    HG1  THR  16           HG1      THR  16  -3.189   9.888  -3.179
  145   HG21  THR  16          1HG2      THR  16  -3.124  13.243  -1.482
  146   HG22  THR  16          2HG2      THR  16  -1.817  13.608  -2.609
  147   HG23  THR  16          3HG2      THR  16  -1.635  12.300  -1.440
  148    H    GLN  17           H        GLN  17  -4.727  13.053  -5.540
  149    HA   GLN  17           HA       GLN  17  -4.218  15.745  -5.101
  150    HB2  GLN  17          2HB       GLN  17  -4.668  14.307  -7.300
  151    HB3  GLN  17          3HB       GLN  17  -6.265  15.024  -7.138
  152    HG2  GLN  17          2HG       GLN  17  -5.541  17.101  -7.657
  153    HG3  GLN  17          3HG       GLN  17  -3.960  16.856  -6.916
  154   HE21  GLN  17          1HE2      GLN  17  -5.793  15.291  -9.525
  155   HE22  GLN  17          2HE2      GLN  17  -4.526  15.374 -10.696
  156    H    TYR  18           H        TYR  18  -7.060  13.886  -4.430
  157    HA   TYR  18           HA       TYR  18  -8.667  16.287  -3.985
  158    HB2  TYR  18          2HB       TYR  18  -9.410  13.358  -3.835
  159    HB3  TYR  18          3HB       TYR  18 -10.529  14.698  -3.612
  160    HD1  TYR  18           HD1      TYR  18  -8.194  13.202  -6.095
  161    HD2  TYR  18           HD2      TYR  18 -11.630  15.627  -5.450
  162    HE1  TYR  18           HE1      TYR  18  -8.607  13.251  -8.519
  163    HE2  TYR  18           HE2      TYR  18 -12.053  15.682  -7.872
  164    HH   TYR  18           HH       TYR  18 -11.441  14.097  -9.884
  165    H    GLU  19           H        GLU  19  -6.975  13.787  -2.263
  166    HA   GLU  19           HA       GLU  19  -8.227  14.223   0.266
  167    HB2  GLU  19          2HB       GLU  19  -5.576  12.936  -0.411
  168    HB3  GLU  19          3HB       GLU  19  -6.354  12.880   1.165
  169    HG2  GLU  19          2HG       GLU  19  -7.654  11.828  -1.329
  170    HG3  GLU  19          3HG       GLU  19  -6.621  10.843  -0.294
  171    H    ILE  20           H        ILE  20  -5.349  15.463  -1.337
  172    HA   ILE  20           HA       ILE  20  -4.076  16.713   0.779
  173    HB   ILE  20           HB       ILE  20  -4.303  17.734  -2.055
  174   HG12  ILE  20          2HG1      ILE  20  -1.863  16.354  -1.116
  175   HG13  ILE  20          3HG1      ILE  20  -3.288  15.336  -1.292
  176   HG21  ILE  20          1HG2      ILE  20  -3.041  18.829   0.272
  177   HG22  ILE  20          2HG2      ILE  20  -1.820  18.394  -0.922
  178   HG23  ILE  20          3HG2      ILE  20  -3.132  19.487  -1.361
  179   HD11  ILE  20          1HD1      ILE  20  -2.766  15.162  -3.435
  180   HD12  ILE  20          2HD1      ILE  20  -3.221  16.857  -3.612
  181   HD13  ILE  20          3HD1      ILE  20  -1.540  16.422  -3.304
  182    H    ALA  21           H        ALA  21  -6.922  17.698  -1.003
  183    HA   ALA  21           HA       ALA  21  -7.115  20.373  -0.364
  184    HB1  ALA  21          1HB       ALA  21  -8.724  19.548  -1.839
  185    HB2  ALA  21          2HB       ALA  21  -9.208  18.258  -0.737
  186    HB3  ALA  21          3HB       ALA  21  -9.640  19.930  -0.381
  187    H    TRP  22           H        TRP  22  -8.135  17.585   1.582
  188    HA   TRP  22           HA       TRP  22  -9.356  18.892   3.684
  189    HB2  TRP  22          2HB       TRP  22  -9.412  16.492   3.553
  190    HB3  TRP  22          3HB       TRP  22  -7.660  16.391   3.697
  191    HD1  TRP  22           HD1      TRP  22  -6.609  16.913   6.153
  192    HE1  TRP  22           HE1      TRP  22  -7.637  16.660   8.499
  193    HE3  TRP  22           HE3      TRP  22 -11.547  16.660   4.853
  194    HZ2  TRP  22           HZ2      TRP  22 -10.201  16.388   9.647
  195    HZ3  TRP  22           HZ3      TRP  22 -13.224  16.402   6.635
  196    HH2  TRP  22           HH2      TRP  22 -12.563  16.269   8.982
  197    H    PHE  23           H        PHE  23  -5.906  18.224   3.219
  198    HA   PHE  23           HA       PHE  23  -5.142  19.456   5.693
  199    HB2  PHE  23          2HB       PHE  23  -3.638  17.812   4.982
  200    HB3  PHE  23          3HB       PHE  23  -3.650  18.385   3.318
  201    HD1  PHE  23           HD1      PHE  23  -2.085  19.968   2.565
  202    HD2  PHE  23           HD2      PHE  23  -2.453  19.157   6.728
  203    HE1  PHE  23           HE1      PHE  23  -0.034  21.257   2.994
  204    HE2  PHE  23           HE2      PHE  23  -0.402  20.445   7.163
  205    HZ   PHE  23           HZ       PHE  23   0.810  21.498   5.295
  206    H    LYS  24           H        LYS  24  -5.543  20.490   2.393
  207    HA   LYS  24           HA       LYS  24  -4.029  22.852   2.457
  208    HB2  LYS  24          2HB       LYS  24  -4.888  21.877   0.379
  209    HB3  LYS  24          3HB       LYS  24  -6.535  22.233   0.882
  210    HG2  LYS  24          2HG       LYS  24  -6.184  24.018  -0.466
  211    HG3  LYS  24          3HG       LYS  24  -5.554  24.692   1.039
  212    HD2  LYS  24          2HD       LYS  24  -3.284  23.806   0.295
  213    HD3  LYS  24          3HD       LYS  24  -4.022  23.561  -1.290
  214    HE2  LYS  24          2HE       LYS  24  -4.050  26.201   0.158
  215    HE3  LYS  24          3HE       LYS  24  -2.783  25.736  -0.976
  216    HZ1  LYS  24          1HZ       LYS  24  -4.190  25.876  -2.750
  217    HZ2  LYS  24          2HZ       LYS  24  -4.859  27.079  -1.768
  218    HZ3  LYS  24          3HZ       LYS  24  -5.579  25.550  -1.841
  219    H    ASN  25           H        ASN  25  -7.197  22.085   3.687
  220    HA   ASN  25           HA       ASN  25  -7.974  24.826   4.095
  221    HB2  ASN  25          2HB       ASN  25  -9.150  22.209   5.047
  222    HB3  ASN  25          3HB       ASN  25  -9.857  23.780   5.410
  223   HD21  ASN  25          1HD2      ASN  25 -10.181  21.226   3.484
  224   HD22  ASN  25          2HD2      ASN  25 -10.858  21.967   2.078
  225    H    LYS  26           H        LYS  26  -5.918  22.693   5.677
  226    HA   LYS  26           HA       LYS  26  -6.343  23.854   8.321
  227    HB2  LYS  26          2HB       LYS  26  -4.248  21.824   7.566
  228    HB3  LYS  26          3HB       LYS  26  -4.906  22.161   9.162
  229    HG2  LYS  26          2HG       LYS  26  -6.474  20.973   6.884
  230    HG3  LYS  26          3HG       LYS  26  -5.721  20.046   8.184
  231    HD2  LYS  26          2HD       LYS  26  -7.260  22.126   9.359
  232    HD3  LYS  26          3HD       LYS  26  -8.263  21.318   8.152
  233    HE2  LYS  26          2HE       LYS  26  -6.691  19.518   9.857
  234    HE3  LYS  26          3HE       LYS  26  -7.913  20.461  10.710
  235    HZ1  LYS  26          1HZ       LYS  26  -9.578  19.344   9.732
  236    HZ2  LYS  26          2HZ       LYS  26  -8.409  18.149   9.478
  237    HZ3  LYS  26          3HZ       LYS  26  -8.794  19.232   8.237
  238    H    HIS  27           H        HIS  27  -4.092  23.931   5.654
  239    HA   HIS  27           HA       HIS  27  -2.696  26.151   6.956
  240    HB2  HIS  27          2HB       HIS  27  -1.256  23.872   5.584
  241    HB3  HIS  27          3HB       HIS  27  -0.510  25.289   6.317
  242    HD1  HIS  27           HD1      HIS  27  -2.355  22.135   7.253
  243    HD2  HIS  27           HD2      HIS  27  -0.058  25.108   9.026
  244    HE1  HIS  27           HE1      HIS  27  -1.906  21.332   9.594
  245    H    GLY  28           H        GLY  28  -3.090  24.262   3.970
  246    HA2  GLY  28          2HA       GLY  28  -3.815  25.244   1.926
  247    HA3  GLY  28          3HA       GLY  28  -3.200  26.792   2.485
  248    H    TYR  29           H        TYR  29  -1.310  23.882   2.783
  249    HA   TYR  29           HA       TYR  29   0.382  24.783   0.546
  250    HB2  TYR  29          2HB       TYR  29   1.180  23.935   3.320
  251    HB3  TYR  29          3HB       TYR  29   2.306  23.815   1.973
  252    HD1  TYR  29           HD1      TYR  29   3.673  25.622   1.502
  253    HD2  TYR  29           HD2      TYR  29   0.040  26.289   3.614
  254    HE1  TYR  29           HE1      TYR  29   4.286  27.985   1.798
  255    HE2  TYR  29           HE2      TYR  29   0.643  28.654   3.916
  256    HH   TYR  29           HH       TYR  29   2.619  30.062   3.935
  257    H    TYR  30           H        TYR  30   2.192  22.817   0.390
  258    HA   TYR  30           HA       TYR  30   0.822  20.247   0.411
  259    HB2  TYR  30          2HB       TYR  30   2.134  21.088  -2.151
  260    HB3  TYR  30          3HB       TYR  30   0.929  19.834  -1.880
  261    HD1  TYR  30           HD1      TYR  30   1.442  23.485  -2.141
  262    HD2  TYR  30           HD2      TYR  30  -1.396  20.317  -2.003
  263    HE1  TYR  30           HE1      TYR  30  -0.329  25.049  -2.824
  264    HE2  TYR  30           HE2      TYR  30  -3.174  21.873  -2.687
  265    HH   TYR  30           HH       TYR  30  -2.606  24.851  -4.004
  266    HA   PRO  31           HA       PRO  31   5.520  19.595  -0.517
  267    HB2  PRO  31          2HB       PRO  31   7.067  21.817  -0.722
  268    HB3  PRO  31          3HB       PRO  31   6.249  21.085  -2.108
  269    HG2  PRO  31          2HG       PRO  31   5.434  23.446  -0.458
  270    HG3  PRO  31          3HG       PRO  31   5.383  23.240  -2.219
  271    HD2  PRO  31          2HD       PRO  31   3.189  22.964  -0.656
  272    HD3  PRO  31          3HD       PRO  31   3.424  22.029  -2.147
  273    H    TRP  32           H        TRP  32   7.744  20.543   0.641
  274    HA   TRP  32           HA       TRP  32   7.091  20.407   3.451
  275    HB2  TRP  32          2HB       TRP  32   9.344  19.919   3.818
  276    HB3  TRP  32          3HB       TRP  32   9.055  19.242   2.218
  277    HD1  TRP  32           HD1      TRP  32  11.094  21.858   4.024
  278    HE1  TRP  32           HE1      TRP  32  12.728  22.959   2.367
  279    HE3  TRP  32           HE3      TRP  32   9.257  19.920  -0.336
  280    HZ2  TRP  32           HZ2      TRP  32  13.177  23.001  -0.419
  281    HZ3  TRP  32           HZ3      TRP  32  10.345  20.541  -2.453
  282    HH2  TRP  32           HH2      TRP  32  12.265  22.050  -2.492
  283    H    GLU  33           H        GLU  33   7.022  22.883   1.389
  284    HA   GLU  33           HA       GLU  33   8.456  24.839   2.981
  285    HB2  GLU  33          2HB       GLU  33   6.633  25.386   0.642
  286    HB3  GLU  33          3HB       GLU  33   7.911  26.414   1.276
  287    HG2  GLU  33          2HG       GLU  33   9.597  24.901   0.493
  288    HG3  GLU  33          3HG       GLU  33   8.376  23.729   0.003
  289    H    ILE  34           H        ILE  34   6.581  23.658   4.549
  290    HA   ILE  34           HA       ILE  34   4.250  25.421   4.609
  291    HB   ILE  34           HB       ILE  34   4.881  23.008   6.313
  292   HG12  ILE  34          2HG1      ILE  34   2.691  23.061   4.291
  293   HG13  ILE  34          3HG1      ILE  34   4.342  22.874   3.710
  294   HG21  ILE  34          1HG2      ILE  34   2.592  23.139   7.067
  295   HG22  ILE  34          2HG2      ILE  34   3.408  24.667   7.397
  296   HG23  ILE  34          3HG2      ILE  34   2.298  24.537   6.032
  297   HD11  ILE  34          1HD1      ILE  34   3.425  21.124   5.924
  298   HD12  ILE  34          2HD1      ILE  34   2.842  20.800   4.291
  299   HD13  ILE  34          3HD1      ILE  34   4.574  20.803   4.625
  300    HA   PRO  35           HA       PRO  35   6.092  27.990   7.703
  301    HB2  PRO  35          2HB       PRO  35   3.833  29.286   8.469
  302    HB3  PRO  35          3HB       PRO  35   4.672  29.632   6.952
  303    HG2  PRO  35          2HG       PRO  35   2.250  27.940   7.434
  304    HG3  PRO  35          3HG       PRO  35   2.558  29.109   6.136
  305    HD2  PRO  35          2HD       PRO  35   2.821  26.437   5.784
  306    HD3  PRO  35          3HD       PRO  35   3.831  27.617   4.925
  307    H    ARG  36           H        ARG  36   5.127  28.799  10.019
  308    HA   ARG  36           HA       ARG  36   5.128  26.426  11.626
  309    HB2  ARG  36          2HB       ARG  36   4.697  29.289  12.494
  310    HB3  ARG  36          3HB       ARG  36   5.147  27.936  13.524
  311    HG2  ARG  36          2HG       ARG  36   7.238  28.646  13.237
  312    HG3  ARG  36          3HG       ARG  36   7.126  27.910  11.637
  313    HD2  ARG  36          2HD       ARG  36   6.866  29.920  10.580
  314    HD3  ARG  36          3HD       ARG  36   6.101  30.677  11.977
  315    HE   ARG  36           HE       ARG  36   8.657  30.258  12.789
  316   HH11  ARG  36          1HH1      ARG  36   7.216  31.830  10.038
  317   HH12  ARG  36          2HH1      ARG  36   8.502  32.977   9.855
  318   HH21  ARG  36          1HH2      ARG  36  10.356  31.763  12.560
  319   HH22  ARG  36          2HH2      ARG  36  10.288  32.937  11.290
  320    H    CYS  37           H        CYS  37   3.508  26.767  13.697
  321    HA   CYS  37           HA       CYS  37   1.030  25.855  12.842
  322    HB2  CYS  37          2HB       CYS  37   1.799  27.172  15.453
  323    HB3  CYS  37          3HB       CYS  37   0.266  26.355  15.177
  324    HG   CYS  37           HG       CYS  37   1.312  24.282  16.335
  Start of MODEL   20
    1    H    MET   1           H        MET   1   5.579  -2.832  -1.350
    2    HA   MET   1           HA       MET   1   3.850  -1.396  -1.718
    3    HB2  MET   1          2HB       MET   1   4.400  -0.843   1.178
    4    HB3  MET   1          3HB       MET   1   3.264   0.165   0.291
    5    HG2  MET   1          2HG       MET   1   2.590  -2.504  -0.283
    6    HG3  MET   1          3HG       MET   1   2.870  -2.409   1.455
    7    HE1  MET   1          1HE       MET   1  -0.428  -2.871   1.452
    8    HE2  MET   1          2HE       MET   1   1.039  -2.812   2.429
    9    HE3  MET   1          3HE       MET   1  -0.263  -1.657   2.721
   10    H    LYS   2           H        LYS   2   3.358   1.022  -1.839
   11    HA   LYS   2           HA       LYS   2   3.954   3.052  -2.677
   12    HB2  LYS   2          2HB       LYS   2   5.888   2.574  -0.464
   13    HB3  LYS   2          3HB       LYS   2   6.208   3.922  -1.548
   14    HG2  LYS   2          2HG       LYS   2   4.978   4.965   0.065
   15    HG3  LYS   2          3HG       LYS   2   3.698   4.503  -1.060
   16    HD2  LYS   2          2HD       LYS   2   2.740   3.660   0.804
   17    HD3  LYS   2          3HD       LYS   2   3.804   2.290   0.476
   18    HE2  LYS   2          2HE       LYS   2   5.492   3.281   1.975
   19    HE3  LYS   2          3HE       LYS   2   4.377   4.598   2.333
   20    HZ1  LYS   2          1HZ       LYS   2   3.185   2.030   2.728
   21    HZ2  LYS   2          2HZ       LYS   2   3.288   3.343   3.789
   22    HZ3  LYS   2          3HZ       LYS   2   4.564   2.238   3.686
   23    H    PHE   3           H        PHE   3   4.368   1.721  -4.676
   24    HA   PHE   3           HA       PHE   3   7.201   1.585  -5.400
   25    HB2  PHE   3          2HB       PHE   3   4.702   0.341  -6.483
   26    HB3  PHE   3          3HB       PHE   3   6.104   0.511  -7.535
   27    HD1  PHE   3           HD1      PHE   3   7.199  -1.483  -7.780
   28    HD2  PHE   3           HD2      PHE   3   5.653  -0.442  -3.953
   29    HE1  PHE   3           HE1      PHE   3   8.157  -3.544  -6.836
   30    HE2  PHE   3           HE2      PHE   3   6.609  -2.500  -3.003
   31    HZ   PHE   3           HZ       PHE   3   7.863  -4.054  -4.444
   32    H    LYS   4           H        LYS   4   7.694   2.207  -7.728
   33    HA   LYS   4           HA       LYS   4   6.357   4.762  -8.337
   34    HB2  LYS   4          2HB       LYS   4   9.190   4.014  -9.063
   35    HB3  LYS   4          3HB       LYS   4   8.440   5.600  -9.177
   36    HG2  LYS   4          2HG       LYS   4   9.407   6.010  -7.216
   37    HG3  LYS   4          3HG       LYS   4   8.138   4.997  -6.524
   38    HD2  LYS   4          2HD       LYS   4   9.845   3.793  -5.697
   39    HD3  LYS   4          3HD       LYS   4   9.951   3.129  -7.329
   40    HE2  LYS   4          2HE       LYS   4  12.139   3.847  -6.560
   41    HE3  LYS   4          3HE       LYS   4  11.603   4.847  -7.909
   42    HZ1  LYS   4          1HZ       LYS   4  12.275   5.622  -5.261
   43    HZ2  LYS   4          2HZ       LYS   4  10.706   6.123  -5.643
   44    HZ3  LYS   4          3HZ       LYS   4  12.005   6.589  -6.622
   45    H    PHE   5           H        PHE   5   7.498   1.721  -9.585
   46    HA   PHE   5           HA       PHE   5   6.906   2.451 -12.335
   47    HB2  PHE   5          2HB       PHE   5   7.809  -0.188 -11.161
   48    HB3  PHE   5          3HB       PHE   5   7.686   0.182 -12.878
   49    HD1  PHE   5           HD1      PHE   5   9.081   2.208 -13.709
   50    HD2  PHE   5           HD2      PHE   5   9.812   0.132 -10.066
   51    HE1  PHE   5           HE1      PHE   5  11.391   3.057 -13.692
   52    HE2  PHE   5           HE2      PHE   5  12.122   0.978 -10.043
   53    HZ   PHE   5           HZ       PHE   5  12.914   2.443 -11.857
   54    H    ASN   6           H        ASN   6   5.533   0.580  -9.714
   55    HA   ASN   6           HA       ASN   6   3.663  -0.958 -11.041
   56    HB2  ASN   6          2HB       ASN   6   3.939   0.150  -8.326
   57    HB3  ASN   6          3HB       ASN   6   2.286  -0.235  -8.796
   58   HD21  ASN   6          1HD2      ASN   6   2.577  -1.779  -6.997
   59   HD22  ASN   6          2HD2      ASN   6   3.237  -3.333  -7.365
   60    HA   PRO   7           HA       PRO   7   0.594   1.690 -12.718
   61    HB2  PRO   7          2HB       PRO   7  -1.703   0.350 -12.169
   62    HB3  PRO   7          3HB       PRO   7  -0.538  -0.196 -13.382
   63    HG2  PRO   7          2HG       PRO   7  -0.911  -1.124 -10.560
   64    HG3  PRO   7          3HG       PRO   7  -0.625  -2.083 -12.025
   65    HD2  PRO   7          2HD       PRO   7   1.342  -1.501 -10.258
   66    HD3  PRO   7          3HD       PRO   7   1.644  -1.679 -11.998
   67    H    THR   8           H        THR   8   0.058   0.644  -9.391
   68    HA   THR   8           HA       THR   8  -1.981   2.418  -8.688
   69    HB   THR   8           HB       THR   8  -1.076   0.478  -7.309
   70    HG1  THR   8           HG1      THR   8  -2.613   1.960  -6.473
   71   HG21  THR   8          1HG2      THR   8   0.864   2.589  -6.361
   72   HG22  THR   8          2HG2      THR   8   1.293   1.206  -7.368
   73   HG23  THR   8          3HG2      THR   8   0.694   0.952  -5.729
   74    H    GLY   9           H        GLY   9   1.328   3.006  -9.363
   75    HA2  GLY   9          2HA       GLY   9   1.966   5.186  -7.792
   76    HA3  GLY   9          3HA       GLY   9   2.532   4.961  -9.440
   77    H    THR  10           H        THR  10   0.074   5.141 -10.785
   78    HA   THR  10           HA       THR  10  -0.219   7.990 -10.873
   79    HB   THR  10           HB       THR  10  -1.820   5.873 -12.325
   80    HG1  THR  10           HG1      THR  10  -0.332   6.196 -13.989
   81   HG21  THR  10          1HG2      THR  10  -2.963   7.522 -13.306
   82   HG22  THR  10          2HG2      THR  10  -1.485   8.414 -13.665
   83   HG23  THR  10          3HG2      THR  10  -2.278   8.615 -12.104
   84    H    ILE  11           H        ILE  11  -2.431   5.306 -10.102
   85    HA   ILE  11           HA       ILE  11  -4.684   6.793  -9.474
   86    HB   ILE  11           HB       ILE  11  -3.761   4.215  -8.199
   87   HG12  ILE  11          2HG1      ILE  11  -5.833   3.650  -9.928
   88   HG13  ILE  11          3HG1      ILE  11  -4.945   4.901 -10.791
   89   HG21  ILE  11          1HG2      ILE  11  -6.131   3.882  -7.636
   90   HG22  ILE  11          2HG2      ILE  11  -5.447   5.293  -6.831
   91   HG23  ILE  11          3HG2      ILE  11  -6.488   5.501  -8.239
   92   HD11  ILE  11          1HD1      ILE  11  -4.111   2.152 -10.041
   93   HD12  ILE  11          2HD1      ILE  11  -3.894   3.031 -11.555
   94   HD13  ILE  11          3HD1      ILE  11  -2.881   3.410 -10.163
   95    H    VAL  12           H        VAL  12  -2.202   5.591  -7.210
   96    HA   VAL  12           HA       VAL  12  -3.176   6.749  -4.891
   97    HB   VAL  12           HB       VAL  12  -0.297   6.281  -5.677
   98   HG11  VAL  12          1HG1      VAL  12   0.155   6.317  -3.249
   99   HG12  VAL  12          2HG1      VAL  12  -0.387   7.879  -3.865
  100   HG13  VAL  12          3HG1      VAL  12  -1.504   6.847  -2.971
  101   HG21  VAL  12          1HG2      VAL  12  -2.172   4.400  -5.439
  102   HG22  VAL  12          2HG2      VAL  12  -0.502   4.144  -4.932
  103   HG23  VAL  12          3HG2      VAL  12  -1.732   4.560  -3.739
  104    H    LYS  13           H        LYS  13  -1.387   8.191  -7.520
  105    HA   LYS  13           HA       LYS  13  -0.762  10.617  -6.121
  106    HB2  LYS  13          2HB       LYS  13   0.594  10.953  -7.864
  107    HB3  LYS  13          3HB       LYS  13   0.050   9.410  -8.509
  108    HG2  LYS  13          2HG       LYS  13  -1.733  10.548  -9.732
  109    HG3  LYS  13          3HG       LYS  13  -1.182  12.097  -9.087
  110    HD2  LYS  13          2HD       LYS  13   1.104  10.954 -10.169
  111    HD3  LYS  13          3HD       LYS  13  -0.169  10.551 -11.323
  112    HE2  LYS  13          2HE       LYS  13   0.808  12.653 -11.953
  113    HE3  LYS  13          3HE       LYS  13  -0.824  12.945 -11.354
  114    HZ1  LYS  13          1HZ       LYS  13   0.905  13.116  -9.180
  115    HZ2  LYS  13          2HZ       LYS  13   0.026  14.365  -9.907
  116    HZ3  LYS  13          3HZ       LYS  13   1.600  14.025 -10.427
  117    H    LYS  14           H        LYS  14  -3.332   9.497  -8.227
  118    HA   LYS  14           HA       LYS  14  -4.511  12.092  -8.567
  119    HB2  LYS  14          2HB       LYS  14  -5.567   9.315  -9.118
  120    HB3  LYS  14          3HB       LYS  14  -6.420  10.795  -9.535
  121    HG2  LYS  14          2HG       LYS  14  -3.765   9.876 -10.614
  122    HG3  LYS  14          3HG       LYS  14  -5.302   9.944 -11.480
  123    HD2  LYS  14          2HD       LYS  14  -5.328  12.399 -11.154
  124    HD3  LYS  14          3HD       LYS  14  -3.737  12.287 -10.398
  125    HE2  LYS  14          2HE       LYS  14  -3.481  12.931 -12.707
  126    HE3  LYS  14          3HE       LYS  14  -2.858  11.297 -12.485
  127    HZ1  LYS  14          1HZ       LYS  14  -4.251  11.615 -14.503
  128    HZ2  LYS  14          2HZ       LYS  14  -5.583  11.887 -13.497
  129    HZ3  LYS  14          3HZ       LYS  14  -4.799  10.388 -13.475
  130    H    LEU  15           H        LEU  15  -5.336   9.192  -6.680
  131    HA   LEU  15           HA       LEU  15  -7.643  10.155  -5.460
  132    HB2  LEU  15          2HB       LEU  15  -5.600   8.110  -4.729
  133    HB3  LEU  15          3HB       LEU  15  -6.821   8.563  -3.542
  134    HG   LEU  15           HG       LEU  15  -7.251   6.494  -4.986
  135   HD11  LEU  15          1HD1      LEU  15  -9.421   6.723  -4.475
  136   HD12  LEU  15          2HD1      LEU  15  -9.574   8.246  -5.350
  137   HD13  LEU  15          3HD1      LEU  15  -8.907   8.231  -3.718
  138   HD21  LEU  15          1HD2      LEU  15  -8.253   6.906  -7.161
  139   HD22  LEU  15          2HD2      LEU  15  -6.593   7.501  -7.123
  140   HD23  LEU  15          3HD2      LEU  15  -7.940   8.634  -6.998
  141    H    THR  16           H        THR  16  -4.275  10.726  -4.715
  142    HA   THR  16           HA       THR  16  -4.734  11.899  -2.149
  143    HB   THR  16           HB       THR  16  -2.340  12.117  -3.984
  144    HG1  THR  16           HG1      THR  16  -2.861  10.459  -1.721
  145   HG21  THR  16          1HG2      THR  16  -1.498  12.471  -1.371
  146   HG22  THR  16          2HG2      THR  16  -2.987  13.413  -1.461
  147   HG23  THR  16          3HG2      THR  16  -1.670  13.734  -2.589
  148    H    GLN  17           H        GLN  17  -4.683  13.062  -5.432
  149    HA   GLN  17           HA       GLN  17  -4.257  15.777  -5.047
  150    HB2  GLN  17          2HB       GLN  17  -4.609  14.380  -7.227
  151    HB3  GLN  17          3HB       GLN  17  -6.300  14.817  -7.020
  152    HG2  GLN  17          2HG       GLN  17  -4.709  17.158  -6.718
  153    HG3  GLN  17          3HG       GLN  17  -4.228  16.325  -8.195
  154   HE21  GLN  17          1HE2      GLN  17  -5.323  16.855  -9.934
  155   HE22  GLN  17          2HE2      GLN  17  -6.935  17.475  -9.979
  156    H    TYR  18           H        TYR  18  -7.013  13.833  -4.272
  157    HA   TYR  18           HA       TYR  18  -8.690  16.184  -3.820
  158    HB2  TYR  18          2HB       TYR  18  -9.327  13.234  -3.609
  159    HB3  TYR  18          3HB       TYR  18 -10.485  14.538  -3.374
  160    HD1  TYR  18           HD1      TYR  18  -8.165  13.089  -5.899
  161    HD2  TYR  18           HD2      TYR  18 -11.668  15.400  -5.194
  162    HE1  TYR  18           HE1      TYR  18  -8.644  13.089  -8.312
  163    HE2  TYR  18           HE2      TYR  18 -12.157  15.405  -7.604
  164    HH   TYR  18           HH       TYR  18  -9.876  14.277  -9.944
  165    H    GLU  19           H        GLU  19  -6.869  13.769  -2.108
  166    HA   GLU  19           HA       GLU  19  -8.069  14.201   0.447
  167    HB2  GLU  19          2HB       GLU  19  -5.393  12.995  -0.280
  168    HB3  GLU  19          3HB       GLU  19  -6.129  12.936   1.315
  169    HG2  GLU  19          2HG       GLU  19  -7.456  11.804  -1.128
  170    HG3  GLU  19          3HG       GLU  19  -6.362  10.870  -0.110
  171    H    ILE  20           H        ILE  20  -5.276  15.513  -1.248
  172    HA   ILE  20           HA       ILE  20  -3.994  16.837   0.815
  173    HB   ILE  20           HB       ILE  20  -4.327  17.806  -2.027
  174   HG12  ILE  20          2HG1      ILE  20  -1.819  16.523  -1.130
  175   HG13  ILE  20          3HG1      ILE  20  -3.213  15.456  -1.256
  176   HG21  ILE  20          1HG2      ILE  20  -3.202  19.609  -1.388
  177   HG22  ILE  20          2HG2      ILE  20  -3.045  18.979   0.251
  178   HG23  ILE  20          3HG2      ILE  20  -1.841  18.569  -0.970
  179   HD11  ILE  20          1HD1      ILE  20  -3.259  16.939  -3.598
  180   HD12  ILE  20          2HD1      ILE  20  -1.554  16.573  -3.327
  181   HD13  ILE  20          3HD1      ILE  20  -2.735  15.266  -3.407
  182    H    ALA  21           H        ALA  21  -6.917  17.698  -0.906
  183    HA   ALA  21           HA       ALA  21  -7.184  20.374  -0.303
  184    HB1  ALA  21          1HB       ALA  21  -8.757  19.287  -1.744
  185    HB2  ALA  21          2HB       ALA  21  -9.309  18.242  -0.434
  186    HB3  ALA  21          3HB       ALA  21  -9.640  19.974  -0.380
  187    H    TRP  22           H        TRP  22  -8.059  17.585   1.711
  188    HA   TRP  22           HA       TRP  22  -9.270  18.883   3.824
  189    HB2  TRP  22          2HB       TRP  22  -9.228  16.470   3.703
  190    HB3  TRP  22          3HB       TRP  22  -7.474  16.451   3.860
  191    HD1  TRP  22           HD1      TRP  22  -6.471  17.106   6.315
  192    HE1  TRP  22           HE1      TRP  22  -7.500  16.830   8.658
  193    HE3  TRP  22           HE3      TRP  22 -11.370  16.502   4.983
  194    HZ2  TRP  22           HZ2      TRP  22 -10.051  16.411   9.792
  195    HZ3  TRP  22           HZ3      TRP  22 -13.041  16.169   6.757
  196    HH2  TRP  22           HH2      TRP  22 -12.394  16.124   9.111
  197    H    PHE  23           H        PHE  23  -5.811  18.325   3.279
  198    HA   PHE  23           HA       PHE  23  -5.027  19.619   5.714
  199    HB2  PHE  23          2HB       PHE  23  -3.486  18.016   4.988
  200    HB3  PHE  23          3HB       PHE  23  -3.560  18.563   3.316
  201    HD1  PHE  23           HD1      PHE  23  -2.303  19.426   6.682
  202    HD2  PHE  23           HD2      PHE  23  -2.071  20.187   2.500
  203    HE1  PHE  23           HE1      PHE  23  -0.287  20.789   7.045
  204    HE2  PHE  23           HE2      PHE  23  -0.055  21.551   2.857
  205    HZ   PHE  23           HZ       PHE  23   0.840  21.853   5.131
  206    H    LYS  24           H        LYS  24  -5.547  20.587   2.410
  207    HA   LYS  24           HA       LYS  24  -4.113  23.000   2.400
  208    HB2  LYS  24          2HB       LYS  24  -4.992  21.965   0.360
  209    HB3  LYS  24          3HB       LYS  24  -6.637  22.273   0.901
  210    HG2  LYS  24          2HG       LYS  24  -6.382  24.047  -0.482
  211    HG3  LYS  24          3HG       LYS  24  -5.737  24.766   0.996
  212    HD2  LYS  24          2HD       LYS  24  -3.457  23.945   0.206
  213    HD3  LYS  24          3HD       LYS  24  -4.227  23.651  -1.355
  214    HE2  LYS  24          2HE       LYS  24  -4.309  26.310   0.055
  215    HE3  LYS  24          3HE       LYS  24  -3.056  25.872  -1.105
  216    HZ1  LYS  24          1HZ       LYS  24  -4.449  26.698  -2.615
  217    HZ2  LYS  24          2HZ       LYS  24  -5.776  26.673  -1.566
  218    HZ3  LYS  24          3HZ       LYS  24  -5.345  25.277  -2.419
  219    H    ASN  25           H        ASN  25  -7.221  22.147   3.724
  220    HA   ASN  25           HA       ASN  25  -8.079  24.866   4.113
  221    HB2  ASN  25          2HB       ASN  25  -9.139  22.215   5.099
  222    HB3  ASN  25          3HB       ASN  25  -9.878  23.758   5.518
  223   HD21  ASN  25          1HD2      ASN  25 -10.068  21.220   3.481
  224   HD22  ASN  25          2HD2      ASN  25 -10.878  21.964   2.149
  225    H    LYS  26           H        LYS  26  -5.912  22.827   5.671
  226    HA   LYS  26           HA       LYS  26  -6.308  24.014   8.308
  227    HB2  LYS  26          2HB       LYS  26  -4.165  22.044   7.527
  228    HB3  LYS  26          3HB       LYS  26  -4.792  22.383   9.135
  229    HG2  LYS  26          2HG       LYS  26  -6.377  21.108   6.916
  230    HG3  LYS  26          3HG       LYS  26  -5.560  20.228   8.210
  231    HD2  LYS  26          2HD       LYS  26  -6.942  21.307   9.871
  232    HD3  LYS  26          3HD       LYS  26  -7.690  22.322   8.636
  233    HE2  LYS  26          2HE       LYS  26  -8.180  19.884   7.604
  234    HE3  LYS  26          3HE       LYS  26  -8.170  19.491   9.323
  235    HZ1  LYS  26          1HZ       LYS  26  -9.818  21.635   8.096
  236    HZ2  LYS  26          2HZ       LYS  26  -9.863  21.129   9.709
  237    HZ3  LYS  26          3HZ       LYS  26 -10.386  20.089   8.482
  238    H    HIS  27           H        HIS  27  -4.130  24.127   5.582
  239    HA   HIS  27           HA       HIS  27  -2.778  26.412   6.814
  240    HB2  HIS  27          2HB       HIS  27  -1.296  24.162   5.438
  241    HB3  HIS  27          3HB       HIS  27  -0.580  25.614   6.131
  242    HD1  HIS  27           HD1      HIS  27  -2.292  22.414   7.159
  243    HD2  HIS  27           HD2      HIS  27  -0.054  25.490   8.830
  244    HE1  HIS  27           HE1      HIS  27  -1.757  21.662   9.498
  245    H    GLY  28           H        GLY  28  -3.183  24.464   3.867
  246    HA2  GLY  28          2HA       GLY  28  -3.995  25.390   1.829
  247    HA3  GLY  28          3HA       GLY  28  -3.418  26.966   2.349
  248    H    TYR  29           H        TYR  29  -1.423  24.126   2.640
  249    HA   TYR  29           HA       TYR  29   0.179  25.049   0.346
  250    HB2  TYR  29          2HB       TYR  29   1.077  24.271   3.110
  251    HB3  TYR  29          3HB       TYR  29   2.171  24.169   1.736
  252    HD1  TYR  29           HD1      TYR  29   3.463  26.013   1.204
  253    HD2  TYR  29           HD2      TYR  29  -0.136  26.590   3.399
  254    HE1  TYR  29           HE1      TYR  29   4.003  28.400   1.450
  255    HE2  TYR  29           HE2      TYR  29   0.394  28.979   3.650
  256    HH   TYR  29           HH       TYR  29   2.443  30.608   1.855
  257    H    TYR  30           H        TYR  30   2.050  23.143   0.172
  258    HA   TYR  30           HA       TYR  30   0.769  20.529   0.266
  259    HB2  TYR  30          2HB       TYR  30   1.985  21.374  -2.341
  260    HB3  TYR  30          3HB       TYR  30   0.832  20.084  -2.020
  261    HD1  TYR  30           HD1      TYR  30   1.212  23.745  -2.349
  262    HD2  TYR  30           HD2      TYR  30  -1.511  20.486  -2.088
  263    HE1  TYR  30           HE1      TYR  30  -0.628  25.238  -3.008
  264    HE2  TYR  30           HE2      TYR  30  -3.358  21.970  -2.747
  265    HH   TYR  30           HH       TYR  30  -2.778  25.343  -3.639
  266    HA   PRO  31           HA       PRO  31   5.462  20.022  -0.775
  267    HB2  PRO  31          2HB       PRO  31   6.926  22.291  -1.054
  268    HB3  PRO  31          3HB       PRO  31   6.098  21.510  -2.406
  269    HG2  PRO  31          2HG       PRO  31   5.246  23.868  -0.771
  270    HG3  PRO  31          3HG       PRO  31   5.157  23.633  -2.526
  271    HD2  PRO  31          2HD       PRO  31   3.015  23.307  -0.902
  272    HD3  PRO  31          3HD       PRO  31   3.242  22.357  -2.385
  273    H    TRP  32           H        TRP  32   7.681  21.061   0.310
  274    HA   TRP  32           HA       TRP  32   7.106  20.947   3.138
  275    HB2  TRP  32          2HB       TRP  32   9.383  20.541   3.452
  276    HB3  TRP  32          3HB       TRP  32   9.076  19.830   1.870
  277    HD1  TRP  32           HD1      TRP  32  11.071  22.541   3.585
  278    HE1  TRP  32           HE1      TRP  32  12.622  23.671   1.870
  279    HE3  TRP  32           HE3      TRP  32   9.190  20.476  -0.697
  280    HZ2  TRP  32           HZ2      TRP  32  12.999  23.686  -0.927
  281    HZ3  TRP  32           HZ3      TRP  32  10.202  21.101  -2.851
  282    HH2  TRP  32           HH2      TRP  32  12.067  22.673  -2.962
  283    H    GLU  33           H        GLU  33   6.899  23.387   1.042
  284    HA   GLU  33           HA       GLU  33   8.306  25.414   2.567
  285    HB2  GLU  33          2HB       GLU  33   6.406  25.864   0.269
  286    HB3  GLU  33          3HB       GLU  33   7.664  26.943   0.855
  287    HG2  GLU  33          2HG       GLU  33   9.380  25.477   0.050
  288    HG3  GLU  33          3HG       GLU  33   8.187  24.256  -0.391
  289    H    ILE  34           H        ILE  34   6.514  24.195   4.201
  290    HA   ILE  34           HA       ILE  34   4.126  25.880   4.297
  291    HB   ILE  34           HB       ILE  34   4.883  23.516   6.019
  292   HG12  ILE  34          2HG1      ILE  34   2.641  23.463   4.053
  293   HG13  ILE  34          3HG1      ILE  34   4.282  23.322   3.433
  294   HG21  ILE  34          1HG2      ILE  34   3.381  25.143   7.114
  295   HG22  ILE  34          2HG2      ILE  34   2.243  24.951   5.781
  296   HG23  ILE  34          3HG2      ILE  34   2.610  23.582   6.830
  297   HD11  ILE  34          1HD1      ILE  34   3.412  21.575   5.681
  298   HD12  ILE  34          2HD1      ILE  34   2.916  21.197   4.031
  299   HD13  ILE  34          3HD1      ILE  34   4.629  21.290   4.438
  300    HA   PRO  35           HA       PRO  35   5.958  28.556   7.304
  301    HB2  PRO  35          2HB       PRO  35   3.677  29.787   8.110
  302    HB3  PRO  35          3HB       PRO  35   4.464  30.138   6.567
  303    HG2  PRO  35          2HG       PRO  35   2.114  28.373   7.137
  304    HG3  PRO  35          3HG       PRO  35   2.349  29.531   5.814
  305    HD2  PRO  35          2HD       PRO  35   2.693  26.864   5.494
  306    HD3  PRO  35          3HD       PRO  35   3.640  28.065   4.592
  307    H    ARG  36           H        ARG  36   5.031  29.367   9.633
  308    HA   ARG  36           HA       ARG  36   4.449  26.899  11.136
  309    HB2  ARG  36          2HB       ARG  36   5.963  29.280  12.202
  310    HB3  ARG  36          3HB       ARG  36   5.821  27.683  12.923
  311    HG2  ARG  36          2HG       ARG  36   7.276  28.344  10.371
  312    HG3  ARG  36          3HG       ARG  36   8.017  28.018  11.939
  313    HD2  ARG  36          2HD       ARG  36   6.347  25.846  11.505
  314    HD3  ARG  36          3HD       ARG  36   7.050  26.174   9.921
  315    HE   ARG  36           HE       ARG  36   9.042  25.385  10.702
  316   HH11  ARG  36          1HH1      ARG  36   7.033  26.223  13.418
  317   HH12  ARG  36          2HH1      ARG  36   8.138  25.594  14.596
  318   HH21  ARG  36          1HH2      ARG  36  10.505  24.553  12.242
  319   HH22  ARG  36          2HH2      ARG  36  10.112  24.645  13.926
  320    H    CYS  37           H        CYS  37   3.321  27.218  13.199
  321    HA   CYS  37           HA       CYS  37   0.985  28.763  12.873
  322    HB2  CYS  37          2HB       CYS  37   0.362  27.999  15.076
  323    HB3  CYS  37          3HB       CYS  37   1.132  26.670  14.218
  324    HG   CYS  37           HG       CYS  37   2.762  26.140  16.116