*HEADER    SIGNALING PROTEIN                       06-NOV-06   2NSW              
*TITLE     NMR SOLUTION STRUCTURE OF THE PHEROMONE EN-2                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MATING PHEROMONE EN-2;                                     
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: EUPLOTES NOBILII                                
*KEYWDS    NMR STRUCTURE, EUPLOTES NOBILII PHEROMONE, DISULFIDE-RICH             
*KEYWDS   2 PROTEIN, ALL ALPHA HELICAL, SIGNALING PROTEIN                        
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    W.J.PLACZEK, T.ETEZADY-ESFARJANI, T.HERRMANN, W.PETI,                 
*AUTHOR   2 K.WUTHRICH                                                           
*REVDAT   1   21-AUG-07 2NSW    0                                                


 21 TRP  HE1    51 MET  QB      4.41            #peak     2 #SUP  1.09
 32 GLY  HA2    33 THR  HN      3.14            #peak    20 #SUP  2.84
 33 THR  HN     34 VAL  QG2     5.09            #peak    21 #SUP  5.08
 21 TRP  HD1    22 ASP- HN      3.86            #peak    27 #SUP  6.04
 21 TRP  HB2    22 ASP- HN      4.11            #peak    32 #SUP  6.28
 22 ASP- HN     22 ASP- HB3     3.55            #peak    39 #SUP  5.00
 18 GLN  HA     22 ASP- HN      4.73            #peak    41 #SUP  3.16
 42 PHE  HN     42 PHE  QD      4.31            #peak    43 #SUP  5.39
 21 TRP  HN     22 ASP- HN      3.32            #peak    51 #SUP  6.07
 19 LEU  HN     21 TRP  HN      4.52            #peak    53 #SUP  2.87
  6 TYR  QE     15 ASN  HN      4.00            #peak    67 #SUP  3.03
 15 ASN  HN     15 ASN  HB2     3.68            #peak    81 #SUP  4.05
 35 CYSS HB3    36 CYSS HN      3.95            #peak    84 #SUP  4.63
 14 LYS+ HD2    15 ASN  HN      4.30            #peak    87 #SUP  5.47
 36 CYSS HN     49 ALA  QB      5.34            #peak    88 #SUP  1.50
  3 GLU- HN      4 ASP- HN      3.28            #peak    96 #SUP  7.54
  3 GLU- HN      3 GLU- HG3     4.58            #peak   102 #SUP  7.17
  3 GLU- HN      3 GLU- HB3     3.53            #peak   104 #SUP  7.07
 14 LYS+ QB     15 ASN  HN      4.36            #peak   105 #SUP  4.09
 30 ASN  HN     31 CYSS HN      3.58            #peak   108 #SUP  4.35
 23 THR  QG2    30 ASN  HN      4.62            #peak   115 #SUP  2.96
 16 ASP- HN     17 SER  HN      4.51            #peak   117 #SUP  4.12
  6 TYR  QD     17 SER  HN      4.96            #peak   118 #SUP  3.87
 28 THR  HB     29 GLY  HN      3.17            #peak   119 #SUP  3.15
 46 GLN  HN     48 CYSS HN      4.53            #peak   124 #SUP  2.49
 21 TRP  HE3    48 CYSS HN      4.80            #peak   128 #SUP  4.00
 45 SER  HA     48 CYSS HN      4.01            #peak   130 #SUP  5.14
 28 THR  QG2    29 GLY  HN      4.41            #peak   141 #SUP  3.07
 44 VAL  QG1    48 CYSS HN      4.96            #peak   142 #SUP  4.00
  8 SER  QB      9 GLU- HN      3.54            #peak   149 #SUP  5.62
  7 THR  QG2     9 GLU- HN      4.89            #peak   154 #SUP  5.27
  7 THR  HN      8 SER  HN      4.56            #peak   156 #SUP  5.32
  6 TYR  QD      7 THR  HN      3.50            #peak   157 #SUP  7.57
  6 TYR  HB2     7 THR  HN      4.77            #peak   159 #SUP  4.88
  7 THR  HN     40 PHE  HN      4.71            #peak   163 #SUP  2.07
  7 THR  HN     40 PHE  QD      4.77            #peak   164 #SUP  6.51
 13 TYR  QD     14 LYS+ HN      4.58            #peak   167 #SUP  6.26
 13 TYR  HN     14 LYS+ HN      4.46            #peak   168 #SUP  5.19
 14 LYS+ HN     14 LYS+ HD3     4.99            #peak   175 #SUP  6.35
 33 THR  HN     34 VAL  HN      3.40            #peak   179 #SUP  5.49
 34 VAL  HN     35 CYSS HN      3.10            #peak   180 #SUP  6.28
 33 THR  HB     34 VAL  HN      3.51            #peak   181 #SUP  5.72
 16 ASP- HN     17 SER  HA      4.82            #peak   191 #SUP  3.76
 36 CYSS HN     37 GLY  HN      3.33            #peak   197 #SUP  3.63
 15 ASN  HB2    16 ASP- HN      4.23            #peak   198 #SUP  4.09
 37 GLY  HN     45 SER  QB      3.97            #peak   200 #SUP  1.50
 50 GLY  HN     51 MET  HN      3.30            #peak   212 #SUP  1.97
 49 ALA  HN     50 GLY  HN      3.30            #peak   213 #SUP  2.31
 39 CYSS HB3    40 PHE  HN      4.74            #peak   230 #SUP  5.50
 25 SER  HA     52 ALA  HN      3.79            #peak   234 #SUP  2.96
 39 CYSS HB2    40 PHE  HN      4.40            #peak   237 #SUP  5.99
 40 PHE  HN     40 PHE  HB3     3.72            #peak   239 #SUP  6.16
 51 MET  QB     52 ALA  HN      3.73            #peak   240 #SUP  4.97
 37 GLY  HN     38 GLN  HN      3.43            #peak   243 #SUP  4.07
 39 CYSS HN     40 PHE  HN      3.40            #peak   245 #SUP  6.16
 50 GLY  HA2    52 ALA  HN      4.33            #peak   247 #SUP  1.88
 38 GLN  HN     38 GLN  QG      4.55            #peak   252 #SUP  4.04
 55 ASN  HN     56 ASP- HN      3.24            #peak   254 #SUP  4.33
 55 ASN  HB3    56 ASP- HN      3.50            #peak   263 #SUP  4.62
 57 CYSS HN     57 CYSS HB3     3.50            #peak   269 #SUP  2.61
 56 ASP- HB3    57 CYSS HN      4.90            #peak   270 #SUP  3.15
 59 ASN  HB2    60 ALA  HN      3.88            #peak   279 #SUP  3.99
 40 PHE  HB3    45 SER  HN      4.77            #peak   283 #SUP  3.68
 17 SER  HN     18 GLN  HN      3.27            #peak   285 #SUP  4.85
 27 GLY  HN     28 THR  HN      3.18            #peak   287 #SUP  4.68
 27 GLY  HN     53 ASP- QB      4.53            #peak   296 #SUP  1.50
  4 ASP- HN      5 PHE  HN      3.66            #peak   300 #SUP  7.43
  5 PHE  HN      6 TYR  HN      2.89            #peak   301 #SUP  7.48
  5 PHE  HN      5 PHE  QD      3.39            #peak   302 #SUP  7.29
 22 ASP- HN     23 THR  HN      3.25            #peak   310 #SUP  4.65
 20 ALA  HN     21 TRP  HN      3.30            #peak   311 #SUP  5.31
 23 THR  HN     24 CYSS HN      3.20            #peak   312 #SUP  4.86
  6 TYR  QE     20 ALA  HN      4.87            #peak   313 #SUP  0.75
 16 ASP- HB2    18 GLN  HN      4.23            #peak   317 #SUP  4.71
 17 SER  HA     20 ALA  HN      3.81            #peak   320 #SUP  1.83
 51 MET  HN     52 ALA  QB      4.52            #peak   322 #SUP  3.56
 19 LEU  HB2    20 ALA  HN      3.92            #peak   324 #SUP  6.21
 19 LEU  QD1    20 ALA  HN      4.55            #peak   326 #SUP  7.44
 35 CYSS HN     36 CYSS HN      3.21            #peak   331 #SUP  5.09
 35 CYSS HN     35 CYSS HB2     3.17            #peak   335 #SUP  5.41
 33 THR  HA     35 CYSS HN      4.53            #peak   337 #SUP  4.15
 36 CYSS HB2    49 ALA  HN      4.43            #peak   338 #SUP  2.91
 36 CYSS HB3    49 ALA  HN      4.83            #peak   340 #SUP  2.96
 48 CYSS HN     49 ALA  HN      3.31            #peak   348 #SUP  2.82
 24 CYSS HN     25 SER  HN      3.38            #peak   351 #SUP  5.31
 38 GLN  HN     39 CYSS HN      3.36            #peak   360 #SUP  4.44
  4 ASP- HN      6 TYR  HN      4.40            #peak   361 #SUP  5.96
 39 CYSS HN     39 CYSS HB3     4.03            #peak   369 #SUP  5.56
 39 CYSS HN     40 PHE  HB3     5.50            #peak   370 #SUP  5.84
 38 GLN  QB     39 CYSS HN      3.60            #peak   371 #SUP  5.52
  4 ASP- HN      5 PHE  QD      4.39            #peak   374 #SUP  6.76
 47 SER  HN     48 CYSS HN      3.06            #peak   385 #SUP  4.39
 47 SER  HN     50 GLY  HN      4.58            #peak   386 #SUP  2.43
 54 SER  HN     55 ASN  HN      3.23            #peak   387 #SUP  4.43
 46 GLN  HG3    47 SER  HN      4.78            #peak   400 #SUP  4.60
 51 MET  QB     53 ASP- HN      4.79            #peak   402 #SUP  4.08
 19 LEU  HN     19 LEU  QD2     4.99            #peak   408 #SUP  6.16
 47 SER  HN     48 CYSS QB      4.80            #peak   410 #SUP  2.76
 51 MET  HG3    53 ASP- HN      3.73            #peak   411 #SUP  2.45
 21 TRP  HN     40 PHE  QE      3.50            #peak   415 #SUP  3.58
 21 TRP  HB3    40 PHE  QE      4.31            #peak   421 #SUP  3.53
  8 SER  HN      9 GLU- HN      3.18            #peak   426 #SUP  6.24
 44 VAL  HN     45 SER  HN      2.97            #peak   432 #SUP  7.23
 40 PHE  HN     40 PHE  QD      4.24            #peak   438 #SUP  7.42
 44 VAL  HN     45 SER  HA      4.69            #peak   442 #SUP  4.78
 40 PHE  QD     41 SER  HN      4.48            #peak   449 #SUP  5.30
 39 CYSS HN     40 PHE  QD      4.72            #peak   455 #SUP  7.68
  3 GLU- HA      6 TYR  HN      4.16            #peak   458 #SUP  6.21
  5 PHE  QE     43 PRO  HD3     4.26            #peak   462 #SUP  2.96
 38 GLN  QB     40 PHE  QD      4.80            #peak   463 #SUP  1.33
 42 PHE  QE     46 GLN  HG3     4.98            #peak   466 #SUP  1.64
  6 TYR  HN      7 THR  QG2     5.32            #peak   467 #SUP  4.73
  9 GLU- HN     11 CYSS HN      4.40            #peak   475 #SUP  3.28
  5 PHE  QD     41 SER  HN      4.57            #peak   485 #SUP  4.00
  4 ASP- HB3     5 PHE  QD      4.52            #peak   502 #SUP  7.14
  5 PHE  QE      5 PHE  HZ      2.42            #peak   508 #SUP  1.95
 59 ASN  HN     59 ASN  HB3     3.59            #peak   522 #SUP  3.17
 28 THR  HN     28 THR  QG2     3.95            #peak   530 #SUP  5.39
 57 CYSS HB3    59 ASN  HN      4.55            #peak   541 #SUP  0.99
  6 TYR  QD     17 SER  HB3     3.95            #peak   553 #SUP  3.87
  6 TYR  QD     17 SER  HA      3.99            #peak   559 #SUP  3.87
 13 TYR  QD     23 THR  HB      4.56            #peak   563 #SUP  2.00
 13 TYR  QD     14 LYS+ HE2     4.92            #peak   566 #SUP  6.40
 13 TYR  QD     23 THR  QG2     5.18            #peak   572 #SUP  2.96
 13 TYR  HN     13 TYR  HB3     3.81            #peak   578 #SUP  6.55
 13 TYR  HN     13 TYR  HB2     3.71            #peak   581 #SUP  5.76
 45 SER  HN     46 GLN  HN      3.27            #peak   584 #SUP  5.14
 46 GLN  HN     47 SER  HN      3.12            #peak   585 #SUP  5.74
 44 VAL  HN     46 GLN  HN      4.86            #peak   586 #SUP  4.13
 43 PRO  HA     46 GLN  HN      4.02            #peak   590 #SUP  4.78
 46 GLN  HN     46 GLN  HG3     4.70            #peak   592 #SUP  4.73
 30 ASN  HB2    31 CYSS HN      4.77            #peak   599 #SUP  4.35
  6 TYR  QE     17 SER  HN      4.12            #peak   603 #SUP  5.62
  6 TYR  QE     16 ASP- HN      3.49            #peak   604 #SUP  4.15
  6 TYR  QE     17 SER  HA      3.82            #peak   613 #SUP  5.21
  6 TYR  QE     39 CYSS HA      4.11            #peak   615 #SUP  1.50
  9 GLU- HN     10 THR  HN      3.25            #peak   624 #SUP  6.76
 10 THR  HN     11 CYSS HN      2.81            #peak   625 #SUP  5.47
  9 GLU- QG     10 THR  HN      4.41            #peak   631 #SUP  5.27
  7 THR  HA     10 THR  HN      4.47            #peak   635 #SUP  2.74
 21 TRP  HH2    48 CYSS HN      4.42            #peak   639 #SUP  4.97
 21 TRP  HH2    48 CYSS QB      4.72            #peak   647 #SUP  4.76
 24 CYSS HN     26 GLY  HN      4.60            #peak   652 #SUP  1.43
 25 SER  HN     26 GLY  HN      3.44            #peak   653 #SUP  3.69
 21 TRP  HZ3    48 CYSS HN      3.90            #peak   659 #SUP  4.97
 21 TRP  HZ3    40 PHE  QD      5.08            #peak   660 #SUP  0.09
 21 TRP  HZ3    47 SER  QB      4.82            #peak   668 #SUP  3.39
 21 TRP  HE3    40 PHE  QE      4.39            #peak   670 #SUP  3.12
 40 PHE  HA     41 SER  HN      2.92            #peak   682 #SUP  4.84
  7 THR  HN     40 PHE  HA      3.87            #peak   684 #SUP  5.36
  6 TYR  QD     40 PHE  HA      4.76            #peak   692 #SUP  5.54
 10 THR  HA     10 THR  QG2     4.01            #peak   698 #SUP  4.65
  6 TYR  HA      7 THR  HN      2.95            #peak   703 #SUP  6.06
  6 TYR  HA      6 TYR  QD      3.21            #peak   706 #SUP  5.23
  6 TYR  HA      6 TYR  QE      4.80            #peak   707 #SUP  4.15
 41 SER  HA     42 PHE  HN      2.78            #peak   713 #SUP  4.94
 41 SER  HA     42 PHE  HB3     5.40            #peak   716 #SUP  4.97
 30 ASN  HA     31 CYSS HN      3.27            #peak   724 #SUP  4.83
 59 ASN  HA     60 ALA  HN      3.09            #peak   728 #SUP  3.20
 31 CYSS HA     32 GLY  HN      3.10            #peak   735 #SUP  3.07
 28 THR  HA     29 GLY  HN      2.97            #peak   740 #SUP  3.01
 26 GLY  HN     31 CYSS HA      4.80            #peak   742 #SUP  1.50
 32 GLY  HA1    33 THR  HN      3.24            #peak   746 #SUP  2.70
 32 GLY  HA1    49 ALA  HA      4.47            #peak   751 #SUP  1.24
  5 PHE  HA      5 PHE  QD      3.64            #peak   757 #SUP  5.75
  5 PHE  HA     44 VAL  QG2     5.17            #peak   759 #SUP  3.84
 11 CYSS HA     12 PRO  HD3     3.58            #peak   764 #SUP  5.89
 10 THR  QG2    11 CYSS HA      4.70            #peak   775 #SUP  4.20
 13 TYR  HA     14 LYS+ HN      2.78            #peak   778 #SUP  6.87
 13 TYR  HA     13 TYR  QD      3.14            #peak   780 #SUP  7.33
 13 TYR  HA     19 LEU  QD1     4.04            #peak   784 #SUP  3.00
 15 ASN  HN     15 ASN  HA      2.86            #peak   789 #SUP  4.12
 16 ASP- HA     17 SER  HN      2.67            #peak   790 #SUP  4.67
 16 ASP- HA     18 GLN  HN      4.16            #peak   795 #SUP  2.61
 57 CYSS HA     59 ASN  HN      4.50            #peak   797 #SUP  3.15
  6 TYR  QE     16 ASP- HA      3.43            #peak   798 #SUP  3.33
 52 ALA  QB     53 ASP- HA      4.90            #peak   812 #SUP  2.86
 10 THR  HA     10 THR  HB      2.93            #peak   814 #SUP  2.76
 42 PHE  HA     45 SER  HN      3.20            #peak   819 #SUP  4.48
 42 PHE  HA     42 PHE  QD      3.58            #peak   820 #SUP  5.40
 42 PHE  HA     46 GLN  HN      4.40            #peak   821 #SUP  2.96
 42 PHE  HA     43 PRO  HA      2.81            #peak   822 #SUP  6.13
  9 GLU- HB3    10 THR  HB      3.72            #peak   823 #SUP  5.01
 42 PHE  HA     44 VAL  HN      3.86            #peak   824 #SUP  4.54
 23 THR  QG2    24 CYSS HA      4.07            #peak   839 #SUP  4.53
 14 LYS+ HA     16 ASP- HN      4.61            #peak   842 #SUP  1.35
  6 TYR  QE     14 LYS+ HA      4.67            #peak   843 #SUP  3.05
 14 LYS+ HA     14 LYS+ HD2     3.99            #peak   848 #SUP  5.71
 51 MET  HA     53 ASP- HN      4.65            #peak   856 #SUP  3.77
  4 ASP- HA      6 TYR  HN      4.88            #peak   867 #SUP  4.83
 47 SER  HA     50 GLY  HN      4.11            #peak   875 #SUP  2.44
 45 SER  QB     48 CYSS QB      4.74            #peak   886 #SUP  1.68
 46 GLN  QB     47 SER  HA      4.58            #peak   887 #SUP  3.63
 45 SER  HN     45 SER  QB      3.15            #peak   889 #SUP  3.82
 11 CYSS HN     39 CYSS HA      3.82            #peak   890 #SUP  1.89
 45 SER  QB     46 GLN  HN      4.82            #peak   891 #SUP  4.47
 45 SER  HA     45 SER  QB      2.40            #peak   894 #SUP  2.78
 27 GLY  HA2    53 ASP- QB      4.86            #peak   895 #SUP  1.50
 27 GLY  HA2    28 THR  QG2     3.09            #peak   898 #SUP  4.29
 41 SER  HN     41 SER  HB2     3.71            #peak   902 #SUP  4.25
 41 SER  HB2    42 PHE  HN      3.24            #peak   903 #SUP  3.83
  5 PHE  QD     41 SER  HB2     3.94            #peak   904 #SUP  1.50
 46 GLN  HA     50 GLY  HN      4.89            #peak   909 #SUP  3.05
 54 SER  HA     54 SER  HB3     2.80            #peak   922 #SUP  4.07
  7 THR  HA      9 GLU- HN      4.09            #peak   923 #SUP  5.86
  7 THR  HA      8 SER  HN      2.66            #peak   927 #SUP  6.25
  7 THR  HA      7 THR  HB      2.76            #peak   929 #SUP  4.44
 52 ALA  HA     53 ASP- QB      4.13            #peak   931 #SUP  4.00
 41 SER  HN     41 SER  HB3     3.76            #peak   957 #SUP  3.75
  5 PHE  QD     41 SER  HB3     4.47            #peak   959 #SUP  1.50
 19 LEU  HA     22 ASP- HN      4.13            #peak   964 #SUP  3.96
 25 SER  HA     48 CYSS HA      4.89            #peak   969 #SUP  1.50
 19 LEU  HA     22 ASP- HB3     3.91            #peak   972 #SUP  3.42
 25 SER  HA     52 ALA  QB      3.37            #peak   975 #SUP  1.50
 19 LEU  HA     19 LEU  QD1     4.26            #peak   977 #SUP  7.15
 19 LEU  HA     19 LEU  QD2     3.23            #peak   978 #SUP  6.34
 19 LEU  HA     21 TRP  HN      4.80            #peak   979 #SUP  5.74
 26 GLY  HA1    27 GLY  HN      3.56            #peak   985 #SUP  2.47
  7 THR  HB      9 GLU- HN      4.55            #peak   992 #SUP  7.04
  7 THR  HB      8 SER  HN      4.17            #peak   996 #SUP  6.23
  3 GLU- HA      6 TYR  QD      4.42            #peak   998 #SUP  2.78
  7 THR  HB     10 THR  HN      3.99            #peak   999 #SUP  4.86
  3 GLU- HA     17 SER  HB2     3.93            #peak  1002 #SUP  2.31
 21 TRP  HA     21 TRP  HE3     3.83            #peak  1015 #SUP  4.16
 20 ALA  HA     24 CYSS HN      4.37            #peak  1020 #SUP  2.02
 54 SER  HN     54 SER  HB3     3.39            #peak  1021 #SUP  4.28
 13 TYR  QD     20 ALA  HA      3.13            #peak  1023 #SUP  6.08
 13 TYR  QE     20 ALA  HA      4.07            #peak  1024 #SUP  4.38
 33 THR  HN     33 THR  HB      3.02            #peak  1033 #SUP  4.89
 47 SER  QB     48 CYSS HN      3.89            #peak  1034 #SUP  3.36
 54 SER  HB3    55 ASN  HN      3.44            #peak  1036 #SUP  4.84
 33 THR  HB     49 ALA  QB      5.22            #peak  1041 #SUP  1.50
 33 THR  HB     34 VAL  QG2     4.47            #peak  1044 #SUP  5.70
 54 SER  HN     54 SER  HB2     3.21            #peak  1051 #SUP  4.71
 54 SER  HB2    55 ASN  HN      3.27            #peak  1052 #SUP  4.75
 37 GLY  HA1    45 SER  QB      3.30            #peak  1059 #SUP  0.98
 50 GLY  HA2    51 MET  HN      3.58            #peak  1069 #SUP  2.43
  2 ILE  HA      4 ASP- HN      4.33            #peak  1070 #SUP  4.71
  2 ILE  HA      5 PHE  QD      3.45            #peak  1072 #SUP  2.88
 21 TRP  HD1    22 ASP- HA      3.42            #peak  1073 #SUP  4.34
 18 GLN  HA     21 TRP  HN      3.90            #peak  1081 #SUP  4.72
 56 ASP- HN     57 CYSS HB2     4.26            #peak  1082 #SUP  2.92
 18 GLN  HA     21 TRP  HB2     3.82            #peak  1085 #SUP  2.25
 57 CYSS HN     57 CYSS HB2     3.03            #peak  1091 #SUP  2.94
 17 SER  HB3    18 GLN  HA      4.46            #peak  1092 #SUP  3.48
 11 CYSS HN     12 PRO  HD2     4.57            #peak  1097 #SUP  5.74
 11 CYSS HB2    12 PRO  HD2     4.71            #peak  1100 #SUP  5.65
  9 GLU- HA      9 GLU- QG      3.56            #peak  1101 #SUP  4.47
  9 GLU- HA     10 THR  QG2     5.21            #peak  1112 #SUP  6.56
  5 PHE  HB3    41 SER  HN      3.52            #peak  1113 #SUP  4.00
  5 PHE  HB3     6 TYR  HN      4.05            #peak  1114 #SUP  6.16
  5 PHE  HB3    44 VAL  QG1     5.24            #peak  1118 #SUP  4.54
  5 PHE  HB3    44 VAL  QG2     4.35            #peak  1119 #SUP  8.21
 26 GLY  HA2    27 GLY  HN      3.37            #peak  1123 #SUP  3.74
 26 GLY  HA2    28 THR  HN      4.48            #peak  1124 #SUP  1.80
 49 ALA  HA     52 ALA  HN      3.70            #peak  1128 #SUP  1.38
 33 THR  QG2    49 ALA  HA      5.04            #peak  1133 #SUP  1.20
 32 GLY  HN     49 ALA  HA      4.51            #peak  1134 #SUP  1.31
 24 CYSS HN     24 CYSS HB2     3.41            #peak  1135 #SUP  5.04
 45 SER  HA     47 SER  HN      4.63            #peak  1139 #SUP  4.79
 36 CYSS HA     45 SER  HA      3.42            #peak  1141 #SUP  1.50
 33 THR  HA     49 ALA  HA      4.30            #peak  1142 #SUP  3.02
 24 CYSS HB2    35 CYSS HB3     4.88            #peak  1146 #SUP  0.75
 49 ALA  HA     52 ALA  QB      3.70            #peak  1148 #SUP  1.21
 24 CYSS HB2    25 SER  HN      4.45            #peak  1150 #SUP  4.26
 21 TRP  HA     24 CYSS HB2     4.12            #peak  1153 #SUP  0.75
 44 VAL  HA     48 CYSS HN      4.42            #peak  1159 #SUP  3.43
 44 VAL  HA     47 SER  HN      3.53            #peak  1161 #SUP  4.22
 44 VAL  HA     46 GLN  HN      4.59            #peak  1163 #SUP  4.62
 27 GLY  HA1    53 ASP- HA      4.83            #peak  1171 #SUP  0.75
 42 PHE  HA     44 VAL  HA      4.87            #peak  1172 #SUP  3.12
 34 VAL  HA     37 GLY  HN      4.27            #peak  1176 #SUP  0.75
 11 CYSS HB2    39 CYSS HB3     4.83            #peak  1186 #SUP  0.75
  7 THR  HN     11 CYSS HB2     4.69            #peak  1189 #SUP  1.57
  8 SER  HN      8 SER  QB      2.61            #peak  1190 #SUP  4.62
 11 CYSS HN     11 CYSS HB2     3.15            #peak  1191 #SUP  3.86
  6 TYR  QE     11 CYSS HB2     3.19            #peak  1193 #SUP  2.37
  7 THR  HA      8 SER  QB      4.33            #peak  1195 #SUP  5.77
 23 THR  HB     24 CYSS HN      2.94            #peak  1202 #SUP  4.47
 23 THR  HN     23 THR  HB      3.14            #peak  1203 #SUP  4.47
 20 ALA  HA     23 THR  HB      3.88            #peak  1206 #SUP  2.96
 23 THR  HA     23 THR  HB      2.91            #peak  1207 #SUP  3.00
 12 PRO  HD3    13 TYR  QD      4.35            #peak  1211 #SUP  8.63
 12 PRO  HD3    13 TYR  HN      3.92            #peak  1213 #SUP  7.26
 12 PRO  HD3    13 TYR  QE      4.49            #peak  1214 #SUP  7.59
 25 SER  HB2    52 ALA  HN      4.35            #peak  1220 #SUP  3.06
 25 SER  HB2    51 MET  HN      4.53            #peak  1221 #SUP  1.90
 25 SER  HB2    51 MET  HG3     4.25            #peak  1224 #SUP  2.39
 17 SER  HN     17 SER  HB2     3.17            #peak  1248 #SUP  3.84
 17 SER  HB2    18 GLN  HN      4.55            #peak  1249 #SUP  3.71
 33 THR  HA     36 CYSS HN      3.92            #peak  1253 #SUP  0.75
  6 TYR  HN      6 TYR  HB2     3.21            #peak  1263 #SUP  4.74
 31 CYSS HB2    32 GLY  HN      3.63            #peak  1272 #SUP  3.31
 31 CYSS HN     31 CYSS HB2     3.85            #peak  1273 #SUP  3.81
 26 GLY  HN     31 CYSS HB2     4.56            #peak  1274 #SUP  1.50
  6 TYR  QE     17 SER  HB3     4.91            #peak  1278 #SUP  4.73
  3 GLU- HA     17 SER  HB3     3.53            #peak  1280 #SUP  3.53
 17 SER  HA     17 SER  HB3     2.79            #peak  1283 #SUP  2.88
 17 SER  HN     17 SER  HB3     3.59            #peak  1285 #SUP  3.57
 36 CYSS HB2    37 GLY  HN      4.30            #peak  1286 #SUP  3.63
 36 CYSS HN     36 CYSS HB2     3.82            #peak  1291 #SUP  4.31
 33 THR  QG2    36 CYSS HB2     5.34            #peak  1293 #SUP  1.50
 48 CYSS HA     51 MET  HN      4.32            #peak  1296 #SUP  0.75
 21 TRP  HH2    48 CYSS HA      3.92            #peak  1297 #SUP  4.76
 21 TRP  HZ3    48 CYSS HA      4.04            #peak  1298 #SUP  4.31
 42 PHE  HN     42 PHE  HB2     2.97            #peak  1302 #SUP  4.32
 21 TRP  HN     21 TRP  HB2     3.17            #peak  1303 #SUP  5.16
 21 TRP  HB2    40 PHE  QE      3.55            #peak  1304 #SUP  4.86
  2 ILE  QD1    21 TRP  HB2     3.99            #peak  1312 #SUP  5.39
 21 TRP  HB3    22 ASP- HN      3.20            #peak  1318 #SUP  5.86
 21 TRP  HN     21 TRP  HB3     3.15            #peak  1319 #SUP  5.23
  3 GLU- HA      6 TYR  HB3     3.74            #peak  1329 #SUP  3.20
  8 SER  HA      8 SER  QB      2.86            #peak  1330 #SUP  3.36
  6 TYR  HN      6 TYR  HB3     3.08            #peak  1333 #SUP  5.36
 40 PHE  HN     40 PHE  HB2     4.03            #peak  1341 #SUP  5.29
 43 PRO  HA     45 SER  HN      3.76            #peak  1342 #SUP  6.00
 39 CYSS HN     39 CYSS HB2     3.39            #peak  1343 #SUP  6.22
 42 PHE  QD     43 PRO  HA      3.64            #peak  1345 #SUP  6.23
 36 CYSS HA     40 PHE  HB2     4.05            #peak  1350 #SUP  1.17
 40 PHE  HB2    41 SER  HN      3.67            #peak  1358 #SUP  4.78
 42 PHE  HN     42 PHE  HB3     3.06            #peak  1361 #SUP  4.44
 14 LYS+ HE3    15 ASN  HB2     2.70            #peak  1367 #SUP  4.17
 59 ASN  HN     59 ASN  HB2     3.40            #peak  1370 #SUP  3.29
 36 CYSS HN     36 CYSS HB3     3.04            #peak  1372 #SUP  4.90
 36 CYSS HB3    37 GLY  HN      3.64            #peak  1373 #SUP  3.63
 43 PRO  HD3    44 VAL  HN      4.04            #peak  1379 #SUP  7.87
  5 PHE  HZ     43 PRO  HD3     5.05            #peak  1382 #SUP  2.00
 35 CYSS HN     35 CYSS HB3     2.91            #peak  1391 #SUP  5.41
 13 TYR  HB3    14 LYS+ HN      4.30            #peak  1395 #SUP  6.35
 13 TYR  HB3    20 ALA  HN      4.47            #peak  1396 #SUP  3.52
 13 TYR  HB3    20 ALA  HA      4.42            #peak  1401 #SUP  6.00
 59 ASN  HB3    60 ALA  HN      3.35            #peak  1405 #SUP  3.89
 13 TYR  HA     14 LYS+ HE2     4.82            #peak  1407 #SUP  6.62
 31 CYSS HB3    52 ALA  QB      3.84            #peak  1412 #SUP  2.59
 11 CYSS HN     11 CYSS HB3     3.23            #peak  1413 #SUP  3.47
 11 CYSS HB3    13 TYR  HN      4.10            #peak  1416 #SUP  1.82
 11 CYSS HB3    39 CYSS HA      3.99            #peak  1419 #SUP  1.59
  8 SER  HA     11 CYSS HB3     3.38            #peak  1422 #SUP  0.75
 31 CYSS HB3    32 GLY  HN      4.54            #peak  1430 #SUP  3.31
 31 CYSS HN     31 CYSS HB3     3.13            #peak  1432 #SUP  4.08
  6 TYR  QE     11 CYSS HB3     4.34            #peak  1433 #SUP  0.75
 26 GLY  HN     31 CYSS HB3     4.57            #peak  1434 #SUP  1.50
  5 PHE  HB2    41 SER  HN      4.69            #peak  1439 #SUP  2.96
 30 ASN  HN     30 ASN  HB2     3.79            #peak  1440 #SUP  3.00
  5 PHE  HN      5 PHE  HB2     3.37            #peak  1441 #SUP  5.47
  5 PHE  HB2     6 TYR  HN      4.07            #peak  1443 #SUP  6.75
 13 TYR  HB2    20 ALA  QB      3.74            #peak  1464 #SUP  5.89
 54 SER  HB3    55 ASN  HB2     3.80            #peak  1465 #SUP  4.40
 55 ASN  HN     55 ASN  HB2     2.84            #peak  1472 #SUP  6.25
 13 TYR  HA     14 LYS+ HE3     4.73            #peak  1473 #SUP  5.87
 52 ALA  QB     53 ASP- QB      5.17            #peak  1475 #SUP  3.31
 15 ASN  HB3    19 LEU  HB3     4.25            #peak  1476 #SUP  2.96
 53 ASP- QB     54 SER  HN      3.22            #peak  1477 #SUP  3.94
 52 ALA  HN     53 ASP- QB      5.13            #peak  1478 #SUP  3.45
 55 ASN  HB2    56 ASP- HN      3.91            #peak  1480 #SUP  3.92
  6 TYR  QD     39 CYSS HB3     4.25            #peak  1489 #SUP  3.89
  6 TYR  QE     39 CYSS HB3     4.20            #peak  1490 #SUP  2.96
 16 ASP- HB2    19 LEU  QD1     4.28            #peak  1498 #SUP  4.46
 16 ASP- HN     16 ASP- HB2     3.97            #peak  1499 #SUP  3.47
 16 ASP- HB2    19 LEU  HN      4.30            #peak  1501 #SUP  2.56
 22 ASP- HN     22 ASP- HB2     3.13            #peak  1507 #SUP  5.98
 24 CYSS HN     24 CYSS HB3     3.28            #peak  1508 #SUP  5.23
 48 CYSS HN     48 CYSS QB      3.10            #peak  1509 #SUP  4.42
 22 ASP- HB2    23 THR  HN      3.69            #peak  1510 #SUP  4.45
 48 CYSS QB     49 ALA  HN      3.89            #peak  1511 #SUP  2.85
 24 CYSS HB3    25 SER  HN      3.94            #peak  1512 #SUP  4.26
 21 TRP  HZ3    48 CYSS QB      3.37            #peak  1513 #SUP  4.31
 21 TRP  HE3    48 CYSS QB      3.77            #peak  1514 #SUP  4.00
 19 LEU  HA     22 ASP- HB2     3.86            #peak  1515 #SUP  5.63
 24 CYSS HB3    35 CYSS HB2     2.74            #peak  1519 #SUP  2.25
 48 CYSS HA     48 CYSS QB      2.92            #peak  1520 #SUP  2.87
 40 PHE  HB3    41 SER  HN      4.48            #peak  1523 #SUP  4.81
 21 TRP  HH2    51 MET  HG2     4.47            #peak  1530 #SUP  2.00
 40 PHE  HB3    45 SER  QB      5.00            #peak  1535 #SUP  2.81
 34 VAL  QG1    38 GLN  QB      4.11            #peak  1538 #SUP  2.63
 38 GLN  HN     38 GLN  QB      3.20            #peak  1539 #SUP  4.26
 12 PRO  HD2    38 GLN  QB      4.56            #peak  1542 #SUP  2.96
 51 MET  HN     51 MET  HG3     4.67            #peak  1543 #SUP  3.58
 55 ASN  HN     55 ASN  HB3     3.34            #peak  1549 #SUP  5.11
  4 ASP- HN      4 ASP- HB2     3.18            #peak  1553 #SUP  7.02
  4 ASP- HB2     5 PHE  QE      3.96            #peak  1554 #SUP  5.03
  4 ASP- HB2     5 PHE  QD      3.69            #peak  1555 #SUP  7.13
 17 SER  HA     21 TRP  HN      4.34            #peak  1560 #SUP  2.31
 30 ASN  HN     30 ASN  HB3     3.64            #peak  1574 #SUP  3.00
 16 ASP- HN     16 ASP- HB3     4.18            #peak  1576 #SUP  3.72
 30 ASN  HB3    31 CYSS HN      4.70            #peak  1577 #SUP  4.35
 34 VAL  QG1    38 GLN  QG      4.80            #peak  1587 #SUP  0.75
 12 PRO  HD2    38 GLN  QG      4.44            #peak  1592 #SUP  2.00
  3 GLU- HN      3 GLU- HG2     4.22            #peak  1593 #SUP  6.97
  3 GLU- HG2     4 ASP- HN      4.60            #peak  1594 #SUP  6.78
 25 SER  HN     25 SER  HB3     3.62            #peak  1598 #SUP  3.93
 21 TRP  HZ2    25 SER  HB3     4.89            #peak  1599 #SUP  2.22
 21 TRP  HH2    25 SER  HB3     4.14            #peak  1600 #SUP  0.92
  3 GLU- HA      3 GLU- HG2     4.24            #peak  1602 #SUP  5.67
  4 ASP- HB3     5 PHE  HN      4.36            #peak  1614 #SUP  6.46
  4 ASP- HN      4 ASP- HB3     3.88            #peak  1615 #SUP  6.74
  4 ASP- HB3     5 PHE  QE      4.58            #peak  1622 #SUP  5.10
  9 GLU- HN      9 GLU- QG      3.62            #peak  1628 #SUP  5.53
  9 GLU- HB3     9 GLU- QG      2.56            #peak  1633 #SUP  4.61
 46 GLN  QB     47 SER  HN      3.46            #peak  1635 #SUP  5.33
 42 PHE  QE     46 GLN  QB      3.80            #peak  1636 #SUP  3.44
 42 PHE  QD     46 GLN  QB      3.94            #peak  1637 #SUP  2.23
 46 GLN  HN     46 GLN  QB      2.94            #peak  1638 #SUP  5.40
 43 PRO  HA     46 GLN  QB      4.10            #peak  1640 #SUP  4.45
 46 GLN  QB     46 GLN  HG3     2.62            #peak  1641 #SUP  4.43
  3 GLU- HN      3 GLU- HB2     3.10            #peak  1643 #SUP  7.65
  3 GLU- HB2     4 ASP- HN      4.48            #peak  1644 #SUP  7.02
  3 GLU- HA      3 GLU- HB2     3.05            #peak  1648 #SUP  6.31
 51 MET  HN     51 MET  QB      2.95            #peak  1653 #SUP  4.72
  2 ILE  QG2    44 VAL  HB      5.08            #peak  1662 #SUP  0.75
 44 VAL  HB     45 SER  HN      3.44            #peak  1665 #SUP  5.33
 44 VAL  HN     44 VAL  HB      3.12            #peak  1666 #SUP  5.61
 40 PHE  HB2    44 VAL  HB      3.64            #peak  1670 #SUP  5.38
  5 PHE  HB2    44 VAL  HB      3.87            #peak  1671 #SUP  4.00
 18 GLN  HN     18 GLN  QB      2.80            #peak  1675 #SUP  4.51
 18 GLN  QB     19 LEU  HN      3.15            #peak  1676 #SUP  5.30
 18 GLN  QB     18 GLN  HG3     3.00            #peak  1679 #SUP  3.97
  3 GLU- HB3     4 ASP- HN      3.96            #peak  1682 #SUP  7.02
  7 THR  HB      9 GLU- HB2     3.73            #peak  1691 #SUP  2.61
  9 GLU- HN      9 GLU- HB2     3.00            #peak  1693 #SUP  6.17
  9 GLU- HA      9 GLU- HB2     2.74            #peak  1694 #SUP  5.19
  9 GLU- HB2    10 THR  HN      3.96            #peak  1697 #SUP  5.75
  9 GLU- HB2    10 THR  QG2     4.55            #peak  1699 #SUP  5.38
  9 GLU- HB3    10 THR  QG2     4.58            #peak  1704 #SUP  6.15
  9 GLU- HN      9 GLU- HB3     3.28            #peak  1705 #SUP  6.50
  9 GLU- HB3    10 THR  HN      3.92            #peak  1706 #SUP  6.44
 20 ALA  QB     21 TRP  HN      3.44            #peak  1715 #SUP  4.09
 20 ALA  HN     20 ALA  QB      3.04            #peak  1717 #SUP  4.99
 20 ALA  QB     40 PHE  QE      3.74            #peak  1718 #SUP  4.74
  6 TYR  QD     20 ALA  QB      4.22            #peak  1719 #SUP  0.75
 13 TYR  QD     20 ALA  QB      3.83            #peak  1720 #SUP  6.52
  6 TYR  QE     20 ALA  QB      3.29            #peak  1721 #SUP  2.00
 13 TYR  HB3    20 ALA  QB      4.02            #peak  1725 #SUP  6.44
 20 ALA  QB     39 CYSS HB3     3.72            #peak  1727 #SUP  1.28
 17 SER  HA     20 ALA  QB      3.31            #peak  1728 #SUP  1.50
 19 LEU  QD1    20 ALA  QB      5.50            #peak  1730 #SUP  5.05
 34 VAL  HN     34 VAL  HB      2.89            #peak  1736 #SUP  5.74
 34 VAL  HB     35 CYSS HN      3.03            #peak  1737 #SUP  5.63
 43 PRO  HB2    46 GLN  QB      4.50            #peak  1746 #SUP  1.83
 14 LYS+ HN     14 LYS+ QB      3.21            #peak  1752 #SUP  5.71
 14 LYS+ QB     14 LYS+ HD2     2.75            #peak  1755 #SUP  6.09
  2 ILE  HB      2 ILE  QD1     3.94            #peak  1757 #SUP  4.61
 12 PRO  HG3    13 TYR  HN      5.06            #peak  1759 #SUP  8.29
 12 PRO  HG3    13 TYR  QE      4.33            #peak  1760 #SUP  7.53
 12 PRO  HG3    13 TYR  QD      4.79            #peak  1771 #SUP  8.56
 43 PRO  HG2    44 VAL  QG2     5.29            #peak  1776 #SUP  6.87
 32 GLY  HN     52 ALA  QB      3.98            #peak  1778 #SUP  3.00
 52 ALA  HN     52 ALA  QB      3.15            #peak  1779 #SUP  4.09
 51 MET  QB     52 ALA  QB      4.91            #peak  1790 #SUP  4.94
 19 LEU  HN     19 LEU  HB2     2.94            #peak  1791 #SUP  6.81
 16 ASP- HB3    19 LEU  HB2     3.89            #peak  1794 #SUP  3.30
 19 LEU  HB2    19 LEU  QD1     3.32            #peak  1796 #SUP  6.97
 19 LEU  HB2    19 LEU  QD2     4.17            #peak  1797 #SUP  6.17
 14 LYS+ HN     14 LYS+ HD2     4.11            #peak  1802 #SUP  7.15
 33 THR  HN     49 ALA  QB      5.23            #peak  1808 #SUP  1.50
 49 ALA  QB     50 GLY  HN      3.79            #peak  1809 #SUP  2.99
 19 LEU  HB3    20 ALA  HN      3.62            #peak  1810 #SUP  6.81
 49 ALA  HN     49 ALA  QB      2.98            #peak  1811 #SUP  3.79
 49 ALA  QB     50 GLY  HA2     5.26            #peak  1814 #SUP  2.13
 19 LEU  HN     19 LEU  HB3     3.00            #peak  1824 #SUP  5.91
 16 ASP- HB3    19 LEU  HB3     4.55            #peak  1828 #SUP  3.89
 19 LEU  HB3    19 LEU  QD1     3.60            #peak  1829 #SUP  7.22
 19 LEU  HB3    19 LEU  QD2     3.57            #peak  1830 #SUP  6.24
 60 ALA  HN     60 ALA  QB      3.15            #peak  1837 #SUP  3.31
 59 ASN  HB3    60 ALA  QB      5.09            #peak  1839 #SUP  3.91
 14 LYS+ HN     14 LYS+ QG      4.04            #peak  1844 #SUP  6.83
 33 THR  HN     33 THR  QG2     4.06            #peak  1849 #SUP  4.84
 33 THR  QG2    34 VAL  HN      4.32            #peak  1850 #SUP  5.39
 33 THR  QG2    37 GLY  HN      5.07            #peak  1851 #SUP  2.84
 43 PRO  HG3    44 VAL  HN      5.30            #peak  1858 #SUP  6.91
  2 ILE  HG12    3 GLU- HN      3.68            #peak  1865 #SUP  7.35
  2 ILE  HG12   17 SER  HB3     4.86            #peak  1867 #SUP  2.25
 27 GLY  HN     28 THR  QG2     4.86            #peak  1869 #SUP  4.29
 42 PHE  QD     43 PRO  HB3     3.43            #peak  1872 #SUP  7.18
  7 THR  HB     10 THR  QG2     4.85            #peak  1876 #SUP  3.87
  9 GLU- HN     10 THR  QG2     5.10            #peak  1880 #SUP  6.52
 10 THR  QG2    11 CYSS HN      4.36            #peak  1881 #SUP  6.60
 10 THR  HN     10 THR  QG2     3.75            #peak  1884 #SUP  7.86
 19 LEU  HG     20 ALA  HN      4.36            #peak  1895 #SUP  5.73
 13 TYR  HB2    19 LEU  HG      4.74            #peak  1899 #SUP  3.52
 34 VAL  HN     34 VAL  QG2     3.18            #peak  1903 #SUP  6.88
 34 VAL  QG2    35 CYSS HN      4.45            #peak  1909 #SUP  5.63
 19 LEU  HN     19 LEU  QD1     4.78            #peak  1911 #SUP  6.90
 13 TYR  QD     19 LEU  QD1     3.70            #peak  1912 #SUP  7.90
 13 TYR  HB3    19 LEU  QD1     3.93            #peak  1914 #SUP  6.30
 14 LYS+ HE2    19 LEU  QD1     5.47            #peak  1915 #SUP  2.60
 13 TYR  HB2    19 LEU  QD1     4.30            #peak  1917 #SUP  7.26
 16 ASP- HB3    19 LEU  QD1     4.72            #peak  1920 #SUP  2.96
  7 THR  QG2    41 SER  HB3     3.92            #peak  1927 #SUP  2.43
  7 THR  QG2    41 SER  HN      3.97            #peak  1930 #SUP  3.63
 23 THR  QG2    24 CYSS HN      4.16            #peak  1931 #SUP  5.97
  7 THR  HN      7 THR  QG2     3.97            #peak  1934 #SUP  5.63
 23 THR  HN     23 THR  QG2     4.54            #peak  1935 #SUP  5.43
  7 THR  QG2     8 SER  HN      4.82            #peak  1936 #SUP  5.14
  7 THR  QG2    11 CYSS HN      4.94            #peak  1937 #SUP  1.09
 23 THR  QG2    31 CYSS HN      4.83            #peak  1938 #SUP  3.00
 13 TYR  QE     23 THR  QG2     3.54            #peak  1939 #SUP  3.52
 34 VAL  HN     34 VAL  QG1     4.42            #peak  1950 #SUP  6.48
 34 VAL  QG1    35 CYSS HN      3.95            #peak  1951 #SUP  6.26
  2 ILE  HG13    3 GLU- HN      4.48            #peak  1962 #SUP  7.11
 19 LEU  QD2    20 ALA  HN      4.60            #peak  1963 #SUP  6.17
 13 TYR  QD     19 LEU  QD2     4.97            #peak  1964 #SUP  4.21
 19 LEU  QD2    22 ASP- HB3     4.95            #peak  1967 #SUP  2.13
 44 VAL  QG1    47 SER  HN      4.62            #peak  1971 #SUP  3.85
 44 VAL  QG1    45 SER  HN      4.44            #peak  1974 #SUP  5.91
  5 PHE  QD     44 VAL  QG1     4.84            #peak  1976 #SUP  4.00
 21 TRP  HZ3    44 VAL  QG1     3.31            #peak  1978 #SUP  1.50
 44 VAL  QG1    45 SER  HA      4.98            #peak  1981 #SUP  4.34
  5 PHE  HB2    44 VAL  QG1     4.23            #peak  1986 #SUP  4.00
 44 VAL  QG1    48 CYSS QB      4.26            #peak  1988 #SUP  3.47
  2 ILE  HB     44 VAL  QG1     4.66            #peak  1991 #SUP  1.50
 12 PRO  HB2    13 TYR  QD      4.28            #peak  1993 #SUP  8.52
 12 PRO  HB2    13 TYR  HN      4.00            #peak  1995 #SUP  7.42
 12 PRO  HB2    13 TYR  QE      4.25            #peak  1996 #SUP  8.13
  2 ILE  QG2     3 GLU- HN      4.32            #peak  2002 #SUP  8.28
  2 ILE  QG2    21 TRP  HZ3     5.00            #peak  2005 #SUP  1.11
  2 ILE  QG2     3 GLU- HA      5.20            #peak  2007 #SUP  7.01
  2 ILE  QG2    17 SER  HB3     5.40            #peak  2009 #SUP  2.25
  2 ILE  QG2     3 GLU- HB2     5.22            #peak  2010 #SUP  6.02
 44 VAL  QG2    45 SER  HN      4.75            #peak  2014 #SUP  5.82
  5 PHE  HN     44 VAL  QG2     5.16            #peak  2015 #SUP  3.71
 44 VAL  HN     44 VAL  QG2     3.39            #peak  2016 #SUP  8.05
  5 PHE  QE     44 VAL  QG2     4.20            #peak  2017 #SUP  5.73
  5 PHE  QD     44 VAL  QG2     3.55            #peak  2018 #SUP  7.73
  5 PHE  HZ     44 VAL  QG2     5.34            #peak  2019 #SUP  4.96
  2 ILE  QD1    21 TRP  HN      4.80            #peak  2030 #SUP  2.95
  2 ILE  QD1     3 GLU- HN      5.23            #peak  2031 #SUP  7.11
  2 ILE  QD1    40 PHE  QE      4.79            #peak  2032 #SUP  0.75
  2 ILE  QD1    21 TRP  HH2     5.13            #peak  2034 #SUP  3.04
  2 ILE  HA      2 ILE  QD1     4.66            #peak  2036 #SUP  5.31
  2 ILE  QD1    17 SER  HB2     5.09            #peak  2038 #SUP  3.07
  2 ILE  QD1    21 TRP  HB3     4.34            #peak  2043 #SUP  3.55
  2 ILE  QD1    17 SER  HA      5.23            #peak  2044 #SUP  3.54
  6 TYR  QD     40 PHE  QE      4.52            #peak     2 #SUP  1.83
 17 SER  HB3    40 PHE  QE      4.47            #peak     7 #SUP  0.75
 17 SER  HA     40 PHE  QE      4.42            #peak    10 #SUP  0.75
  6 TYR  QD     40 PHE  QD      4.28            #peak    15 #SUP  7.91
 40 PHE  HA     40 PHE  QD      3.62            #peak    16 #SUP  5.63
 36 CYSS HA     40 PHE  QD      3.46            #peak    20 #SUP  1.79
 40 PHE  QD     45 SER  HA      4.17            #peak    22 #SUP  2.31
 21 TRP  HZ2    51 MET  QB      3.43            #peak    61 #SUP  4.00
  6 TYR  QE      8 SER  HA      4.02            #peak   102 #SUP  1.55
 21 TRP  HZ3    25 SER  HB2     4.40            #peak   122 #SUP  0.85
 21 TRP  HE3    48 CYSS HA      4.14            #peak   133 #SUP  4.00
  6 TYR  HA     40 PHE  QD      3.66            #peak   148 #SUP  5.61
  6 TYR  HA     40 PHE  HA      3.56            #peak   151 #SUP  3.87
  3 GLU- HA      6 TYR  HA      4.37            #peak   152 #SUP  3.20
  6 TYR  HA     17 SER  HB2     3.91            #peak   153 #SUP  1.50
 41 SER  HA     42 PHE  HA      4.25            #peak   157 #SUP  4.91
 55 ASN  HA     59 ASN  HB2     4.52            #peak   163 #SUP  0.75
 24 CYSS HB2    31 CYSS HA      4.47            #peak   169 #SUP  1.83
 28 THR  HA     57 CYSS HA      4.24            #peak   192 #SUP  1.64
 42 PHE  HA     45 SER  QB      2.57            #peak   204 #SUP  3.05
 53 ASP- HA     54 SER  HA      4.26            #peak   205 #SUP  3.46
 24 CYSS HA     31 CYSS HA      2.84            #peak   219 #SUP  1.50
 55 ASN  HB3    56 ASP- HA      4.15            #peak   234 #SUP  4.69
 41 SER  HA     41 SER  HB2     2.67            #peak   258 #SUP  3.62
 28 THR  HA     28 THR  HB      2.73            #peak   287 #SUP  3.00
 41 SER  HA     41 SER  HB3     2.95            #peak   289 #SUP  2.91
 21 TRP  HA     40 PHE  QE      3.81            #peak   313 #SUP  3.53
 19 LEU  QD1    20 ALA  HA      4.63            #peak   333 #SUP  5.54
 21 TRP  HH2    47 SER  QB      3.70            #peak   334 #SUP  3.21
 47 SER  HA     47 SER  QB      2.43            #peak   335 #SUP  2.61
 57 CYSS HA     58 PRO  HD2     3.16            #peak   342 #SUP  4.91
 47 SER  HA     50 GLY  HA2     2.86            #peak   345 #SUP  1.76
 54 SER  HA     54 SER  HB2     2.85            #peak   346 #SUP  4.32
 44 VAL  HA     47 SER  QB      3.44            #peak   347 #SUP  1.83
  2 ILE  HA     44 VAL  QG2     4.18            #peak   365 #SUP  0.75
 11 CYSS HA     12 PRO  HD2     3.15            #peak   376 #SUP  6.38
 12 PRO  HD2    20 ALA  QB      4.41            #peak   380 #SUP  2.32
  5 PHE  HB3    40 PHE  QD      4.57            #peak   383 #SUP  4.27
 36 CYSS HB3    45 SER  HA      4.19            #peak   400 #SUP  2.96
 34 VAL  HA     38 GLN  QB      4.30            #peak   418 #SUP  0.02
  6 TYR  QD      8 SER  QB      4.48            #peak   425 #SUP  3.56
 11 CYSS HB2    39 CYSS HA      3.09            #peak   429 #SUP  3.07
 21 TRP  HZ2    25 SER  HB2     4.56            #peak   445 #SUP  2.12
 25 SER  HA     25 SER  HB2     3.01            #peak   446 #SUP  2.44
 28 THR  HA     58 PRO  HD3     3.81            #peak   452 #SUP  0.75
 57 CYSS HA     58 PRO  HD3     3.31            #peak   453 #SUP  5.63
 24 CYSS HB2    35 CYSS HB2     3.26            #peak   456 #SUP  3.87
 25 SER  HB2    48 CYSS HA      3.14            #peak   457 #SUP  1.50
  6 TYR  QE     17 SER  HB2     4.50            #peak   465 #SUP  5.89
 17 SER  HA     17 SER  HB2     2.80            #peak   468 #SUP  3.25
  6 TYR  HB2    40 PHE  QD      4.48            #peak   471 #SUP  3.18
  5 PHE  QE     43 PRO  HD2     4.67            #peak   472 #SUP  1.22
  6 TYR  QD     17 SER  HB2     3.37            #peak   474 #SUP  4.97
  3 GLU- HA      6 TYR  HB2     3.54            #peak   478 #SUP  4.99
  3 GLU- HB2    17 SER  HB2     3.82            #peak   480 #SUP  0.99
 31 CYSS HA     31 CYSS HB2     2.95            #peak   482 #SUP  3.00
 36 CYSS HB2    45 SER  HA      3.31            #peak   489 #SUP  1.50
 25 SER  HB3    48 CYSS HA      3.98            #peak   498 #SUP  1.50
 21 TRP  HB2    21 TRP  HE3     3.54            #peak   504 #SUP  4.31
 42 PHE  HA     42 PHE  HB2     3.00            #peak   506 #SUP  4.50
 21 TRP  HB3    21 TRP  HD1     3.24            #peak   510 #SUP  5.05
 18 GLN  HA     21 TRP  HB3     3.58            #peak   512 #SUP  2.25
 40 PHE  HB2    45 SER  HA      4.08            #peak   527 #SUP  4.58
 42 PHE  HA     42 PHE  HB3     3.03            #peak   537 #SUP  4.62
 15 ASN  HA     15 ASN  HB2     3.04            #peak   539 #SUP  4.10
 36 CYSS HB3    45 SER  QB      4.42            #peak   540 #SUP  2.42
 59 ASN  HB2    60 ALA  QB      4.74            #peak   550 #SUP  3.95
 56 ASP- HA     56 ASP- HB2     2.76            #peak   560 #SUP  2.67
 13 TYR  HB3    19 LEU  HG      4.21            #peak   567 #SUP  0.02
 59 ASN  HA     59 ASN  HB3     2.86            #peak   577 #SUP  3.45
  5 PHE  HB2    40 PHE  QD      4.30            #peak   594 #SUP  3.21
 30 ASN  HA     30 ASN  HB2     2.71            #peak   602 #SUP  3.18
 13 TYR  HB2    20 ALA  HA      4.28            #peak   605 #SUP  5.46
  2 ILE  HA      5 PHE  HB2     4.64            #peak   606 #SUP  1.53
 23 THR  QG2    30 ASN  HB2     4.29            #peak   614 #SUP  2.69
 15 ASN  HB3    19 LEU  HB2     4.38            #peak   617 #SUP  2.08
 53 ASP- HA     53 ASP- QB      2.54            #peak   618 #SUP  4.96
 54 SER  HB2    55 ASN  HB2     4.37            #peak   619 #SUP  4.56
 27 GLY  HA1    53 ASP- QB      3.81            #peak   629 #SUP  2.96
 39 CYSS HB3    40 PHE  QD      4.79            #peak   631 #SUP  6.75
 16 ASP- HB2    19 LEU  HB3     3.96            #peak   644 #SUP  5.63
 21 TRP  HZ2    51 MET  HG2     4.07            #peak   657 #SUP  2.96
 21 TRP  HZ2    51 MET  HG3     4.24            #peak   670 #SUP  1.50
 11 CYSS HA     38 GLN  QB      4.33            #peak   672 #SUP  2.96
 51 MET  HA     51 MET  HG3     4.20            #peak   673 #SUP  3.20
 35 CYSS HA     38 GLN  QB      3.92            #peak   675 #SUP  1.19
 30 ASN  HA     30 ASN  HB3     2.43            #peak   700 #SUP  3.18
 23 THR  QG2    30 ASN  HB3     4.54            #peak   704 #SUP  2.69
 46 GLN  HA     46 GLN  HG2     3.57            #peak   707 #SUP  2.74
 11 CYSS HA     38 GLN  QG      3.95            #peak   712 #SUP  2.00
 38 GLN  HA     38 GLN  QG      3.42            #peak   714 #SUP  3.32
 38 GLN  QB     38 GLN  QG      2.84            #peak   716 #SUP  2.59
  3 GLU- HB2     3 GLU- HG2     2.75            #peak   717 #SUP  5.27
 25 SER  HA     25 SER  HB3     2.76            #peak   719 #SUP  2.44
 18 GLN  HA     18 GLN  HG2     3.91            #peak   720 #SUP  3.44
  3 GLU- HA      3 GLU- HG3     3.86            #peak   725 #SUP  5.86
 46 GLN  HA     46 GLN  QB      2.93            #peak   745 #SUP  4.43
 21 TRP  HH2    51 MET  QB      4.40            #peak   751 #SUP  2.44
 51 MET  HA     51 MET  QB      3.00            #peak   758 #SUP  4.54
 25 SER  HA     51 MET  QB      3.74            #peak   759 #SUP  4.00
 25 SER  HB2    51 MET  QB      3.18            #peak   762 #SUP  5.91
 48 CYSS HA     51 MET  QB      3.69            #peak   763 #SUP  0.75
 40 PHE  QD     44 VAL  HB      4.53            #peak   765 #SUP  3.55
  5 PHE  QD     44 VAL  HB      4.55            #peak   767 #SUP  4.00
  5 PHE  HB3    44 VAL  HB      3.72            #peak   769 #SUP  4.96
  3 GLU- HA      3 GLU- HB3     2.99            #peak   783 #SUP  5.72
  9 GLU- HA      9 GLU- HB3     2.91            #peak   799 #SUP  5.37
 20 ALA  QB     39 CYSS HB2     4.48            #peak   809 #SUP  1.28
  2 ILE  HB     40 PHE  QD      4.62            #peak   830 #SUP  1.50
 31 CYSS HA     52 ALA  QB      4.56            #peak   847 #SUP  2.59
 32 GLY  HA1    52 ALA  QB      4.52            #peak   848 #SUP  1.99
 19 LEU  HA     19 LEU  HB2     2.86            #peak   850 #SUP  6.49
 31 CYSS HB2    52 ALA  QB      4.20            #peak   856 #SUP  4.03
 16 ASP- HB2    19 LEU  HB2     3.59            #peak   860 #SUP  5.07
 46 GLN  HA     49 ALA  QB      3.29            #peak   870 #SUP  1.74
 19 LEU  HB3    20 ALA  HA      4.51            #peak   872 #SUP  4.38
 33 THR  HA     49 ALA  QB      3.36            #peak   876 #SUP  3.46
 36 CYSS HB2    49 ALA  QB      4.50            #peak   879 #SUP  4.00
 15 ASN  HB2    19 LEU  HB3     4.47            #peak   880 #SUP  1.51
 36 CYSS HB3    49 ALA  QB      4.31            #peak   881 #SUP  3.99
 14 LYS+ QG     14 LYS+ HE2     4.26            #peak   895 #SUP  5.41
  2 ILE  HA      2 ILE  HG12    4.23            #peak   901 #SUP  5.63
 33 THR  QG2    34 VAL  HA      4.38            #peak   902 #SUP  5.22
 33 THR  HA     33 THR  QG2     3.29            #peak   904 #SUP  3.74
  2 ILE  HG12    3 GLU- HA      4.40            #peak   911 #SUP  6.73
 42 PHE  QE     43 PRO  HB3     4.56            #peak   918 #SUP  4.86
 28 THR  HA     28 THR  QG2     3.10            #peak   920 #SUP  4.42
 27 GLY  HA1    28 THR  QG2     4.89            #peak   925 #SUP  4.29
 13 TYR  QD     19 LEU  HG      4.29            #peak   932 #SUP  4.21
 19 LEU  HA     19 LEU  HG      4.22            #peak   934 #SUP  5.80
 34 VAL  HA     34 VAL  QG2     3.13            #peak   941 #SUP  5.65
  7 THR  QG2    41 SER  HA      4.92            #peak   947 #SUP  2.43
  7 THR  QG2    40 PHE  HB3     4.67            #peak   951 #SUP  3.06
  7 THR  QG2    40 PHE  HA      4.24            #peak   957 #SUP  6.48
  6 TYR  HA      7 THR  QG2     4.94            #peak   959 #SUP  6.34
 23 THR  QG2    31 CYSS HA      4.74            #peak   961 #SUP  4.28
  7 THR  HA      7 THR  QG2     2.80            #peak   964 #SUP  4.50
 23 THR  HA     23 THR  QG2     3.05            #peak   970 #SUP  3.96
  7 THR  QG2    10 THR  QG2     3.41            #peak   978 #SUP  3.46
 34 VAL  QG1    35 CYSS HA      4.44            #peak   979 #SUP  4.73
 34 VAL  HA     34 VAL  QG1     3.22            #peak   982 #SUP  5.60
 40 PHE  QD     44 VAL  QG1     3.83            #peak   993 #SUP  4.00
 21 TRP  HH2    44 VAL  QG1     4.84            #peak   995 #SUP  1.50
 21 TRP  HE3    44 VAL  QG1     3.84            #peak   997 #SUP  1.50
  2 ILE  HA     44 VAL  QG1     3.92            #peak   998 #SUP  2.96
 44 VAL  HA     44 VAL  QG1     3.41            #peak  1000 #SUP  4.64
 40 PHE  HB2    44 VAL  QG1     3.89            #peak  1001 #SUP  5.90
 40 PHE  HB3    44 VAL  QG1     3.94            #peak  1006 #SUP  4.50
  2 ILE  QG2    44 VAL  QG1     4.18            #peak  1009 #SUP  2.96
  2 ILE  QG2    21 TRP  HB2     4.92            #peak  1020 #SUP  3.37
  2 ILE  QG2    40 PHE  QE      5.12            #peak  1021 #SUP  0.75
  2 ILE  QG2    21 TRP  HE3     4.34            #peak  1022 #SUP  4.70
  2 ILE  HA      2 ILE  QG2     3.28            #peak  1023 #SUP  6.05
  2 ILE  QG2     2 ILE  QD1     3.52            #peak  1025 #SUP  5.72
 44 VAL  HA     44 VAL  QG2     3.16            #peak  1032 #SUP  6.05
 43 PRO  HA     44 VAL  QG2     5.03            #peak  1033 #SUP  8.31
 43 PRO  HD3    44 VAL  QG2     4.87            #peak  1034 #SUP  7.04
  5 PHE  HB2    44 VAL  QG2     3.70            #peak  1036 #SUP  7.07
 43 PRO  HG3    44 VAL  QG2     4.94            #peak  1040 #SUP  7.29
  2 ILE  QD1    21 TRP  HD1     4.68            #peak  1043 #SUP  2.76
  2 ILE  QD1    21 TRP  HE3     4.36            #peak  1044 #SUP  6.07
  2 ILE  QD1    18 GLN  HA      4.31            #peak  1048 #SUP  1.22
  2 ILE  QD1    17 SER  HB3     4.67            #peak  1050 #SUP  5.54
 11 CYSS SG     39 CYSS SG      2.10 
 11 CYSS SG     39 CYSS CB      3.10 
 11 CYSS CB     39 CYSS SG      3.10 
 24 CYSS SG     35 CYSS SG      2.10 
 24 CYSS SG     35 CYSS CB      3.10 
 24 CYSS CB     35 CYSS SG      3.10 
 35 CYSS SG     48 CYSS SG      2.10 
 35 CYSS SG     48 CYSS CB      3.10 
 35 CYSS CB     48 CYSS SG      3.10 
 31 CYSS SG     57 CYSS SG      2.10 
 31 CYSS SG     57 CYSS CB      3.10 
 31 CYSS CB     57 CYSS SG      3.10 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ASP   1           H        ASP   1   9.859  -5.152  -7.188
    2    HA   ASP   1           HA       ASP   1   8.107  -6.445  -7.319
    3    HB2  ASP   1           1HB      ASP   1  10.000  -8.011  -5.548
    4    HB3  ASP   1           2HB      ASP   1   8.427  -8.688  -5.917
    5    H    ILE   2           H        ILE   2   6.094  -5.975  -6.424
    6    HA   ILE   2           HA       ILE   2   5.938  -5.844  -3.498
    7    HB   ILE   2           HB       ILE   2   4.402  -4.172  -3.673
    8   HG12  ILE   2          1HG1      ILE   2   3.743  -5.082  -6.490
    9   HG13  ILE   2          2HG1      ILE   2   2.789  -5.396  -5.054
   10   HG21  ILE   2          1HG2      ILE   2   5.403  -2.501  -4.874
   11   HG22  ILE   2          2HG2      ILE   2   6.705  -3.715  -4.874
   12   HG23  ILE   2          3HG2      ILE   2   5.664  -3.527  -6.306
   13   HD11  ILE   2          3HD1      ILE   2   3.467  -2.526  -5.483
   14   HD12  ILE   2          1HD1      ILE   2   2.399  -3.246  -6.712
   15   HD13  ILE   2          2HD1      ILE   2   1.925  -3.272  -4.997
   16    H    GLU   3           H        GLU   3   4.458  -7.163  -6.494
   17    HA   GLU   3           HA       GLU   3   2.263  -8.323  -5.361
   18    HB2  GLU   3           1HB      GLU   3   2.740  -8.166  -7.809
   19    HB3  GLU   3           2HB      GLU   3   3.972  -9.401  -7.647
   20    HG2  GLU   3           1HG      GLU   3   2.436 -11.111  -7.450
   21    HG3  GLU   3           2HG      GLU   3   1.319 -10.145  -6.508
   22    H    ASP   4           H        ASP   4   5.680  -9.303  -5.280
   23    HA   ASP   4           HA       ASP   4   5.157 -11.937  -4.445
   24    HB2  ASP   4           1HB      ASP   4   7.631 -10.170  -4.141
   25    HB3  ASP   4           2HB      ASP   4   7.606 -11.886  -3.789
   26    H    PHE   5           H        PHE   5   4.876  -8.848  -2.968
   27    HA   PHE   5           HA       PHE   5   5.105 -10.052  -0.299
   28    HB2  PHE   5           1HB      PHE   5   5.873  -7.382  -1.536
   29    HB3  PHE   5           2HB      PHE   5   5.359  -7.370   0.139
   30    HD1  PHE   5           1HD      PHE   5   6.679  -8.565   1.851
   31    HD2  PHE   5           2HD      PHE   5   8.001  -8.292  -2.172
   32    HE1  PHE   5           1HE      PHE   5   8.993  -9.221   2.567
   33    HE2  PHE   5           2HE      PHE   5  10.316  -8.948  -1.456
   34    HZ   PHE   5           HZ       PHE   5  10.784  -9.405   0.905
   35    H    TYR   6           H        TYR   6   2.828  -9.608  -2.437
   36    HA   TYR   6           HA       TYR   6   1.093  -7.737  -1.138
   37    HB2  TYR   6           1HB      TYR   6   1.248  -8.465  -3.639
   38    HB3  TYR   6           2HB      TYR   6   0.569 -10.006  -3.155
   39    HD1  TYR   6           2HD      TYR   6  -0.473  -6.717  -1.773
   40    HD2  TYR   6           1HD      TYR   6  -1.444  -9.924  -4.434
   41    HE1  TYR   6           2HE      TYR   6  -2.818  -5.778  -2.061
   42    HE2  TYR   6           1HE      TYR   6  -3.786  -8.974  -4.712
   43    HH   TYR   6           HH       TYR   6  -5.109  -7.306  -4.296
   44    H    THR   7           H        THR   7  -0.571  -8.118   0.301
   45    HA   THR   7           HA       THR   7  -0.906 -10.925   1.137
   46    HB   THR   7           HB       THR   7  -0.988 -10.158   3.404
   47    HG1  THR   7           1HG      THR   7  -1.062  -7.670   3.603
   48   HG21  THR   7          3HG2      THR   7   1.319  -9.702   2.125
   49   HG22  THR   7          1HG2      THR   7   0.856  -7.998   2.349
   50   HG23  THR   7          2HG2      THR   7   1.066  -9.056   3.764
   51    H    SER   8           H        SER   8  -2.615 -11.332  -0.313
   52    HA   SER   8           HA       SER   8  -4.809  -9.572  -0.418
   53    HB2  SER   8           1HB      SER   8  -4.365 -10.980  -2.324
   54    HB3  SER   8           2HB      SER   8  -4.364 -12.434  -1.346
   55    HG   SER   8           HG       SER   8  -6.679 -11.969  -0.889
   56    H    GLU   9           H        GLU   9  -3.698 -11.521   2.055
   57    HA   GLU   9           HA       GLU   9  -6.137 -12.724   2.828
   58    HB2  GLU   9           1HB      GLU   9  -3.440 -12.999   3.520
   59    HB3  GLU   9           2HB      GLU   9  -4.148 -12.311   4.968
   60    HG2  GLU   9           1HG      GLU   9  -6.050 -14.205   4.314
   61    HG3  GLU   9           2HG      GLU   9  -4.595 -14.985   3.726
   62    H    THR  10           H        THR  10  -4.283  -9.773   3.777
   63    HA   THR  10           HA       THR  10  -6.566  -8.971   5.445
   64    HB   THR  10           HB       THR  10  -4.549  -8.951   6.732
   65    HG1  THR  10           1HG      THR  10  -5.661  -6.894   6.810
   66   HG21  THR  10          3HG2      THR  10  -2.672  -9.155   5.337
   67   HG22  THR  10          1HG2      THR  10  -3.314  -8.002   4.142
   68   HG23  THR  10          2HG2      THR  10  -2.612  -7.406   5.665
   69    H    CYS  11           H        CYS  11  -4.809  -8.303   2.477
   70    HA   CYS  11           HA       CYS  11  -5.573  -5.634   2.190
   71    HB2  CYS  11           1HB      CYS  11  -3.797  -6.835   0.899
   72    HB3  CYS  11           2HB      CYS  11  -5.058  -7.649  -0.005
   73    HA   PRO  12           HA       PRO  12  -9.804  -6.263   1.292
   74    HB2  PRO  12           1HB      PRO  12 -10.455  -3.747   0.447
   75    HB3  PRO  12           2HB      PRO  12 -10.363  -4.196   2.139
   76    HG2  PRO  12           1HG      PRO  12  -8.455  -2.604   0.538
   77    HG3  PRO  12           2HG      PRO  12  -8.609  -2.706   2.281
   78    HD2  PRO  12           1HD      PRO  12  -6.614  -3.975   0.656
   79    HD3  PRO  12           2HD      PRO  12  -6.838  -4.170   2.383
   80    H    TYR  13           H        TYR  13  -7.426  -5.831  -0.949
   81    HA   TYR  13           HA       TYR  13  -9.375  -6.224  -3.119
   82    HB2  TYR  13           1HB      TYR  13  -6.471  -5.189  -3.080
   83    HB3  TYR  13           2HB      TYR  13  -7.486  -5.251  -4.507
   84    HD1  TYR  13           2HD      TYR  13  -9.559  -3.774  -4.605
   85    HD2  TYR  13           1HD      TYR  13  -6.544  -3.330  -1.602
   86    HE1  TYR  13           2HE      TYR  13 -10.389  -1.423  -4.108
   87    HE2  TYR  13           1HE      TYR  13  -7.384  -0.981  -1.115
   88    HH   TYR  13           HH       TYR  13  -9.979   0.126  -1.542
   89    H    LYS  14           H        LYS  14  -9.287  -8.109  -4.265
   90    HA   LYS  14           HA       LYS  14  -6.908  -9.777  -3.824
   91    HB2  LYS  14           1HB      LYS  14  -8.612 -11.705  -4.149
   92    HB3  LYS  14           2HB      LYS  14  -8.496 -10.914  -2.589
   93    HG2  LYS  14           1HG      LYS  14 -10.847 -11.074  -3.097
   94    HG3  LYS  14           2HG      LYS  14 -10.411  -9.388  -3.299
   95    HD2  LYS  14           1HD      LYS  14 -10.078 -11.023  -5.762
   96    HD3  LYS  14           2HD      LYS  14 -11.732 -10.928  -5.193
   97    HE2  LYS  14           1HE      LYS  14 -11.100  -8.310  -4.940
   98    HE3  LYS  14           2HE      LYS  14  -9.932  -8.723  -6.180
   99    HZ1  LYS  14           3HZ      LYS  14 -12.718  -9.545  -6.469
  100    HZ2  LYS  14           1HZ      LYS  14 -12.262  -8.029  -6.871
  101    HZ3  LYS  14           2HZ      LYS  14 -11.594  -9.311  -7.631
  102    H    ASN  15           H        ASN  15  -7.370  -7.748  -5.904
  103    HA   ASN  15           HA       ASN  15  -7.894  -9.434  -8.202
  104    HB2  ASN  15           1HB      ASN  15  -8.638  -6.814  -7.619
  105    HB3  ASN  15           2HB      ASN  15  -7.229  -6.554  -8.627
  106   HD21  ASN  15          1HD2      ASN  15  -8.578  -5.653 -10.210
  107   HD22  ASN  15          2HD2      ASN  15  -9.527  -6.628 -11.282
  108    H    ASP  16           H        ASP  16  -5.552  -6.915  -6.983
  109    HA   ASP  16           HA       ASP  16  -3.360  -8.478  -7.833
  110    HB2  ASP  16           1HB      ASP  16  -4.323  -7.104  -9.912
  111    HB3  ASP  16           2HB      ASP  16  -3.501  -5.756  -9.151
  112    H    SER  17           H        SER  17  -1.257  -7.327  -7.189
  113    HA   SER  17           HA       SER  17  -1.667  -5.943  -4.780
  114    HB2  SER  17           1HB      SER  17   0.851  -5.789  -4.772
  115    HB3  SER  17           2HB      SER  17   0.238  -7.416  -4.989
  116    HG   SER  17           HG       SER  17   1.574  -5.717  -6.842
  117    H    GLN  18           H        GLN  18  -1.011  -5.034  -8.151
  118    HA   GLN  18           HA       GLN  18  -0.063  -2.463  -7.610
  119    HB2  GLN  18           1HB      GLN  18  -1.378  -3.679 -10.074
  120    HB3  GLN  18           2HB      GLN  18  -0.709  -2.060 -10.052
  121    HG2  GLN  18           1HG      GLN  18   1.475  -3.213  -9.144
  122    HG3  GLN  18           2HG      GLN  18   0.754  -4.701  -9.722
  123   HE21  GLN  18          1HE2      GLN  18   2.483  -1.905 -10.506
  124   HE22  GLN  18          2HE2      GLN  18   2.525  -2.055 -12.231
  125    H    LEU  19           H        LEU  19  -3.275  -3.917  -7.691
  126    HA   LEU  19           HA       LEU  19  -4.723  -1.536  -8.138
  127    HB2  LEU  19           1HB      LEU  19  -5.627  -3.749  -8.563
  128    HB3  LEU  19           2HB      LEU  19  -5.503  -4.162  -6.865
  129    HG   LEU  19           HG       LEU  19  -7.132  -2.298  -6.372
  130   HD11  LEU  19          1HD1      LEU  19  -6.833  -0.963  -8.376
  131   HD12  LEU  19          2HD1      LEU  19  -7.447  -2.294  -9.386
  132   HD13  LEU  19          3HD1      LEU  19  -8.530  -1.482  -8.230
  133   HD21  LEU  19          3HD2      LEU  19  -8.385  -4.131  -6.184
  134   HD22  LEU  19          1HD2      LEU  19  -8.989  -3.754  -7.815
  135   HD23  LEU  19          2HD2      LEU  19  -7.637  -4.893  -7.609
  136    H    ALA  20           H        ALA  20  -4.310  -3.476  -5.087
  137    HA   ALA  20           HA       ALA  20  -5.313  -1.523  -3.408
  138    HB1  ALA  20           3HB      ALA  20  -4.675  -4.053  -3.062
  139    HB2  ALA  20           1HB      ALA  20  -3.102  -3.390  -2.559
  140    HB3  ALA  20           2HB      ALA  20  -4.583  -2.923  -1.690
  141    H    TRP  21           H        TRP  21  -2.077  -1.959  -4.856
  142    HA   TRP  21           HA       TRP  21  -0.808  -0.053  -3.175
  143    HB2  TRP  21           1HB      TRP  21   0.628  -1.613  -4.096
  144    HB3  TRP  21           2HB      TRP  21  -0.101  -1.521  -5.687
  145    HD1  TRP  21           HD       TRP  21   0.574   0.750  -7.177
  146    HE1  TRP  21           1HE      TRP  21   2.741   2.255  -7.245
  147    HE3  TRP  21           3HE      TRP  21   2.392  -0.748  -2.670
  148    HZ2  TRP  21           2HZ      TRP  21   4.923   2.641  -5.446
  149    HZ3  TRP  21           3HZ      TRP  21   4.546   0.242  -1.900
  150    HH2  TRP  21           HH       TRP  21   5.802   1.882  -3.208
  151    H    ASP  22           H        ASP  22  -2.464  -0.057  -6.374
  152    HA   ASP  22           HA       ASP  22  -1.743   2.521  -7.080
  153    HB2  ASP  22           1HB      ASP  22  -3.805   0.517  -7.880
  154    HB3  ASP  22           2HB      ASP  22  -4.223   2.179  -8.250
  155    H    THR  23           H        THR  23  -3.806   1.288  -4.600
  156    HA   THR  23           HA       THR  23  -5.573   3.601  -4.575
  157    HB   THR  23           HB       THR  23  -5.485   0.840  -3.457
  158    HG1  THR  23           1HG      THR  23  -7.537   2.877  -3.966
  159   HG21  THR  23          3HG2      THR  23  -7.353   1.808  -1.778
  160   HG22  THR  23          1HG2      THR  23  -5.655   1.667  -1.263
  161   HG23  THR  23          2HG2      THR  23  -6.294   3.238  -1.802
  162    H    CYS  24           H        CYS  24  -3.471   1.965  -2.106
  163    HA   CYS  24           HA       CYS  24  -3.433   4.231  -0.472
  164    HB2  CYS  24           1HB      CYS  24  -2.865   2.488   0.808
  165    HB3  CYS  24           2HB      CYS  24  -2.180   1.584  -0.528
  166    H    SER  25           H        SER  25  -0.683   2.718  -2.330
  167    HA   SER  25           HA       SER  25   0.687   5.212  -2.297
  168    HB2  SER  25           1HB      SER  25   2.039   3.501  -4.068
  169    HB3  SER  25           2HB      SER  25   2.404   3.746  -2.371
  170    HG   SER  25           HG       SER  25   0.690   1.721  -3.525
  171    H    GLY  26           H        GLY  26  -1.621   5.855  -3.520
  172    HA2  GLY  26           1HA      GLY  26  -0.958   5.888  -6.404
  173    HA3  GLY  26           2HA      GLY  26  -2.591   5.718  -5.793
  174    H    GLY  27           H        GLY  27  -1.122   7.682  -3.543
  175    HA2  GLY  27           1HA      GLY  27  -0.672   9.969  -3.488
  176    HA3  GLY  27           2HA      GLY  27  -1.403  10.169  -5.068
  177    H    THR  28           H        THR  28  -3.787   8.444  -4.345
  178    HA   THR  28           HA       THR  28  -5.064  10.172  -2.345
  179    HB   THR  28           HB       THR  28  -7.036  10.331  -3.907
  180    HG1  THR  28           1HG      THR  28  -6.356   8.335  -5.078
  181   HG21  THR  28          3HG2      THR  28  -5.666  12.260  -4.205
  182   HG22  THR  28          1HG2      THR  28  -4.310  11.303  -4.849
  183   HG23  THR  28          2HG2      THR  28  -5.757  11.581  -5.848
  184    H    GLY  29           H        GLY  29  -7.560   9.123  -2.257
  185    HA2  GLY  29           1HA      GLY  29  -8.783   7.212  -1.880
  186    HA3  GLY  29           2HA      GLY  29  -7.366   6.222  -2.169
  187    H    ASN  30           H        ASN  30  -6.377   5.300  -0.418
  188    HA   ASN  30           HA       ASN  30  -6.793   6.643   2.132
  189    HB2  ASN  30           1HB      ASN  30  -6.672   4.094   2.991
  190    HB3  ASN  30           2HB      ASN  30  -8.195   4.808   2.498
  191   HD21  ASN  30          1HD2      ASN  30  -6.014   2.309   2.047
  192   HD22  ASN  30          2HD2      ASN  30  -6.628   1.620   0.581
  193    H    CYS  31           H        CYS  31  -4.516   7.290   0.887
  194    HA   CYS  31           HA       CYS  31  -2.471   5.339   1.084
  195    HB2  CYS  31           1HB      CYS  31  -1.096   6.879   0.124
  196    HB3  CYS  31           2HB      CYS  31  -2.656   7.453  -0.431
  197    H    GLY  32           H        GLY  32  -0.608   5.468   2.600
  198    HA2  GLY  32           1HA      GLY  32  -0.181   7.114   4.684
  199    HA3  GLY  32           2HA      GLY  32  -1.492   6.116   5.280
  200    H    THR  33           H        THR  33   0.517   5.694   6.831
  201    HA   THR  33           HA       THR  33   2.376   3.757   5.740
  202    HB   THR  33           HB       THR  33   1.985   4.872   8.568
  203    HG1  THR  33           1HG      THR  33   2.461   6.402   6.742
  204   HG21  THR  33          3HG2      THR  33   4.336   3.495   7.165
  205   HG22  THR  33          1HG2      THR  33   4.448   4.323   8.737
  206   HG23  THR  33          2HG2      THR  33   3.437   2.868   8.568
  207    H    VAL  34           H        VAL  34  -0.821   3.649   6.725
  208    HA   VAL  34           HA       VAL  34  -0.704   1.272   8.291
  209    HB   VAL  34           HB       VAL  34  -2.920   2.750   6.868
  210   HG11  VAL  34          1HG1      VAL  34  -3.659   0.484   6.953
  211   HG12  VAL  34          2HG1      VAL  34  -3.050   0.275   8.612
  212   HG13  VAL  34          3HG1      VAL  34  -4.449   1.331   8.304
  213   HG21  VAL  34          3HG2      VAL  34  -2.335   4.102   8.641
  214   HG22  VAL  34          1HG2      VAL  34  -3.540   3.047   9.417
  215   HG23  VAL  34          2HG2      VAL  34  -1.803   2.737   9.652
  216    H    CYS  35           H        CYS  35  -1.335   2.089   4.832
  217    HA   CYS  35           HA       CYS  35  -1.996  -0.501   4.054
  218    HB2  CYS  35           1HB      CYS  35  -2.440   0.563   2.175
  219    HB3  CYS  35           2HB      CYS  35  -1.735   2.022   2.842
  220    H    CYS  36           H        CYS  36   0.948   0.908   5.171
  221    HA   CYS  36           HA       CYS  36   2.857  -0.334   3.633
  222    HB2  CYS  36           1HB      CYS  36   4.343   0.422   5.145
  223    HB3  CYS  36           2HB      CYS  36   2.965   1.378   5.653
  224    H    GLY  37           H        GLY  37   1.230  -1.439   6.695
  225    HA2  GLY  37           1HA      GLY  37   2.124  -4.188   6.068
  226    HA3  GLY  37           2HA      GLY  37   1.848  -3.558   7.679
  227    H    GLN  38           H        GLN  38  -0.170  -3.063   4.718
  228    HA   GLN  38           HA       GLN  38  -2.287  -4.484   6.140
  229    HB2  GLN  38           1HB      GLN  38  -2.319  -1.818   5.534
  230    HB3  GLN  38           2HB      GLN  38  -3.042  -2.461   4.073
  231    HG2  GLN  38           1HG      GLN  38  -4.578  -3.850   5.672
  232    HG3  GLN  38           2HG      GLN  38  -4.023  -2.770   6.935
  233   HE21  GLN  38          1HE2      GLN  38  -5.451  -2.847   3.694
  234   HE22  GLN  38          2HE2      GLN  38  -6.407  -1.409   3.832
  235    H    CYS  39           H        CYS  39  -1.110  -3.457   2.858
  236    HA   CYS  39           HA       CYS  39  -2.328  -5.907   1.818
  237    HB2  CYS  39           1HB      CYS  39  -1.691  -3.272   0.494
  238    HB3  CYS  39           2HB      CYS  39  -2.035  -4.725  -0.423
  239    H    PHE  40           H        PHE  40   0.607  -4.131   2.524
  240    HA   PHE  40           HA       PHE  40   2.138  -6.280   1.262
  241    HB2  PHE  40           1HB      PHE  40   3.145  -3.413   1.367
  242    HB3  PHE  40           2HB      PHE  40   3.567  -4.665   0.216
  243    HD1  PHE  40           2HD      PHE  40   2.094  -5.153  -1.686
  244    HD2  PHE  40           1HD      PHE  40   1.208  -2.014   1.029
  245    HE1  PHE  40           2HE      PHE  40   0.461  -4.192  -3.331
  246    HE2  PHE  40           1HE      PHE  40  -0.425  -1.052  -0.617
  247    HZ   PHE  40           HZ       PHE  40  -0.779  -2.153  -2.777
  248    H    SER  41           H        SER  41   4.672  -5.687   2.013
  249    HA   SER  41           HA       SER  41   4.660  -4.833   4.747
  250    HB2  SER  41           1HB      SER  41   4.932  -7.708   3.933
  251    HB3  SER  41           2HB      SER  41   6.031  -7.136   5.172
  252    HG   SER  41           HG       SER  41   3.139  -7.082   5.227
  253    H    PHE  42           H        PHE  42   6.931  -4.607   5.592
  254    HA   PHE  42           HA       PHE  42   8.601  -3.428   3.766
  255    HB2  PHE  42           1HB      PHE  42   8.462  -4.089   6.552
  256    HB3  PHE  42           2HB      PHE  42   9.987  -4.764   6.015
  257    HD1  PHE  42           2HD      PHE  42   8.025  -1.609   6.044
  258    HD2  PHE  42           1HD      PHE  42  11.866  -3.393   5.773
  259    HE1  PHE  42           2HE      PHE  42   9.090   0.657   6.220
  260    HE2  PHE  42           1HE      PHE  42  12.931  -1.127   5.948
  261    HZ   PHE  42           HZ       PHE  42  11.530   0.871   6.170
  262    HA   PRO  43           HA       PRO  43  10.715  -3.136   3.785
  263    HB2  PRO  43           1HB      PRO  43  12.388  -2.773   1.655
  264    HB3  PRO  43           2HB      PRO  43  12.939  -3.330   3.223
  265    HG2  PRO  43           1HG      PRO  43  12.564  -4.879   0.733
  266    HG3  PRO  43           2HG      PRO  43  13.495  -5.299   2.157
  267    HD2  PRO  43           1HD      PRO  43  10.920  -6.328   1.424
  268    HD3  PRO  43           2HD      PRO  43  11.798  -6.659   2.904
  269    H    VAL  44           H        VAL  44   8.657  -4.557   1.840
  270    HA   VAL  44           HA       VAL  44   8.330  -2.572  -0.158
  271    HB   VAL  44           HB       VAL  44   6.170  -4.428   0.786
  272   HG11  VAL  44          1HG1      VAL  44   7.049  -3.315  -1.891
  273   HG12  VAL  44          2HG1      VAL  44   5.860  -4.630  -1.727
  274   HG13  VAL  44          3HG1      VAL  44   5.520  -3.029  -1.025
  275   HG21  VAL  44          3HG2      VAL  44   7.560  -6.182   0.651
  276   HG22  VAL  44          1HG2      VAL  44   7.579  -5.890  -1.104
  277   HG23  VAL  44          2HG2      VAL  44   8.858  -5.204  -0.074
  278    H    SER  45           H        SER  45   6.981  -3.174   3.116
  279    HA   SER  45           HA       SER  45   4.901  -1.442   3.066
  280    HB2  SER  45           1HB      SER  45   4.928  -2.520   5.082
  281    HB3  SER  45           2HB      SER  45   6.678  -2.602   5.131
  282    HG   SER  45           HG       SER  45   6.669  -0.294   5.730
  283    H    GLN  46           H        GLN  46   8.322  -0.763   2.860
  284    HA   GLN  46           HA       GLN  46   8.121   1.885   3.864
  285    HB2  GLN  46           1HB      GLN  46  10.248   0.830   4.112
  286    HB3  GLN  46           2HB      GLN  46  10.284   0.301   2.442
  287    HG2  GLN  46           1HG      GLN  46  11.782   2.188   2.602
  288    HG3  GLN  46           2HG      GLN  46  10.365   2.745   1.735
  289   HE21  GLN  46          1HE2      GLN  46  12.045   2.711   4.813
  290   HE22  GLN  46          2HE2      GLN  46  11.294   4.104   5.516
  291    H    SER  47           H        SER  47   7.829   0.244   0.727
  292    HA   SER  47           HA       SER  47   8.109   2.623  -0.777
  293    HB2  SER  47           1HB      SER  47   6.706   0.117  -1.752
  294    HB3  SER  47           2HB      SER  47   7.653   1.263  -2.679
  295    HG   SER  47           HG       SER  47   8.806  -0.743  -2.245
  296    H    CYS  48           H        CYS  48   5.417   0.699   0.618
  297    HA   CYS  48           HA       CYS  48   3.328   1.907  -0.732
  298    HB2  CYS  48           1HB      CYS  48   2.618   0.069   0.385
  299    HB3  CYS  48           2HB      CYS  48   3.649   0.358   1.772
  300    H    ALA  49           H        ALA  49   4.789   2.650   2.522
  301    HA   ALA  49           HA       ALA  49   3.270   5.045   2.792
  302    HB1  ALA  49           3HB      ALA  49   4.859   3.335   4.414
  303    HB2  ALA  49           1HB      ALA  49   5.614   4.946   4.479
  304    HB3  ALA  49           2HB      ALA  49   3.903   4.747   4.926
  305    H    GLY  50           H        GLY  50   5.808   4.200   0.759
  306    HA2  GLY  50           1HA      GLY  50   7.200   6.765   0.946
  307    HA3  GLY  50           2HA      GLY  50   7.652   5.373  -0.018
  308    H    MET  51           H        MET  51   5.394   4.748  -1.486
  309    HA   MET  51           HA       MET  51   5.323   7.004  -3.252
  310    HB2  MET  51           1HB      MET  51   5.575   4.439  -3.828
  311    HB3  MET  51           2HB      MET  51   3.842   4.352  -3.583
  312    HG2  MET  51           1HG      MET  51   4.032   6.564  -5.240
  313    HG3  MET  51           2HG      MET  51   5.375   5.596  -5.815
  314    HE1  MET  51           3HE      MET  51   4.603   5.523  -7.842
  315    HE2  MET  51           1HE      MET  51   4.283   3.810  -8.205
  316    HE3  MET  51           2HE      MET  51   3.007   5.026  -8.452
  317    H    ALA  52           H        ALA  52   3.802   6.730  -0.504
  318    HA   ALA  52           HA       ALA  52   1.060   6.944  -1.427
  319    HB1  ALA  52           3HB      ALA  52   2.445   6.221   1.006
  320    HB2  ALA  52           1HB      ALA  52   1.300   7.541   1.341
  321    HB3  ALA  52           2HB      ALA  52   0.723   6.030   0.597
  322    H    ASP  53           H        ASP  53   3.034   8.912  -2.381
  323    HA   ASP  53           HA       ASP  53   3.236  11.050  -2.667
  324    HB2  ASP  53           1HB      ASP  53   0.424  10.739  -1.775
  325    HB3  ASP  53           2HB      ASP  53   1.055  12.352  -1.504
  326    H    SER  54           H        SER  54   3.543  13.236  -1.464
  327    HA   SER  54           HA       SER  54   4.275  12.626   1.276
  328    HB2  SER  54           1HB      SER  54   5.438  14.230  -0.876
  329    HB3  SER  54           2HB      SER  54   5.253  15.192   0.577
  330    HG   SER  54           HG       SER  54   7.312  14.015   0.444
  331    H    ASN  55           H        ASN  55   3.322  15.688  -0.441
  332    HA   ASN  55           HA       ASN  55   1.507  16.159   1.788
  333    HB2  ASN  55           1HB      ASN  55   3.562  17.772   0.880
  334    HB3  ASN  55           2HB      ASN  55   2.222  18.420  -0.044
  335   HD21  ASN  55          1HD2      ASN  55   3.625  17.955   3.087
  336   HD22  ASN  55          2HD2      ASN  55   2.568  18.978   4.002
  337    H    ASP  56           H        ASP  56   1.734  15.261  -1.489
  338    HA   ASP  56           HA       ASP  56  -0.399  16.777  -2.527
  339    HB2  ASP  56           1HB      ASP  56   1.009  14.224  -3.411
  340    HB3  ASP  56           2HB      ASP  56  -0.321  14.900  -4.329
  341    H    CYS  57           H        CYS  57  -0.066  13.951  -0.500
  342    HA   CYS  57           HA       CYS  57  -2.476  12.668  -1.277
  343    HB2  CYS  57           1HB      CYS  57  -0.253  12.100   0.397
  344    HB3  CYS  57           2HB      CYS  57  -1.690  11.986   1.394
  345    HA   PRO  58           HA       PRO  58  -5.227  14.889   1.268
  346    HB2  PRO  58           1HB      PRO  58  -6.994  12.999   2.149
  347    HB3  PRO  58           2HB      PRO  58  -7.056  13.693   0.541
  348    HG2  PRO  58           1HG      PRO  58  -6.110  11.018   1.371
  349    HG3  PRO  58           2HG      PRO  58  -6.576  11.571  -0.226
  350    HD2  PRO  58           1HD      PRO  58  -3.905  11.176   0.742
  351    HD3  PRO  58           2HD      PRO  58  -4.369  11.839  -0.812
  352    H    ASN  59           H        ASN  59  -2.984  14.884   2.594
  353    HA   ASN  59           HA       ASN  59  -3.535  13.684   5.151
  354    HB2  ASN  59           1HB      ASN  59  -1.143  15.359   4.220
  355    HB3  ASN  59           2HB      ASN  59  -1.225  14.454   5.719
  356   HD21  ASN  59          1HD2      ASN  59   0.636  14.227   3.507
  357   HD22  ASN  59          2HD2      ASN  59   0.563  12.599   2.920
  358    H    ALA  60           H        ALA  60  -3.039  15.187   7.156
  359    HA   ALA  60           HA       ALA  60  -4.787  17.371   7.085
  360    HB1  ALA  60           3HB      ALA  60  -3.322  17.789   9.332
  361    HB2  ALA  60           1HB      ALA  60  -4.604  16.560   9.214
  362    HB3  ALA  60           2HB      ALA  60  -2.899  16.092   9.003
  Start of MODEL    2
    1    H1   ASP   1           H        ASP   1  10.564  -6.429  -5.970
    2    HA   ASP   1           HA       ASP   1   8.656  -6.412  -7.029
    3    HB2  ASP   1           1HB      ASP   1   9.070  -9.318  -6.728
    4    HB3  ASP   1           2HB      ASP   1   7.369  -8.897  -6.717
    5    H    ILE   2           H        ILE   2   6.491  -5.866  -6.324
    6    HA   ILE   2           HA       ILE   2   6.127  -6.016  -3.469
    7    HB   ILE   2           HB       ILE   2   4.708  -4.276  -3.700
    8   HG12  ILE   2          1HG1      ILE   2   3.883  -5.304  -6.431
    9   HG13  ILE   2          2HG1      ILE   2   2.991  -5.511  -4.937
   10   HG21  ILE   2          1HG2      ILE   2   6.005  -3.945  -6.403
   11   HG22  ILE   2          2HG2      ILE   2   5.592  -2.703  -5.196
   12   HG23  ILE   2          3HG2      ILE   2   6.932  -3.834  -4.887
   13   HD11  ILE   2          3HD1      ILE   2   3.566  -2.716  -5.149
   14   HD12  ILE   2          1HD1      ILE   2   2.980  -3.253  -6.742
   15   HD13  ILE   2          2HD1      ILE   2   1.983  -3.518  -5.291
   16    H    GLU   3           H        GLU   3   4.725  -7.389  -6.470
   17    HA   GLU   3           HA       GLU   3   2.454  -8.457  -5.404
   18    HB2  GLU   3           1HB      GLU   3   2.642 -10.146  -7.276
   19    HB3  GLU   3           2HB      GLU   3   2.822  -8.480  -7.788
   20    HG2  GLU   3           1HG      GLU   3   4.785  -9.091  -8.753
   21    HG3  GLU   3           2HG      GLU   3   5.447  -9.239  -7.137
   22    H    ASP   4           H        ASP   4   5.832  -9.463  -5.046
   23    HA   ASP   4           HA       ASP   4   5.231 -12.070  -4.178
   24    HB2  ASP   4           1HB      ASP   4   7.567 -10.423  -4.647
   25    HB3  ASP   4           2HB      ASP   4   7.716 -11.140  -3.054
   26    H    PHE   5           H        PHE   5   4.659  -9.015  -2.843
   27    HA   PHE   5           HA       PHE   5   4.753 -10.110  -0.122
   28    HB2  PHE   5           1HB      PHE   5   5.608  -7.472  -1.369
   29    HB3  PHE   5           2HB      PHE   5   4.949  -7.411   0.254
   30    HD1  PHE   5           2HD      PHE   5   7.725  -8.645  -1.806
   31    HD2  PHE   5           1HD      PHE   5   6.184  -8.280   2.131
   32    HE1  PHE   5           2HE      PHE   5   9.971  -9.259  -0.871
   33    HE2  PHE   5           1HE      PHE   5   8.431  -8.895   3.066
   34    HZ   PHE   5           HZ       PHE   5  10.297  -9.377   1.555
   35    H    TYR   6           H        TYR   6   2.659  -9.744  -2.454
   36    HA   TYR   6           HA       TYR   6   0.810  -7.853  -1.358
   37    HB2  TYR   6           1HB      TYR   6   1.068  -8.504  -3.803
   38    HB3  TYR   6           2HB      TYR   6   0.640 -10.155  -3.403
   39    HD1  TYR   6           1HD      TYR   6  -1.263  -7.819  -1.481
   40    HD2  TYR   6           2HD      TYR   6  -1.050  -9.700  -5.318
   41    HE1  TYR   6           1HE      TYR   6  -3.715  -7.284  -1.888
   42    HE2  TYR   6           2HE      TYR   6  -3.503  -9.158  -5.712
   43    HH   TYR   6           HH       TYR   6  -5.173  -6.938  -3.884
   44    H    THR   7           H        THR   7  -0.123  -8.280   0.599
   45    HA   THR   7           HA       THR   7  -0.832 -11.044   1.214
   46    HB   THR   7           HB       THR   7  -0.890 -10.270   3.479
   47    HG1  THR   7           1HG      THR   7  -1.015  -7.622   2.214
   48   HG21  THR   7          3HG2      THR   7   1.156  -9.106   3.836
   49   HG22  THR   7          1HG2      THR   7   1.427  -9.895   2.264
   50   HG23  THR   7          2HG2      THR   7   0.988  -8.171   2.330
   51    H    SER   8           H        SER   8  -2.546 -11.407  -0.252
   52    HA   SER   8           HA       SER   8  -4.705  -9.618  -0.369
   53    HB2  SER   8           1HB      SER   8  -4.268 -11.094  -2.239
   54    HB3  SER   8           2HB      SER   8  -4.356 -12.519  -1.223
   55    HG   SER   8           HG       SER   8  -6.561 -10.716  -1.766
   56    H    GLU   9           H        GLU   9  -3.634 -11.608   2.116
   57    HA   GLU   9           HA       GLU   9  -6.089 -12.725   2.925
   58    HB2  GLU   9           1HB      GLU   9  -3.405 -13.031   3.625
   59    HB3  GLU   9           2HB      GLU   9  -4.088 -12.276   5.052
   60    HG2  GLU   9           1HG      GLU   9  -5.806 -14.420   3.941
   61    HG3  GLU   9           2HG      GLU   9  -4.224 -14.994   4.428
   62    H    THR  10           H        THR  10  -4.145  -9.846   3.967
   63    HA   THR  10           HA       THR  10  -6.428  -8.964   5.577
   64    HB   THR  10           HB       THR  10  -4.372  -8.924   6.810
   65    HG1  THR  10           1HG      THR  10  -3.975  -6.493   6.755
   66   HG21  THR  10          3HG2      THR  10  -3.218  -8.023   4.173
   67   HG22  THR  10          1HG2      THR  10  -2.494  -7.350   5.653
   68   HG23  THR  10          2HG2      THR  10  -2.518  -9.111   5.395
   69    H    CYS  11           H        CYS  11  -4.711  -8.344   2.568
   70    HA   CYS  11           HA       CYS  11  -5.513  -5.691   2.240
   71    HB2  CYS  11           1HB      CYS  11  -3.737  -6.960   0.959
   72    HB3  CYS  11           2HB      CYS  11  -5.030  -7.700   0.037
   73    HA   PRO  12           HA       PRO  12  -9.739  -6.394   1.381
   74    HB2  PRO  12           1HB      PRO  12 -10.430  -3.905   0.487
   75    HB3  PRO  12           2HB      PRO  12 -10.321  -4.317   2.187
   76    HG2  PRO  12           1HG      PRO  12  -8.445  -2.734   0.540
   77    HG3  PRO  12           2HG      PRO  12  -8.586  -2.801   2.285
   78    HD2  PRO  12           1HD      PRO  12  -6.585  -4.078   0.674
   79    HD3  PRO  12           2HD      PRO  12  -6.795  -4.238   2.407
   80    H    TYR  13           H        TYR  13  -7.390  -5.871  -0.907
   81    HA   TYR  13           HA       TYR  13  -9.344  -6.338  -3.054
   82    HB2  TYR  13           1HB      TYR  13  -6.464  -5.248  -2.913
   83    HB3  TYR  13           2HB      TYR  13  -7.300  -5.514  -4.430
   84    HD1  TYR  13           2HD      TYR  13  -9.355  -4.148  -4.970
   85    HD2  TYR  13           1HD      TYR  13  -6.848  -3.281  -1.614
   86    HE1  TYR  13           2HE      TYR  13 -10.343  -1.810  -4.828
   87    HE2  TYR  13           1HE      TYR  13  -7.845  -0.945  -1.483
   88    HH   TYR  13           HH       TYR  13 -10.627  -0.096  -2.829
   89    H    LYS  14           H        LYS  14  -9.059  -8.073  -4.488
   90    HA   LYS  14           HA       LYS  14  -6.780  -9.820  -3.936
   91    HB2  LYS  14           1HB      LYS  14  -8.110 -11.753  -3.706
   92    HB3  LYS  14           2HB      LYS  14  -8.830 -10.556  -2.648
   93    HG2  LYS  14           1HG      LYS  14  -9.797 -11.144  -5.487
   94    HG3  LYS  14           2HG      LYS  14 -10.516 -11.823  -4.040
   95    HD2  LYS  14           1HD      LYS  14 -11.839  -9.983  -3.928
   96    HD3  LYS  14           2HD      LYS  14 -10.413  -9.058  -3.501
   97    HE2  LYS  14           1HE      LYS  14 -11.318  -7.929  -5.402
   98    HE3  LYS  14           2HE      LYS  14  -9.955  -8.833  -6.033
   99    HZ1  LYS  14           3HZ      LYS  14 -11.795 -10.625  -6.364
  100    HZ2  LYS  14           1HZ      LYS  14 -12.785  -9.326  -6.386
  101    HZ3  LYS  14           2HZ      LYS  14 -11.568  -9.443  -7.468
  102    H    ASN  15           H        ASN  15  -7.391  -7.787  -6.024
  103    HA   ASN  15           HA       ASN  15  -7.895  -9.516  -8.292
  104    HB2  ASN  15           1HB      ASN  15  -8.885  -7.045  -7.792
  105    HB3  ASN  15           2HB      ASN  15  -7.394  -6.545  -8.566
  106   HD21  ASN  15          1HD2      ASN  15  -8.918  -5.647 -10.126
  107   HD22  ASN  15          2HD2      ASN  15  -9.483  -6.628 -11.437
  108    H    ASP  16           H        ASP  16  -5.629  -6.897  -7.144
  109    HA   ASP  16           HA       ASP  16  -3.405  -8.373  -8.088
  110    HB2  ASP  16           1HB      ASP  16  -4.463  -6.986 -10.097
  111    HB3  ASP  16           2HB      ASP  16  -3.706  -5.615  -9.309
  112    H    SER  17           H        SER  17  -1.364  -7.350  -7.294
  113    HA   SER  17           HA       SER  17  -1.758  -5.982  -4.898
  114    HB2  SER  17           1HB      SER  17   0.735  -5.850  -4.848
  115    HB3  SER  17           2HB      SER  17   0.156  -7.462  -5.220
  116    HG   SER  17           HG       SER  17   0.706  -5.679  -7.390
  117    H    GLN  18           H        GLN  18  -0.988  -4.980  -8.240
  118    HA   GLN  18           HA       GLN  18  -0.128  -2.408  -7.601
  119    HB2  GLN  18           1HB      GLN  18   0.186  -3.676  -9.799
  120    HB3  GLN  18           2HB      GLN  18  -1.479  -3.291 -10.185
  121    HG2  GLN  18           1HG      GLN  18  -0.946  -0.840  -9.915
  122    HG3  GLN  18           2HG      GLN  18   0.729  -1.258  -9.612
  123   HE21  GLN  18          1HE2      GLN  18   1.855  -0.673 -11.306
  124   HE22  GLN  18          2HE2      GLN  18   1.512  -1.034 -12.965
  125    H    LEU  19           H        LEU  19  -3.277  -3.917  -7.653
  126    HA   LEU  19           HA       LEU  19  -4.775  -1.558  -8.162
  127    HB2  LEU  19           1HB      LEU  19  -5.655  -3.748  -8.651
  128    HB3  LEU  19           2HB      LEU  19  -5.501  -4.237  -6.975
  129    HG   LEU  19           HG       LEU  19  -7.172  -2.448  -6.374
  130   HD11  LEU  19          1HD1      LEU  19  -6.745  -1.198  -8.585
  131   HD12  LEU  19          2HD1      LEU  19  -7.887  -2.362  -9.300
  132   HD13  LEU  19          3HD1      LEU  19  -8.415  -1.295  -7.976
  133   HD21  LEU  19          3HD2      LEU  19  -9.112  -3.754  -7.075
  134   HD22  LEU  19          1HD2      LEU  19  -8.119  -4.605  -8.282
  135   HD23  LEU  19          2HD2      LEU  19  -7.782  -4.813  -6.546
  136    H    ALA  20           H        ALA  20  -4.274  -3.516  -5.136
  137    HA   ALA  20           HA       ALA  20  -5.392  -1.626  -3.440
  138    HB1  ALA  20           3HB      ALA  20  -3.152  -3.273  -2.392
  139    HB2  ALA  20           1HB      ALA  20  -4.836  -3.140  -1.831
  140    HB3  ALA  20           2HB      ALA  20  -4.441  -4.176  -3.223
  141    H    TRP  21           H        TRP  21  -2.143  -1.916  -4.884
  142    HA   TRP  21           HA       TRP  21  -0.937  -0.011  -3.159
  143    HB2  TRP  21           1HB      TRP  21   0.539  -1.507  -4.135
  144    HB3  TRP  21           2HB      TRP  21  -0.188  -1.367  -5.723
  145    HD1  TRP  21           HD       TRP  21   0.369   1.065  -7.054
  146    HE1  TRP  21           1HE      TRP  21   2.514   2.601  -7.070
  147    HE3  TRP  21           3HE      TRP  21   2.355  -0.767  -2.747
  148    HZ2  TRP  21           2HZ      TRP  21   4.751   2.872  -5.318
  149    HZ3  TRP  21           3HZ      TRP  21   4.523   0.188  -1.969
  150    HH2  TRP  21           HH       TRP  21   5.714   1.945  -3.180
  151    H    ASP  22           H        ASP  22  -2.654   0.016  -6.317
  152    HA   ASP  22           HA       ASP  22  -2.010   2.622  -6.991
  153    HB2  ASP  22           1HB      ASP  22  -3.918   0.538  -7.835
  154    HB3  ASP  22           2HB      ASP  22  -4.594   2.145  -8.011
  155    H    THR  23           H        THR  23  -3.912   1.327  -4.440
  156    HA   THR  23           HA       THR  23  -5.771   3.567  -4.335
  157    HB   THR  23           HB       THR  23  -5.529   0.811  -3.233
  158    HG1  THR  23           1HG      THR  23  -7.617   2.818  -3.725
  159   HG21  THR  23          3HG2      THR  23  -7.341   1.702  -1.455
  160   HG22  THR  23          1HG2      THR  23  -5.614   1.624  -1.029
  161   HG23  THR  23          2HG2      THR  23  -6.340   3.172  -1.525
  162    H    CYS  24           H        CYS  24  -3.423   2.024  -2.032
  163    HA   CYS  24           HA       CYS  24  -3.400   4.365  -0.438
  164    HB2  CYS  24           1HB      CYS  24  -2.879   2.678   0.932
  165    HB3  CYS  24           2HB      CYS  24  -2.235   1.680  -0.357
  166    H    SER  25           H        SER  25  -0.655   2.667  -2.127
  167    HA   SER  25           HA       SER  25   0.737   5.143  -2.301
  168    HB2  SER  25           1HB      SER  25   2.162   3.323  -3.846
  169    HB3  SER  25           2HB      SER  25   2.407   3.620  -2.136
  170    HG   SER  25           HG       SER  25   1.683   1.657  -1.715
  171    H    GLY  26           H        GLY  26  -1.532   5.691  -3.631
  172    HA2  GLY  26           1HA      GLY  26  -0.820   5.419  -6.492
  173    HA3  GLY  26           2HA      GLY  26  -2.466   5.364  -5.892
  174    H    GLY  27           H        GLY  27  -0.988   7.504  -3.828
  175    HA2  GLY  27           1HA      GLY  27  -0.387   9.778  -4.123
  176    HA3  GLY  27           2HA      GLY  27  -1.299   9.824  -5.619
  177    H    THR  28           H        THR  28  -3.702   8.473  -4.751
  178    HA   THR  28           HA       THR  28  -4.665  10.254  -2.620
  179    HB   THR  28           HB       THR  28  -6.713  10.622  -4.020
  180    HG1  THR  28           1HG      THR  28  -6.219   8.501  -5.182
  181   HG21  THR  28          3HG2      THR  28  -5.259  12.408  -4.528
  182   HG22  THR  28          1HG2      THR  28  -3.982  11.324  -5.128
  183   HG23  THR  28          2HG2      THR  28  -5.418  11.645  -6.128
  184    H    GLY  29           H        GLY  29  -7.171   9.443  -2.231
  185    HA2  GLY  29           1HA      GLY  29  -8.537   7.600  -1.853
  186    HA3  GLY  29           2HA      GLY  29  -7.195   6.516  -2.163
  187    H    ASN  30           H        ASN  30  -6.670   5.385  -0.347
  188    HA   ASN  30           HA       ASN  30  -6.824   6.855   2.164
  189    HB2  ASN  30           1HB      ASN  30  -6.840   4.446   3.154
  190    HB3  ASN  30           2HB      ASN  30  -8.291   4.967   2.321
  191   HD21  ASN  30          1HD2      ASN  30  -9.107   3.267   1.355
  192   HD22  ASN  30          2HD2      ASN  30  -8.277   2.157   0.317
  193    H    CYS  31           H        CYS  31  -4.548   7.459   0.837
  194    HA   CYS  31           HA       CYS  31  -2.503   5.528   1.051
  195    HB2  CYS  31           1HB      CYS  31  -1.097   7.110   0.162
  196    HB3  CYS  31           2HB      CYS  31  -2.655   7.595  -0.478
  197    H    GLY  32           H        GLY  32  -0.761   5.455   2.626
  198    HA2  GLY  32           1HA      GLY  32  -0.305   7.155   4.721
  199    HA3  GLY  32           2HA      GLY  32  -1.593   6.110   5.287
  200    H    THR  33           H        THR  33   0.470   5.730   6.811
  201    HA   THR  33           HA       THR  33   2.337   3.832   5.665
  202    HB   THR  33           HB       THR  33   2.006   4.868   8.528
  203    HG1  THR  33           1HG      THR  33   3.409   5.726   6.103
  204   HG21  THR  33          3HG2      THR  33   4.722   4.530   7.790
  205   HG22  THR  33          1HG2      THR  33   3.804   3.507   8.921
  206   HG23  THR  33          2HG2      THR  33   3.906   3.062   7.200
  207    H    VAL  34           H        VAL  34  -0.835   3.661   6.711
  208    HA   VAL  34           HA       VAL  34  -0.647   1.281   8.263
  209    HB   VAL  34           HB       VAL  34  -2.944   2.650   6.853
  210   HG11  VAL  34          1HG1      VAL  34  -3.668   0.952   9.102
  211   HG12  VAL  34          2HG1      VAL  34  -4.321   0.992   7.447
  212   HG13  VAL  34          3HG1      VAL  34  -2.873   0.022   7.809
  213   HG21  VAL  34          3HG2      VAL  34  -2.162   4.112   8.528
  214   HG22  VAL  34          1HG2      VAL  34  -3.520   3.245   9.285
  215   HG23  VAL  34          2HG2      VAL  34  -1.845   2.781   9.666
  216    H    CYS  35           H        CYS  35  -1.310   2.104   4.816
  217    HA   CYS  35           HA       CYS  35  -1.968  -0.482   4.027
  218    HB2  CYS  35           1HB      CYS  35  -2.392   0.565   2.133
  219    HB3  CYS  35           2HB      CYS  35  -1.746   2.037   2.830
  220    H    CYS  36           H        CYS  36   0.981   0.932   5.136
  221    HA   CYS  36           HA       CYS  36   2.888  -0.301   3.596
  222    HB2  CYS  36           1HB      CYS  36   4.381   0.417   5.130
  223    HB3  CYS  36           2HB      CYS  36   3.012   1.400   5.609
  224    H    GLY  37           H        GLY  37   1.277  -1.435   6.656
  225    HA2  GLY  37           1HA      GLY  37   2.156  -4.179   5.990
  226    HA3  GLY  37           2HA      GLY  37   1.906  -3.566   7.612
  227    H    GLN  38           H        GLN  38  -0.131  -3.101   4.650
  228    HA   GLN  38           HA       GLN  38  -2.241  -4.500   6.102
  229    HB2  GLN  38           1HB      GLN  38  -2.302  -1.845   5.562
  230    HB3  GLN  38           2HB      GLN  38  -2.966  -2.434   4.051
  231    HG2  GLN  38           1HG      GLN  38  -4.461  -3.945   5.710
  232    HG3  GLN  38           2HG      GLN  38  -4.097  -2.653   6.837
  233   HE21  GLN  38          1HE2      GLN  38  -6.621  -3.430   5.623
  234   HE22  GLN  38          2HE2      GLN  38  -7.246  -2.049   4.784
  235    H    CYS  39           H        CYS  39  -1.062  -3.482   2.821
  236    HA   CYS  39           HA       CYS  39  -2.293  -5.929   1.786
  237    HB2  CYS  39           1HB      CYS  39  -1.680  -3.303   0.425
  238    HB3  CYS  39           2HB      CYS  39  -2.104  -4.762  -0.448
  239    H    PHE  40           H        PHE  40   0.629  -4.140   2.478
  240    HA   PHE  40           HA       PHE  40   2.165  -6.251   1.160
  241    HB2  PHE  40           1HB      PHE  40   3.151  -3.379   1.294
  242    HB3  PHE  40           2HB      PHE  40   3.558  -4.608   0.113
  243    HD1  PHE  40           1HD      PHE  40   2.002  -5.109  -1.740
  244    HD2  PHE  40           2HD      PHE  40   1.252  -1.947   0.988
  245    HE1  PHE  40           1HE      PHE  40   0.333  -4.128  -3.337
  246    HE2  PHE  40           2HE      PHE  40  -0.418  -0.965  -0.609
  247    HZ   PHE  40           HZ       PHE  40  -0.857  -2.068  -2.752
  248    H    SER  41           H        SER  41   4.683  -5.748   1.898
  249    HA   SER  41           HA       SER  41   4.706  -4.898   4.642
  250    HB2  SER  41           1HB      SER  41   4.632  -6.974   5.525
  251    HB3  SER  41           2HB      SER  41   4.549  -7.688   3.927
  252    HG   SER  41           HG       SER  41   6.764  -7.362   5.649
  253    H    PHE  42           H        PHE  42   6.990  -4.683   5.467
  254    HA   PHE  42           HA       PHE  42   8.629  -3.456   3.641
  255    HB2  PHE  42           1HB      PHE  42   8.524  -4.157   6.416
  256    HB3  PHE  42           2HB      PHE  42  10.045  -4.824   5.855
  257    HD1  PHE  42           1HD      PHE  42   8.080  -1.668   5.927
  258    HD2  PHE  42           2HD      PHE  42  11.920  -3.450   5.634
  259    HE1  PHE  42           1HE      PHE  42   9.146   0.596   6.123
  260    HE2  PHE  42           2HE      PHE  42  12.986  -1.186   5.830
  261    HZ   PHE  42           HZ       PHE  42  11.586   0.810   6.073
  262    HA   PRO  43           HA       PRO  43  10.743  -3.151   3.647
  263    HB2  PRO  43           1HB      PRO  43  12.394  -2.741   1.507
  264    HB3  PRO  43           2HB      PRO  43  12.963  -3.322   3.060
  265    HG2  PRO  43           1HG      PRO  43  12.573  -4.829   0.546
  266    HG3  PRO  43           2HG      PRO  43  13.519  -5.269   1.954
  267    HD2  PRO  43           1HD      PRO  43  10.943  -6.300   1.227
  268    HD3  PRO  43           2HD      PRO  43  11.838  -6.652   2.692
  269    H    VAL  44           H        VAL  44   8.668  -4.545   1.705
  270    HA   VAL  44           HA       VAL  44   8.313  -2.530  -0.258
  271    HB   VAL  44           HB       VAL  44   6.167  -4.407   0.677
  272   HG11  VAL  44          1HG1      VAL  44   5.935  -4.587  -1.889
  273   HG12  VAL  44          2HG1      VAL  44   5.434  -3.069  -1.105
  274   HG13  VAL  44          3HG1      VAL  44   7.000  -3.162  -1.945
  275   HG21  VAL  44          3HG2      VAL  44   7.587  -5.824  -1.254
  276   HG22  VAL  44          1HG2      VAL  44   8.850  -5.172  -0.182
  277   HG23  VAL  44          2HG2      VAL  44   7.537  -6.167   0.491
  278    H    SER  45           H        SER  45   6.998  -3.193   3.019
  279    HA   SER  45           HA       SER  45   4.917  -1.455   3.010
  280    HB2  SER  45           1HB      SER  45   4.953  -2.601   4.993
  281    HB3  SER  45           2HB      SER  45   6.704  -2.657   5.051
  282    HG   SER  45           HG       SER  45   6.669  -0.381   5.722
  283    H    GLN  46           H        GLN  46   8.374  -0.802   2.945
  284    HA   GLN  46           HA       GLN  46   8.167   1.826   3.966
  285    HB2  GLN  46           1HB      GLN  46  10.235   0.157   3.758
  286    HB3  GLN  46           2HB      GLN  46  10.446   0.930   2.200
  287    HG2  GLN  46           1HG      GLN  46  10.421   3.180   3.362
  288    HG3  GLN  46           2HG      GLN  46  10.332   2.350   4.902
  289   HE21  GLN  46          1HE2      GLN  46  12.248   2.919   5.737
  290   HE22  GLN  46          2HE2      GLN  46  13.795   2.478   5.096
  291    H    SER  47           H        SER  47   7.859   0.269   0.795
  292    HA   SER  47           HA       SER  47   8.187   2.676  -0.654
  293    HB2  SER  47           1HB      SER  47   6.738   0.228  -1.699
  294    HB3  SER  47           2HB      SER  47   7.729   1.369  -2.586
  295    HG   SER  47           HG       SER  47   9.070  -0.373  -2.333
  296    H    CYS  48           H        CYS  48   5.447   0.739   0.643
  297    HA   CYS  48           HA       CYS  48   3.374   1.961  -0.662
  298    HB2  CYS  48           1HB      CYS  48   2.697   0.146   0.533
  299    HB3  CYS  48           2HB      CYS  48   3.694   0.531   1.922
  300    H    ALA  49           H        ALA  49   4.722   2.760   2.632
  301    HA   ALA  49           HA       ALA  49   3.266   5.150   2.869
  302    HB1  ALA  49           3HB      ALA  49   5.804   4.148   4.220
  303    HB2  ALA  49           1HB      ALA  49   4.869   5.566   4.750
  304    HB3  ALA  49           2HB      ALA  49   4.134   3.946   4.800
  305    H    GLY  50           H        GLY  50   5.992   4.263   0.938
  306    HA2  GLY  50           1HA      GLY  50   7.218   6.875   0.881
  307    HA3  GLY  50           2HA      GLY  50   7.616   5.477  -0.098
  308    H    MET  51           H        MET  51   5.370   4.802  -1.477
  309    HA   MET  51           HA       MET  51   5.096   7.079  -3.194
  310    HB2  MET  51           1HB      MET  51   5.497   4.643  -3.944
  311    HB3  MET  51           2HB      MET  51   3.861   4.281  -3.431
  312    HG2  MET  51           1HG      MET  51   3.240   4.873  -5.547
  313    HG3  MET  51           2HG      MET  51   3.462   6.529  -5.018
  314    HE1  MET  51           3HE      MET  51   4.197   3.811  -7.077
  315    HE2  MET  51           1HE      MET  51   4.320   5.049  -8.349
  316    HE3  MET  51           2HE      MET  51   5.741   4.066  -7.924
  317    H    ALA  52           H        ALA  52   3.723   6.696  -0.389
  318    HA   ALA  52           HA       ALA  52   0.932   6.771  -1.181
  319    HB1  ALA  52           3HB      ALA  52   2.510   6.327   1.284
  320    HB2  ALA  52           1HB      ALA  52   1.021   7.272   1.520
  321    HB3  ALA  52           2HB      ALA  52   0.939   5.649   0.793
  322    H    ASP  53           H        ASP  53   2.946   8.867  -2.041
  323    HA   ASP  53           HA       ASP  53   3.039  11.018  -2.287
  324    HB2  ASP  53           1HB      ASP  53   0.207  10.530  -1.589
  325    HB3  ASP  53           2HB      ASP  53   0.719  12.158  -1.188
  326    H    SER  54           H        SER  54   3.301  13.143  -1.047
  327    HA   SER  54           HA       SER  54   3.656  12.552   1.783
  328    HB2  SER  54           1HB      SER  54   5.331  13.860  -0.225
  329    HB3  SER  54           2HB      SER  54   5.062  14.928   1.138
  330    HG   SER  54           HG       SER  54   6.799  12.916   1.007
  331    H    ASN  55           H        ASN  55   3.501  15.668  -0.064
  332    HA   ASN  55           HA       ASN  55   1.501  16.527   1.850
  333    HB2  ASN  55           1HB      ASN  55   3.787  17.786   0.965
  334    HB3  ASN  55           2HB      ASN  55   2.623  18.453  -0.162
  335   HD21  ASN  55          1HD2      ASN  55   3.901  20.074   1.584
  336   HD22  ASN  55          2HD2      ASN  55   2.823  20.680   2.797
  337    H    ASP  56           H        ASP  56   1.849  15.262  -1.302
  338    HA   ASP  56           HA       ASP  56  -0.033  16.870  -2.641
  339    HB2  ASP  56           1HB      ASP  56   1.819  14.916  -3.350
  340    HB3  ASP  56           2HB      ASP  56   0.303  14.066  -3.570
  341    H    CYS  57           H        CYS  57  -0.051  13.880  -0.672
  342    HA   CYS  57           HA       CYS  57  -2.571  12.945  -1.406
  343    HB2  CYS  57           1HB      CYS  57  -0.519  12.250   0.441
  344    HB3  CYS  57           2HB      CYS  57  -2.027  12.315   1.331
  345    HA   PRO  58           HA       PRO  58  -5.214  15.540   0.890
  346    HB2  PRO  58           1HB      PRO  58  -7.157  13.874   1.849
  347    HB3  PRO  58           2HB      PRO  58  -7.114  14.442   0.192
  348    HG2  PRO  58           1HG      PRO  58  -6.419  11.773   1.256
  349    HG3  PRO  58           2HG      PRO  58  -6.790  12.234  -0.393
  350    HD2  PRO  58           1HD      PRO  58  -4.190  11.702   0.696
  351    HD3  PRO  58           2HD      PRO  58  -4.553  12.276  -0.920
  352    H    ASN  59           H        ASN  59  -3.014  15.446   2.291
  353    HA   ASN  59           HA       ASN  59  -3.699  14.473   4.900
  354    HB2  ASN  59           1HB      ASN  59  -1.221  16.006   3.951
  355    HB3  ASN  59           2HB      ASN  59  -1.379  15.182   5.489
  356   HD21  ASN  59          1HD2      ASN  59  -1.512  12.918   5.566
  357   HD22  ASN  59          2HD2      ASN  59  -0.917  11.913   4.288
  358    H    ALA  60           H        ALA  60  -3.263  16.058   6.830
  359    HA   ALA  60           HA       ALA  60  -3.251  18.824   6.426
  360    HB1  ALA  60           3HB      ALA  60  -5.613  19.311   7.080
  361    HB2  ALA  60           1HB      ALA  60  -5.485  18.515   5.493
  362    HB3  ALA  60           2HB      ALA  60  -5.985  17.577   6.921
  Start of MODEL    3
    1    H1   ASP   1           H        ASP   1  10.130  -7.320  -5.105
    2    HA   ASP   1           HA       ASP   1   8.732  -5.997  -7.116
    3    HB2  ASP   1           1HB      ASP   1   8.285  -9.001  -6.856
    4    HB3  ASP   1           2HB      ASP   1   7.063  -7.936  -7.523
    5    H    ILE   2           H        ILE   2   6.263  -5.957  -6.471
    6    HA   ILE   2           HA       ILE   2   6.142  -6.042  -3.558
    7    HB   ILE   2           HB       ILE   2   4.665  -4.332  -3.649
    8   HG12  ILE   2          1HG1      ILE   2   3.760  -5.286  -6.381
    9   HG13  ILE   2          2HG1      ILE   2   2.917  -5.520  -4.863
   10   HG21  ILE   2          1HG2      ILE   2   5.390  -2.685  -5.220
   11   HG22  ILE   2          2HG2      ILE   2   6.797  -3.690  -4.796
   12   HG23  ILE   2          3HG2      ILE   2   5.967  -3.932  -6.352
   13   HD11  ILE   2          3HD1      ILE   2   2.994  -3.154  -6.605
   14   HD12  ILE   2          1HD1      ILE   2   1.842  -3.571  -5.314
   15   HD13  ILE   2          2HD1      ILE   2   3.371  -2.755  -4.912
   16    H    GLU   3           H        GLU   3   4.725  -7.420  -6.527
   17    HA   GLU   3           HA       GLU   3   2.474  -8.527  -5.458
   18    HB2  GLU   3           1HB      GLU   3   2.629 -10.168  -7.332
   19    HB3  GLU   3           2HB      GLU   3   2.930  -8.524  -7.858
   20    HG2  GLU   3           1HG      GLU   3   4.920  -9.194  -8.707
   21    HG3  GLU   3           2HG      GLU   3   5.473  -9.530  -7.078
   22    H    ASP   4           H        ASP   4   5.877  -9.505  -5.148
   23    HA   ASP   4           HA       ASP   4   5.300 -12.098  -4.224
   24    HB2  ASP   4           1HB      ASP   4   7.767 -10.340  -3.825
   25    HB3  ASP   4           2HB      ASP   4   7.705 -12.056  -3.477
   26    H    PHE   5           H        PHE   5   4.698  -9.050  -2.926
   27    HA   PHE   5           HA       PHE   5   4.866 -10.097  -0.192
   28    HB2  PHE   5           1HB      PHE   5   5.751  -7.505  -1.495
   29    HB3  PHE   5           2HB      PHE   5   5.066  -7.373   0.113
   30    HD1  PHE   5           2HD      PHE   5   6.199  -8.417   2.034
   31    HD2  PHE   5           1HD      PHE   5   7.915  -8.497  -1.846
   32    HE1  PHE   5           2HE      PHE   5   8.420  -9.028   3.030
   33    HE2  PHE   5           1HE      PHE   5  10.137  -9.108  -0.850
   34    HZ   PHE   5           HZ       PHE   5  10.363  -9.366   1.576
   35    H    TYR   6           H        TYR   6   2.716  -9.816  -2.448
   36    HA   TYR   6           HA       TYR   6   0.903  -7.869  -1.386
   37    HB2  TYR   6           1HB      TYR   6   1.176  -8.725  -3.816
   38    HB3  TYR   6           2HB      TYR   6   0.550 -10.273  -3.283
   39    HD1  TYR   6           1HD      TYR   6  -0.876  -7.253  -1.801
   40    HD2  TYR   6           2HD      TYR   6  -1.241 -10.083  -4.989
   41    HE1  TYR   6           1HE      TYR   6  -3.247  -6.451  -2.251
   42    HE2  TYR   6           2HE      TYR   6  -3.610  -9.272  -5.428
   43    HH   TYR   6           HH       TYR   6  -5.249  -8.036  -4.708
   44    H    THR   7           H        THR   7  -0.332  -8.139   0.399
   45    HA   THR   7           HA       THR   7  -0.914 -10.901   1.221
   46    HB   THR   7           HB       THR   7  -1.187  -9.881   3.469
   47    HG1  THR   7           1HG      THR   7  -2.000  -7.825   2.375
   48   HG21  THR   7          3HG2      THR   7   1.219  -8.351   2.562
   49   HG22  THR   7          1HG2      THR   7   1.065  -9.536   3.882
   50   HG23  THR   7          2HG2      THR   7   1.253 -10.093   2.202
   51    H    SER   8           H        SER   8  -2.614 -11.226  -0.318
   52    HA   SER   8           HA       SER   8  -4.752  -9.456  -0.495
   53    HB2  SER   8           1HB      SER   8  -4.706 -10.898  -2.301
   54    HB3  SER   8           2HB      SER   8  -4.165 -12.263  -1.344
   55    HG   SER   8           HG       SER   8  -6.394 -12.458  -2.131
   56    H    GLU   9           H        GLU   9  -3.732 -11.449   2.067
   57    HA   GLU   9           HA       GLU   9  -6.229 -12.361   2.964
   58    HB2  GLU   9           1HB      GLU   9  -3.553 -12.775   3.649
   59    HB3  GLU   9           2HB      GLU   9  -4.184 -11.933   5.050
   60    HG2  GLU   9           1HG      GLU   9  -6.014 -13.581   5.270
   61    HG3  GLU   9           2HG      GLU   9  -5.508 -14.384   3.797
   62    H    THR  10           H        THR  10  -4.056  -9.676   4.118
   63    HA   THR  10           HA       THR  10  -6.249  -8.581   5.669
   64    HB   THR  10           HB       THR  10  -4.117  -8.547   6.766
   65    HG1  THR  10           1HG      THR  10  -5.110  -6.469   6.906
   66   HG21  THR  10          3HG2      THR  10  -3.113  -7.785   4.023
   67   HG22  THR  10          1HG2      THR  10  -2.275  -7.084   5.428
   68   HG23  THR  10          2HG2      THR  10  -2.368  -8.852   5.238
   69    H    CYS  11           H        CYS  11  -4.633  -8.083   2.562
   70    HA   CYS  11           HA       CYS  11  -5.454  -5.445   2.174
   71    HB2  CYS  11           1HB      CYS  11  -3.732  -6.834   0.879
   72    HB3  CYS  11           2HB      CYS  11  -5.090  -7.478  -0.022
   73    HA   PRO  12           HA       PRO  12  -9.703  -6.169   1.464
   74    HB2  PRO  12           1HB      PRO  12 -10.418  -3.720   0.485
   75    HB3  PRO  12           2HB      PRO  12 -10.258  -4.058   2.197
   76    HG2  PRO  12           1HG      PRO  12  -8.431  -2.553   0.427
   77    HG3  PRO  12           2HG      PRO  12  -8.518  -2.544   2.177
   78    HD2  PRO  12           1HD      PRO  12  -6.569  -3.894   0.563
   79    HD3  PRO  12           2HD      PRO  12  -6.727  -3.979   2.306
   80    H    TYR  13           H        TYR  13  -7.440  -5.630  -0.945
   81    HA   TYR  13           HA       TYR  13  -9.449  -6.397  -2.956
   82    HB2  TYR  13           1HB      TYR  13  -6.716  -5.004  -3.242
   83    HB3  TYR  13           2HB      TYR  13  -7.901  -5.194  -4.519
   84    HD1  TYR  13           1HD      TYR  13  -9.946  -3.812  -4.557
   85    HD2  TYR  13           2HD      TYR  13  -6.956  -3.278  -1.545
   86    HE1  TYR  13           1HE      TYR  13 -10.950  -1.556  -3.950
   87    HE2  TYR  13           2HE      TYR  13  -7.970  -1.025  -0.947
   88    HH   TYR  13           HH       TYR  13  -9.571   0.377  -1.305
   89    H    LYS  14           H        LYS  14  -9.035  -8.176  -4.264
   90    HA   LYS  14           HA       LYS  14  -6.446  -9.487  -3.859
   91    HB2  LYS  14           1HB      LYS  14  -7.838 -11.675  -3.958
   92    HB3  LYS  14           2HB      LYS  14  -7.719 -10.798  -2.445
   93    HG2  LYS  14           1HG      LYS  14 -10.050 -11.360  -2.740
   94    HG3  LYS  14           2HG      LYS  14  -9.909  -9.636  -3.020
   95    HD2  LYS  14           1HD      LYS  14  -9.527 -11.297  -5.460
   96    HD3  LYS  14           2HD      LYS  14 -11.124 -11.426  -4.750
   97    HE2  LYS  14           1HE      LYS  14 -10.864  -8.731  -4.627
   98    HE3  LYS  14           2HE      LYS  14  -9.771  -9.027  -5.965
   99    HZ1  LYS  14           3HZ      LYS  14 -12.625  -9.466  -5.817
  100    HZ2  LYS  14           1HZ      LYS  14 -11.723  -8.897  -7.053
  101    HZ3  LYS  14           2HZ      LYS  14 -11.763 -10.499  -6.742
  102    H    ASN  15           H        ASN  15  -7.380  -7.667  -5.961
  103    HA   ASN  15           HA       ASN  15  -7.883  -9.500  -8.139
  104    HB2  ASN  15           1HB      ASN  15  -8.864  -6.970  -7.602
  105    HB3  ASN  15           2HB      ASN  15  -7.542  -6.572  -8.682
  106   HD21  ASN  15          1HD2      ASN  15 -10.167  -6.101  -9.338
  107   HD22  ASN  15          2HD2      ASN  15 -10.661  -7.116 -10.652
  108    H    ASP  16           H        ASP  16  -5.571  -6.994  -6.925
  109    HA   ASP  16           HA       ASP  16  -3.430  -8.307  -8.214
  110    HB2  ASP  16           1HB      ASP  16  -4.714  -6.515  -9.853
  111    HB3  ASP  16           2HB      ASP  16  -3.580  -5.439  -9.061
  112    H    SER  17           H        SER  17  -1.342  -7.394  -7.427
  113    HA   SER  17           HA       SER  17  -1.614  -6.244  -4.882
  114    HB2  SER  17           1HB      SER  17   0.922  -6.197  -4.966
  115    HB3  SER  17           2HB      SER  17   0.206  -7.769  -5.262
  116    HG   SER  17           HG       SER  17   0.961  -5.956  -7.388
  117    H    GLN  18           H        GLN  18  -0.825  -5.039  -8.156
  118    HA   GLN  18           HA       GLN  18   0.092  -2.534  -7.246
  119    HB2  GLN  18           1HB      GLN  18  -0.834  -3.527  -9.973
  120    HB3  GLN  18           2HB      GLN  18  -0.204  -1.913  -9.712
  121    HG2  GLN  18           1HG      GLN  18   1.946  -2.796  -8.947
  122    HG3  GLN  18           2HG      GLN  18   1.328  -4.436  -8.939
  123   HE21  GLN  18          1HE2      GLN  18   3.608  -3.634 -10.317
  124   HE22  GLN  18          2HE2      GLN  18   3.359  -3.803 -12.023
  125    H    LEU  19           H        LEU  19  -3.048  -3.987  -7.795
  126    HA   LEU  19           HA       LEU  19  -4.498  -1.649  -8.358
  127    HB2  LEU  19           1HB      LEU  19  -5.521  -3.654  -8.909
  128    HB3  LEU  19           2HB      LEU  19  -5.155  -4.397  -7.365
  129    HG   LEU  19           HG       LEU  19  -7.582  -3.797  -7.823
  130   HD11  LEU  19          1HD1      LEU  19  -6.411  -4.229  -5.549
  131   HD12  LEU  19          2HD1      LEU  19  -6.613  -2.478  -5.300
  132   HD13  LEU  19          3HD1      LEU  19  -8.039  -3.510  -5.568
  133   HD21  LEU  19          3HD2      LEU  19  -8.027  -1.327  -7.051
  134   HD22  LEU  19          1HD2      LEU  19  -6.387  -1.054  -7.686
  135   HD23  LEU  19          2HD2      LEU  19  -7.659  -1.699  -8.752
  136    H    ALA  20           H        ALA  20  -4.122  -3.506  -5.251
  137    HA   ALA  20           HA       ALA  20  -5.393  -1.584  -3.685
  138    HB1  ALA  20           3HB      ALA  20  -5.213  -3.504  -2.485
  139    HB2  ALA  20           1HB      ALA  20  -3.723  -4.002  -3.321
  140    HB3  ALA  20           2HB      ALA  20  -3.642  -2.838  -1.977
  141    H    TRP  21           H        TRP  21  -2.038  -1.908  -4.874
  142    HA   TRP  21           HA       TRP  21  -0.927   0.019  -3.140
  143    HB2  TRP  21           1HB      TRP  21   0.599  -1.435  -4.092
  144    HB3  TRP  21           2HB      TRP  21  -0.096  -1.303  -5.695
  145    HD1  TRP  21           HD       TRP  21   0.350   1.275  -6.899
  146    HE1  TRP  21           1HE      TRP  21   2.506   2.798  -6.906
  147    HE3  TRP  21           3HE      TRP  21   2.508  -0.854  -2.816
  148    HZ2  TRP  21           2HZ      TRP  21   4.820   2.937  -5.242
  149    HZ3  TRP  21           3HZ      TRP  21   4.716   0.034  -2.074
  150    HH2  TRP  21           HH       TRP  21   5.868   1.863  -3.214
  151    H    ASP  22           H        ASP  22  -2.492   0.081  -6.386
  152    HA   ASP  22           HA       ASP  22  -1.880   2.717  -6.958
  153    HB2  ASP  22           1HB      ASP  22  -3.715   0.619  -7.943
  154    HB3  ASP  22           2HB      ASP  22  -4.383   2.227  -8.138
  155    H    THR  23           H        THR  23  -3.923   1.296  -4.572
  156    HA   THR  23           HA       THR  23  -5.811   3.510  -4.501
  157    HB   THR  23           HB       THR  23  -5.636   0.712  -3.562
  158    HG1  THR  23           1HG      THR  23  -7.252   1.600  -5.015
  159   HG21  THR  23          3HG2      THR  23  -7.328   1.301  -1.667
  160   HG22  THR  23          1HG2      THR  23  -5.601   1.522  -1.296
  161   HG23  THR  23          2HG2      THR  23  -6.610   2.930  -1.707
  162    H    CYS  24           H        CYS  24  -3.267   2.024  -2.396
  163    HA   CYS  24           HA       CYS  24  -3.482   4.253  -0.599
  164    HB2  CYS  24           1HB      CYS  24  -2.930   2.549   0.730
  165    HB3  CYS  24           2HB      CYS  24  -2.265   1.599  -0.583
  166    H    SER  25           H        SER  25  -0.649   2.712  -2.295
  167    HA   SER  25           HA       SER  25   0.686   5.223  -2.306
  168    HB2  SER  25           1HB      SER  25   2.141   3.480  -3.949
  169    HB3  SER  25           2HB      SER  25   2.413   3.766  -2.242
  170    HG   SER  25           HG       SER  25   1.567   1.846  -1.743
  171    H    GLY  26           H        GLY  26  -1.583   5.781  -3.648
  172    HA2  GLY  26           1HA      GLY  26  -0.791   5.731  -6.499
  173    HA3  GLY  26           2HA      GLY  26  -2.447   5.545  -5.957
  174    H    GLY  27           H        GLY  27  -1.084   7.618  -3.721
  175    HA2  GLY  27           1HA      GLY  27  -0.609   9.935  -3.863
  176    HA3  GLY  27           2HA      GLY  27  -1.529  10.033  -5.352
  177    H    THR  28           H        THR  28  -3.896   8.643  -4.711
  178    HA   THR  28           HA       THR  28  -4.937  10.210  -2.443
  179    HB   THR  28           HB       THR  28  -6.998  10.508  -3.815
  180    HG1  THR  28           1HG      THR  28  -6.964   8.713  -5.195
  181   HG21  THR  28          3HG2      THR  28  -4.337  11.292  -5.063
  182   HG22  THR  28          1HG2      THR  28  -5.862  11.646  -5.911
  183   HG23  THR  28          2HG2      THR  28  -5.557  12.341  -4.301
  184    H    GLY  29           H        GLY  29  -7.303   9.247  -1.928
  185    HA2  GLY  29           1HA      GLY  29  -8.572   7.343  -1.544
  186    HA3  GLY  29           2HA      GLY  29  -7.236   6.326  -2.045
  187    H    ASN  30           H        ASN  30  -6.866   5.011  -0.279
  188    HA   ASN  30           HA       ASN  30  -6.840   6.260   2.319
  189    HB2  ASN  30           1HB      ASN  30  -6.566   3.857   3.118
  190    HB3  ASN  30           2HB      ASN  30  -8.022   4.127   2.181
  191   HD21  ASN  30          1HD2      ASN  30  -8.301   2.132   1.379
  192   HD22  ASN  30          2HD2      ASN  30  -7.227   1.333   0.280
  193    H    CYS  31           H        CYS  31  -4.733   7.032   0.481
  194    HA   CYS  31           HA       CYS  31  -2.444   5.463   0.721
  195    HB2  CYS  31           1HB      CYS  31  -1.273   7.249  -0.229
  196    HB3  CYS  31           2HB      CYS  31  -2.878   7.315  -0.929
  197    H    GLY  32           H        GLY  32  -0.943   5.265   2.384
  198    HA2  GLY  32           1HA      GLY  32  -0.325   7.210   4.274
  199    HA3  GLY  32           2HA      GLY  32  -1.597   6.223   4.965
  200    H    THR  33           H        THR  33   0.467   5.908   6.465
  201    HA   THR  33           HA       THR  33   2.324   3.951   5.408
  202    HB   THR  33           HB       THR  33   1.996   5.237   8.172
  203    HG1  THR  33           1HG      THR  33   3.910   6.430   7.154
  204   HG21  THR  33          3HG2      THR  33   4.437   4.656   8.374
  205   HG22  THR  33          1HG2      THR  33   3.418   3.200   8.273
  206   HG23  THR  33          2HG2      THR  33   4.326   3.751   6.845
  207    H    VAL  34           H        VAL  34  -0.836   3.843   6.514
  208    HA   VAL  34           HA       VAL  34  -0.615   1.535   8.173
  209    HB   VAL  34           HB       VAL  34  -2.910   2.941   6.804
  210   HG11  VAL  34          1HG1      VAL  34  -3.297   0.455   7.134
  211   HG12  VAL  34          2HG1      VAL  34  -3.165   0.751   8.884
  212   HG13  VAL  34          3HG1      VAL  34  -4.458   1.535   7.943
  213   HG21  VAL  34          3HG2      VAL  34  -2.223   2.768   9.753
  214   HG22  VAL  34          1HG2      VAL  34  -1.698   4.096   8.690
  215   HG23  VAL  34          2HG2      VAL  34  -3.433   3.814   8.971
  216    H    CYS  35           H        CYS  35  -1.322   2.218   4.710
  217    HA   CYS  35           HA       CYS  35  -2.051  -0.384   4.041
  218    HB2  CYS  35           1HB      CYS  35  -2.469   0.583   2.103
  219    HB3  CYS  35           2HB      CYS  35  -1.797   2.074   2.735
  220    H    CYS  36           H        CYS  36   0.939   0.997   5.066
  221    HA   CYS  36           HA       CYS  36   2.810  -0.319   3.559
  222    HB2  CYS  36           1HB      CYS  36   4.332   0.358   5.098
  223    HB3  CYS  36           2HB      CYS  36   3.005   1.430   5.501
  224    H    GLY  37           H        GLY  37   1.168  -1.351   6.639
  225    HA2  GLY  37           1HA      GLY  37   1.993  -4.128   6.038
  226    HA3  GLY  37           2HA      GLY  37   1.747  -3.473   7.645
  227    H    GLN  38           H        GLN  38  -0.292  -2.938   4.707
  228    HA   GLN  38           HA       GLN  38  -2.413  -4.346   6.133
  229    HB2  GLN  38           1HB      GLN  38  -2.444  -1.678   5.713
  230    HB3  GLN  38           2HB      GLN  38  -3.101  -2.180   4.167
  231    HG2  GLN  38           1HG      GLN  38  -5.002  -1.886   5.596
  232    HG3  GLN  38           2HG      GLN  38  -4.784  -3.621   5.467
  233   HE21  GLN  38          1HE2      GLN  38  -6.173  -3.275   7.467
  234   HE22  GLN  38          2HE2      GLN  38  -5.357  -3.210   8.993
  235    H    CYS  39           H        CYS  39  -1.047  -3.362   2.936
  236    HA   CYS  39           HA       CYS  39  -2.461  -5.655   1.784
  237    HB2  CYS  39           1HB      CYS  39  -1.670  -3.003   0.600
  238    HB3  CYS  39           2HB      CYS  39  -1.969  -4.398  -0.417
  239    H    PHE  40           H        PHE  40   0.585  -4.017   2.489
  240    HA   PHE  40           HA       PHE  40   1.992  -6.287   1.297
  241    HB2  PHE  40           1HB      PHE  40   3.177  -3.491   1.301
  242    HB3  PHE  40           2HB      PHE  40   3.481  -4.796   0.171
  243    HD1  PHE  40           2HD      PHE  40   1.111  -2.130   1.089
  244    HD2  PHE  40           1HD      PHE  40   2.158  -5.055  -1.803
  245    HE1  PHE  40           2HE      PHE  40  -0.489  -1.091  -0.542
  246    HE2  PHE  40           1HE      PHE  40   0.559  -4.015  -3.434
  247    HZ   PHE  40           HZ       PHE  40  -0.746  -2.045  -2.784
  248    H    SER  41           H        SER  41   4.576  -5.716   2.010
  249    HA   SER  41           HA       SER  41   4.573  -4.847   4.742
  250    HB2  SER  41           1HB      SER  41   4.860  -7.719   3.921
  251    HB3  SER  41           2HB      SER  41   5.951  -7.143   5.165
  252    HG   SER  41           HG       SER  41   4.345  -7.132   6.581
  253    H    PHE  42           H        PHE  42   6.853  -4.635   5.585
  254    HA   PHE  42           HA       PHE  42   8.513  -3.455   3.736
  255    HB2  PHE  42           1HB      PHE  42   8.365  -4.048   6.532
  256    HB3  PHE  42           2HB      PHE  42   9.891  -4.743   6.022
  257    HD1  PHE  42           1HD      PHE  42   7.952  -1.569   5.680
  258    HD2  PHE  42           2HD      PHE  42  11.765  -3.395   6.039
  259    HE1  PHE  42           1HE      PHE  42   9.024   0.696   5.806
  260    HE2  PHE  42           2HE      PHE  42  12.838  -1.130   6.165
  261    HZ   PHE  42           HZ       PHE  42  11.455   0.889   6.047
  262    HA   PRO  43           HA       PRO  43  10.653  -3.165   3.820
  263    HB2  PRO  43           1HB      PRO  43  12.381  -2.824   1.730
  264    HB3  PRO  43           2HB      PRO  43  12.889  -3.376   3.314
  265    HG2  PRO  43           1HG      PRO  43  12.566  -4.935   0.823
  266    HG3  PRO  43           2HG      PRO  43  13.458  -5.353   2.272
  267    HD2  PRO  43           1HD      PRO  43  10.896  -6.371   1.480
  268    HD3  PRO  43           2HD      PRO  43  11.735  -6.700   2.983
  269    H    VAL  44           H        VAL  44   8.620  -4.573   1.851
  270    HA   VAL  44           HA       VAL  44   8.360  -2.596  -0.169
  271    HB   VAL  44           HB       VAL  44   6.158  -4.428   0.715
  272   HG11  VAL  44          1HG1      VAL  44   5.519  -3.136  -1.131
  273   HG12  VAL  44          2HG1      VAL  44   7.124  -3.252  -1.892
  274   HG13  VAL  44          3HG1      VAL  44   6.051  -4.671  -1.859
  275   HG21  VAL  44          3HG2      VAL  44   7.608  -5.939  -1.095
  276   HG22  VAL  44          1HG2      VAL  44   8.869  -5.243  -0.048
  277   HG23  VAL  44          2HG2      VAL  44   7.543  -6.192   0.666
  278    H    SER  45           H        SER  45   6.928  -3.185   3.072
  279    HA   SER  45           HA       SER  45   4.856  -1.446   2.967
  280    HB2  SER  45           1HB      SER  45   4.777  -2.406   5.022
  281    HB3  SER  45           2HB      SER  45   6.504  -2.701   5.039
  282    HG   SER  45           HG       SER  45   5.872  -1.239   6.738
  283    H    GLN  46           H        GLN  46   8.293  -0.781   2.878
  284    HA   GLN  46           HA       GLN  46   8.084   1.866   3.863
  285    HB2  GLN  46           1HB      GLN  46  10.155   0.141   3.598
  286    HB3  GLN  46           2HB      GLN  46  10.382   1.046   2.115
  287    HG2  GLN  46           1HG      GLN  46  10.195   3.188   3.565
  288    HG3  GLN  46           2HG      GLN  46  10.334   2.136   4.960
  289   HE21  GLN  46          1HE2      GLN  46  12.127   4.203   4.131
  290   HE22  GLN  46          2HE2      GLN  46  13.679   3.496   3.829
  291    H    SER  47           H        SER  47   7.836   0.242   0.710
  292    HA   SER  47           HA       SER  47   8.127   2.637  -0.769
  293    HB2  SER  47           1HB      SER  47   6.765   0.125  -1.786
  294    HB3  SER  47           2HB      SER  47   7.711   1.290  -2.691
  295    HG   SER  47           HG       SER  47   9.538   0.290  -2.140
  296    H    CYS  48           H        CYS  48   5.440   0.714   0.615
  297    HA   CYS  48           HA       CYS  48   3.355   1.892  -0.775
  298    HB2  CYS  48           1HB      CYS  48   2.651   0.049   0.340
  299    HB3  CYS  48           2HB      CYS  48   3.657   0.357   1.741
  300    H    ALA  49           H        ALA  49   4.838   2.680   2.454
  301    HA   ALA  49           HA       ALA  49   3.281   5.070   2.692
  302    HB1  ALA  49           3HB      ALA  49   4.331   5.274   4.808
  303    HB2  ALA  49           1HB      ALA  49   4.167   3.520   4.557
  304    HB3  ALA  49           2HB      ALA  49   5.739   4.312   4.297
  305    H    GLY  50           H        GLY  50   5.748   4.248   0.637
  306    HA2  GLY  50           1HA      GLY  50   7.173   6.807   0.873
  307    HA3  GLY  50           2HA      GLY  50   7.678   5.398  -0.040
  308    H    MET  51           H        MET  51   5.366   4.734  -1.501
  309    HA   MET  51           HA       MET  51   5.408   6.893  -3.387
  310    HB2  MET  51           1HB      MET  51   5.623   4.399  -3.966
  311    HB3  MET  51           2HB      MET  51   3.949   4.195  -3.491
  312    HG2  MET  51           1HG      MET  51   3.377   4.740  -5.624
  313    HG3  MET  51           2HG      MET  51   3.861   6.384  -5.259
  314    HE1  MET  51           3HE      MET  51   3.808   5.139  -8.044
  315    HE2  MET  51           1HE      MET  51   4.540   6.758  -7.932
  316    HE3  MET  51           2HE      MET  51   5.385   5.457  -8.805
  317    H    ALA  52           H        ALA  52   3.804   6.705  -0.631
  318    HA   ALA  52           HA       ALA  52   1.111   7.084  -1.647
  319    HB1  ALA  52           3HB      ALA  52   1.103   5.816   0.316
  320    HB2  ALA  52           1HB      ALA  52   2.413   6.767   1.057
  321    HB3  ALA  52           2HB      ALA  52   0.776   7.454   0.933
  322    H    ASP  53           H        ASP  53   3.177   8.948  -2.540
  323    HA   ASP  53           HA       ASP  53   3.588  11.073  -2.718
  324    HB2  ASP  53           1HB      ASP  53   0.687  10.887  -2.163
  325    HB3  ASP  53           2HB      ASP  53   1.346  12.459  -1.758
  326    H    SER  54           H        SER  54   3.343  13.387  -1.373
  327    HA   SER  54           HA       SER  54   3.892  12.681   1.405
  328    HB2  SER  54           1HB      SER  54   5.467  14.156  -0.552
  329    HB3  SER  54           2HB      SER  54   5.098  15.194   0.811
  330    HG   SER  54           HG       SER  54   6.678  12.842   0.698
  331    H    ASN  55           H        ASN  55   3.278  15.712  -0.524
  332    HA   ASN  55           HA       ASN  55   1.648  16.680   1.609
  333    HB2  ASN  55           1HB      ASN  55   3.253  17.901  -0.276
  334    HB3  ASN  55           2HB      ASN  55   1.683  18.112  -1.027
  335   HD21  ASN  55          1HD2      ASN  55   3.656  19.930   0.351
  336   HD22  ASN  55          2HD2      ASN  55   2.733  20.831   1.507
  337    H    ASP  56           H        ASP  56   1.299  14.818  -1.298
  338    HA   ASP  56           HA       ASP  56  -1.254  15.738  -2.044
  339    HB2  ASP  56           1HB      ASP  56   0.675  14.165  -3.208
  340    HB3  ASP  56           2HB      ASP  56  -0.448  12.927  -2.683
  341    H    CYS  57           H        CYS  57   0.111  13.260   0.142
  342    HA   CYS  57           HA       CYS  57  -2.256  11.775   0.469
  343    HB2  CYS  57           1HB      CYS  57   0.383  11.487   1.204
  344    HB3  CYS  57           2HB      CYS  57  -0.400  11.791   2.741
  345    HA   PRO  58           HA       PRO  58  -4.318  14.437   3.236
  346    HB2  PRO  58           1HB      PRO  58  -6.057  12.699   4.430
  347    HB3  PRO  58           2HB      PRO  58  -6.337  13.400   2.849
  348    HG2  PRO  58           1HG      PRO  58  -5.487  10.653   3.534
  349    HG3  PRO  58           2HG      PRO  58  -6.174  11.248   2.035
  350    HD2  PRO  58           1HD      PRO  58  -3.418  10.628   2.534
  351    HD3  PRO  58           2HD      PRO  58  -4.086  11.332   1.075
  352    H    ASN  59           H        ASN  59  -1.907  14.289   4.167
  353    HA   ASN  59           HA       ASN  59  -2.033  13.061   6.755
  354    HB2  ASN  59           1HB      ASN  59   0.153  14.719   5.390
  355    HB3  ASN  59           2HB      ASN  59   0.349  13.911   6.932
  356   HD21  ASN  59          1HD2      ASN  59   2.132  13.196   5.237
  357   HD22  ASN  59          2HD2      ASN  59   1.850  11.653   4.500
  358    H    ALA  60           H        ALA  60  -1.369  14.436   8.731
  359    HA   ALA  60           HA       ALA  60  -1.403  17.231   8.633
  360    HB1  ALA  60           3HB      ALA  60  -3.582  17.822   9.214
  361    HB2  ALA  60           1HB      ALA  60  -3.871  16.499   8.059
  362    HB3  ALA  60           2HB      ALA  60  -3.978  16.192   9.809
  Start of MODEL    4
    1    H1   ASP   1           H        ASP   1  10.560  -5.851  -6.842
    2    HA   ASP   1           HA       ASP   1   8.051  -5.992  -7.526
    3    HB2  ASP   1           1HB      ASP   1  10.040  -7.851  -6.974
    4    HB3  ASP   1           2HB      ASP   1   8.792  -8.331  -5.841
    5    H    ILE   2           H        ILE   2   6.032  -5.742  -6.536
    6    HA   ILE   2           HA       ILE   2   6.006  -5.789  -3.604
    7    HB   ILE   2           HB       ILE   2   4.498  -4.101  -3.607
    8   HG12  ILE   2          1HG1      ILE   2   3.583  -4.928  -6.377
    9   HG13  ILE   2          2HG1      ILE   2   2.766  -5.284  -4.869
   10   HG21  ILE   2          1HG2      ILE   2   6.602  -3.368  -4.731
   11   HG22  ILE   2          2HG2      ILE   2   5.785  -3.582  -6.298
   12   HG23  ILE   2          3HG2      ILE   2   5.175  -2.383  -5.133
   13   HD11  ILE   2          3HD1      ILE   2   2.678  -2.851  -6.471
   14   HD12  ILE   2          1HD1      ILE   2   1.656  -3.324  -5.093
   15   HD13  ILE   2          2HD1      ILE   2   3.199  -2.484  -4.809
   16    H    GLU   3           H        GLU   3   4.525  -7.043  -6.604
   17    HA   GLU   3           HA       GLU   3   2.327  -8.240  -5.517
   18    HB2  GLU   3           1HB      GLU   3   2.461  -9.793  -7.483
   19    HB3  GLU   3           2HB      GLU   3   2.656  -8.108  -7.921
   20    HG2  GLU   3           1HG      GLU   3   5.171  -9.606  -7.260
   21    HG3  GLU   3           2HG      GLU   3   4.362 -10.068  -8.744
   22    H    ASP   4           H        ASP   4   5.751  -9.169  -5.372
   23    HA   ASP   4           HA       ASP   4   5.252 -11.824  -4.589
   24    HB2  ASP   4           1HB      ASP   4   7.516 -10.135  -5.154
   25    HB3  ASP   4           2HB      ASP   4   7.777 -10.834  -3.569
   26    H    PHE   5           H        PHE   5   4.935  -8.747  -3.073
   27    HA   PHE   5           HA       PHE   5   5.113  -9.989  -0.418
   28    HB2  PHE   5           1HB      PHE   5   5.837  -7.276  -1.596
   29    HB3  PHE   5           2HB      PHE   5   5.328  -7.325   0.080
   30    HD1  PHE   5           1HD      PHE   5   7.915  -8.402  -2.295
   31    HD2  PHE   5           2HD      PHE   5   6.746  -8.259   1.781
   32    HE1  PHE   5           1HE      PHE   5  10.246  -9.029  -1.605
   33    HE2  PHE   5           2HE      PHE   5   9.077  -8.886   2.472
   34    HZ   PHE   5           HZ       PHE   5  10.798  -9.264   0.770
   35    H    TYR   6           H        TYR   6   2.869  -9.558  -2.590
   36    HA   TYR   6           HA       TYR   6   1.080  -7.729  -1.308
   37    HB2  TYR   6           1HB      TYR   6   1.258  -8.389  -3.804
   38    HB3  TYR   6           2HB      TYR   6   0.682  -9.987  -3.370
   39    HD1  TYR   6           1HD      TYR   6  -0.640  -6.907  -1.803
   40    HD2  TYR   6           2HD      TYR   6  -1.277  -9.917  -4.776
   41    HE1  TYR   6           1HE      TYR   6  -3.041  -6.124  -2.092
   42    HE2  TYR   6           2HE      TYR   6  -3.676  -9.123  -5.055
   43    HH   TYR   6           HH       TYR   6  -4.756  -6.363  -4.321
   44    H    THR   7           H        THR   7  -0.490  -8.133   0.200
   45    HA   THR   7           HA       THR   7  -0.840 -10.957   0.968
   46    HB   THR   7           HB       THR   7  -1.093 -10.130   3.262
   47    HG1  THR   7           1HG      THR   7  -2.198  -8.127   2.482
   48   HG21  THR   7          3HG2      THR   7   1.117  -8.326   2.234
   49   HG22  THR   7          1HG2      THR   7   1.083  -9.324   3.708
   50   HG23  THR   7          2HG2      THR   7   1.322 -10.091   2.119
   51    H    SER   8           H        SER   8  -2.532 -11.328  -0.530
   52    HA   SER   8           HA       SER   8  -4.745  -9.598  -0.600
   53    HB2  SER   8           1HB      SER   8  -4.266 -10.974  -2.527
   54    HB3  SER   8           2HB      SER   8  -4.283 -12.444  -1.572
   55    HG   SER   8           HG       SER   8  -6.270 -12.285  -2.681
   56    H    GLU   9           H        GLU   9  -3.626 -11.600   1.835
   57    HA   GLU   9           HA       GLU   9  -6.064 -12.825   2.576
   58    HB2  GLU   9           1HB      GLU   9  -3.366 -13.111   3.265
   59    HB3  GLU   9           2HB      GLU   9  -4.080 -12.462   4.728
   60    HG2  GLU   9           1HG      GLU   9  -5.505 -14.714   3.298
   61    HG3  GLU   9           2HG      GLU   9  -4.082 -15.092   4.249
   62    H    THR  10           H        THR  10  -4.108 -10.059   3.899
   63    HA   THR  10           HA       THR  10  -6.416  -9.257   5.496
   64    HB   THR  10           HB       THR  10  -4.331  -9.298   6.707
   65    HG1  THR  10           1HG      THR  10  -5.079  -7.293   7.299
   66   HG21  THR  10          3HG2      THR  10  -2.511  -9.300   5.220
   67   HG22  THR  10          1HG2      THR  10  -3.245  -8.067   4.166
   68   HG23  THR  10          2HG2      THR  10  -2.506  -7.589   5.714
   69    H    CYS  11           H        CYS  11  -4.705  -8.452   2.529
   70    HA   CYS  11           HA       CYS  11  -5.516  -5.789   2.352
   71    HB2  CYS  11           1HB      CYS  11  -3.735  -6.869   0.994
   72    HB3  CYS  11           2HB      CYS  11  -4.970  -7.732   0.099
   73    HA   PRO  12           HA       PRO  12  -9.748  -6.448   1.483
   74    HB2  PRO  12           1HB      PRO  12 -10.447  -3.913   0.739
   75    HB3  PRO  12           2HB      PRO  12 -10.327  -4.423   2.412
   76    HG2  PRO  12           1HG      PRO  12  -8.463  -2.744   0.848
   77    HG3  PRO  12           2HG      PRO  12  -8.592  -2.912   2.587
   78    HD2  PRO  12           1HD      PRO  12  -6.600  -4.090   0.892
   79    HD3  PRO  12           2HD      PRO  12  -6.799  -4.352   2.613
   80    H    TYR  13           H        TYR  13  -7.404  -6.024  -0.750
   81    HA   TYR  13           HA       TYR  13  -9.375  -6.309  -2.919
   82    HB2  TYR  13           1HB      TYR  13  -6.499  -5.206  -2.788
   83    HB3  TYR  13           2HB      TYR  13  -7.402  -5.360  -4.282
   84    HD1  TYR  13           2HD      TYR  13  -9.579  -4.016  -4.524
   85    HD2  TYR  13           1HD      TYR  13  -6.711  -3.279  -1.436
   86    HE1  TYR  13           2HE      TYR  13 -10.549  -1.694  -4.168
   87    HE2  TYR  13           1HE      TYR  13  -7.691  -0.959  -1.090
   88    HH   TYR  13           HH       TYR  13  -9.023   0.574  -1.936
   89    H    LYS  14           H        LYS  14  -9.283  -8.144  -4.150
   90    HA   LYS  14           HA       LYS  14  -6.894  -9.816  -3.802
   91    HB2  LYS  14           1HB      LYS  14  -8.619 -11.746  -4.120
   92    HB3  LYS  14           2HB      LYS  14  -8.400 -11.017  -2.541
   93    HG2  LYS  14           1HG      LYS  14 -10.777 -11.138  -2.890
   94    HG3  LYS  14           2HG      LYS  14 -10.347  -9.451  -3.087
   95    HD2  LYS  14           1HD      LYS  14 -10.174 -11.010  -5.606
   96    HD3  LYS  14           2HD      LYS  14 -11.787 -10.970  -4.923
   97    HE2  LYS  14           1HE      LYS  14 -11.238  -8.355  -4.636
   98    HE3  LYS  14           2HE      LYS  14 -10.090  -8.679  -5.919
   99    HZ1  LYS  14           3HZ      LYS  14 -12.925  -8.578  -6.036
  100    HZ2  LYS  14           1HZ      LYS  14 -11.831  -8.434  -7.240
  101    HZ3  LYS  14           2HZ      LYS  14 -12.325  -9.914  -6.759
  102    H    ASN  15           H        ASN  15  -7.353  -7.773  -5.815
  103    HA   ASN  15           HA       ASN  15  -7.963  -9.421  -8.128
  104    HB2  ASN  15           1HB      ASN  15  -8.817  -6.870  -7.491
  105    HB3  ASN  15           2HB      ASN  15  -7.413  -6.495  -8.471
  106   HD21  ASN  15          1HD2      ASN  15  -9.094  -5.561  -9.850
  107   HD22  ASN  15          2HD2      ASN  15  -9.874  -6.553 -11.036
  108    H    ASP  16           H        ASP  16  -5.663  -6.860  -6.921
  109    HA   ASP  16           HA       ASP  16  -3.453  -8.328  -7.888
  110    HB2  ASP  16           1HB      ASP  16  -4.669  -6.439  -9.675
  111    HB3  ASP  16           2HB      ASP  16  -3.183  -5.703  -9.108
  112    H    SER  17           H        SER  17  -1.377  -7.188  -7.224
  113    HA   SER  17           HA       SER  17  -1.755  -5.857  -4.787
  114    HB2  SER  17           1HB      SER  17   0.752  -5.662  -4.818
  115    HB3  SER  17           2HB      SER  17   0.175  -7.293  -5.099
  116    HG   SER  17           HG       SER  17   1.922  -6.239  -6.581
  117    H    GLN  18           H        GLN  18  -1.141  -4.852  -8.148
  118    HA   GLN  18           HA       GLN  18  -0.254  -2.277  -7.562
  119    HB2  GLN  18           1HB      GLN  18  -1.606  -3.444 -10.031
  120    HB3  GLN  18           2HB      GLN  18  -0.942  -1.823  -9.977
  121    HG2  GLN  18           1HG      GLN  18   1.298  -2.622  -9.663
  122    HG3  GLN  18           2HG      GLN  18   0.755  -4.224  -9.202
  123   HE21  GLN  18          1HE2      GLN  18   1.591  -2.098 -11.747
  124   HE22  GLN  18          2HE2      GLN  18   1.361  -3.166 -13.091
  125    H    LEU  19           H        LEU  19  -3.415  -3.794  -7.506
  126    HA   LEU  19           HA       LEU  19  -4.929  -1.430  -7.900
  127    HB2  LEU  19           1HB      LEU  19  -5.768  -3.689  -8.338
  128    HB3  LEU  19           2HB      LEU  19  -5.654  -4.076  -6.633
  129    HG   LEU  19           HG       LEU  19  -7.310  -2.220  -6.186
  130   HD11  LEU  19          1HD1      LEU  19  -6.915  -1.022  -8.340
  131   HD12  LEU  19          2HD1      LEU  19  -7.786  -2.331  -9.175
  132   HD13  LEU  19          3HD1      LEU  19  -8.631  -1.324  -7.974
  133   HD21  LEU  19          3HD2      LEU  19  -8.245  -4.313  -5.985
  134   HD22  LEU  19          1HD2      LEU  19  -9.253  -3.603  -7.270
  135   HD23  LEU  19          2HD2      LEU  19  -7.945  -4.735  -7.688
  136    H    ALA  20           H        ALA  20  -4.424  -3.439  -4.908
  137    HA   ALA  20           HA       ALA  20  -5.408  -1.542  -3.159
  138    HB1  ALA  20           3HB      ALA  20  -4.732  -3.028  -1.535
  139    HB2  ALA  20           1HB      ALA  20  -4.613  -4.096  -2.954
  140    HB3  ALA  20           2HB      ALA  20  -3.151  -3.316  -2.302
  141    H    TRP  21           H        TRP  21  -2.209  -1.886  -4.705
  142    HA   TRP  21           HA       TRP  21  -0.944   0.019  -3.003
  143    HB2  TRP  21           1HB      TRP  21   0.487  -1.551  -3.946
  144    HB3  TRP  21           2HB      TRP  21  -0.222  -1.407  -5.541
  145    HD1  TRP  21           HD       TRP  21   0.416   0.995  -6.891
  146    HE1  TRP  21           1HE      TRP  21   2.607   2.466  -6.905
  147    HE3  TRP  21           3HE      TRP  21   2.315  -0.854  -2.552
  148    HZ2  TRP  21           2HZ      TRP  21   4.838   2.686  -5.140
  149    HZ3  TRP  21           3HZ      TRP  21   4.504   0.043  -1.767
  150    HH2  TRP  21           HH       TRP  21   5.757   1.752  -2.985
  151    H    ASP  22           H        ASP  22  -2.576  -0.010  -6.219
  152    HA   ASP  22           HA       ASP  22  -1.909   2.593  -6.894
  153    HB2  ASP  22           1HB      ASP  22  -2.750   1.217  -8.637
  154    HB3  ASP  22           2HB      ASP  22  -4.110   0.667  -7.679
  155    H    THR  23           H        THR  23  -3.913   1.321  -4.414
  156    HA   THR  23           HA       THR  23  -5.838   3.492  -4.434
  157    HB   THR  23           HB       THR  23  -5.464   0.825  -3.152
  158    HG1  THR  23           1HG      THR  23  -7.244   0.987  -4.492
  159   HG21  THR  23          3HG2      THR  23  -5.629   1.832  -1.018
  160   HG22  THR  23          1HG2      THR  23  -6.517   3.241  -1.648
  161   HG23  THR  23          2HG2      THR  23  -7.346   1.676  -1.464
  162    H    CYS  24           H        CYS  24  -3.400   2.219  -2.060
  163    HA   CYS  24           HA       CYS  24  -3.515   4.702  -0.650
  164    HB2  CYS  24           1HB      CYS  24  -3.022   3.233   0.943
  165    HB3  CYS  24           2HB      CYS  24  -2.462   2.032  -0.204
  166    H    SER  25           H        SER  25  -0.775   2.818  -2.151
  167    HA   SER  25           HA       SER  25   0.744   5.200  -2.390
  168    HB2  SER  25           1HB      SER  25   2.056   3.289  -3.918
  169    HB3  SER  25           2HB      SER  25   2.312   3.573  -2.208
  170    HG   SER  25           HG       SER  25   1.478   1.652  -1.795
  171    H    GLY  26           H        GLY  26  -1.481   5.888  -3.718
  172    HA2  GLY  26           1HA      GLY  26  -0.723   5.661  -6.566
  173    HA3  GLY  26           2HA      GLY  26  -2.383   5.480  -6.034
  174    H    GLY  27           H        GLY  27  -0.708   7.673  -3.991
  175    HA2  GLY  27           1HA      GLY  27  -0.355   9.964  -4.170
  176    HA3  GLY  27           2HA      GLY  27  -1.275  10.010  -5.661
  177    H    THR  28           H        THR  28  -3.531   8.354  -4.602
  178    HA   THR  28           HA       THR  28  -4.604  10.178  -2.564
  179    HB   THR  28           HB       THR  28  -6.689  10.346  -3.879
  180    HG1  THR  28           1HG      THR  28  -5.123   8.772  -5.797
  181   HG21  THR  28          3HG2      THR  28  -4.123  10.884  -5.440
  182   HG22  THR  28          1HG2      THR  28  -5.723  11.238  -6.135
  183   HG23  THR  28          2HG2      THR  28  -5.195  12.066  -4.651
  184    H    GLY  29           H        GLY  29  -7.248   8.804  -2.832
  185    HA2  GLY  29           1HA      GLY  29  -8.305   6.950  -2.088
  186    HA3  GLY  29           2HA      GLY  29  -6.827   6.032  -2.294
  187    H    ASN  30           H        ASN  30  -6.522   4.977  -0.358
  188    HA   ASN  30           HA       ASN  30  -6.815   6.598   2.037
  189    HB2  ASN  30           1HB      ASN  30  -6.804   4.331   3.214
  190    HB3  ASN  30           2HB      ASN  30  -8.156   4.566   2.124
  191   HD21  ASN  30          1HD2      ASN  30  -8.580   2.555   1.497
  192   HD22  ASN  30          2HD2      ASN  30  -7.493   1.497   0.661
  193    H    CYS  31           H        CYS  31  -4.502   7.066   0.477
  194    HA   CYS  31           HA       CYS  31  -2.361   5.382   0.997
  195    HB2  CYS  31           1HB      CYS  31  -1.076   6.929  -0.049
  196    HB3  CYS  31           2HB      CYS  31  -2.656   7.420  -0.627
  197    H    GLY  32           H        GLY  32  -0.890   5.259   2.735
  198    HA2  GLY  32           1HA      GLY  32  -0.511   7.201   4.697
  199    HA3  GLY  32           2HA      GLY  32  -1.776   6.132   5.271
  200    H    THR  33           H        THR  33   0.127   5.843   6.937
  201    HA   THR  33           HA       THR  33   2.198   4.047   5.988
  202    HB   THR  33           HB       THR  33   1.548   5.161   8.768
  203    HG1  THR  33           1HG      THR  33   3.193   6.715   8.046
  204   HG21  THR  33          3HG2      THR  33   4.069   3.927   7.540
  205   HG22  THR  33          1HG2      THR  33   4.034   4.796   9.093
  206   HG23  THR  33          2HG2      THR  33   3.134   3.272   8.906
  207    H    VAL  34           H        VAL  34  -1.042   3.730   6.834
  208    HA   VAL  34           HA       VAL  34  -0.731   1.272   8.304
  209    HB   VAL  34           HB       VAL  34  -3.114   2.761   7.193
  210   HG11  VAL  34          1HG1      VAL  34  -3.238   0.453   9.145
  211   HG12  VAL  34          2HG1      VAL  34  -4.566   1.224   8.244
  212   HG13  VAL  34          3HG1      VAL  34  -3.373   0.219   7.386
  213   HG21  VAL  34          3HG2      VAL  34  -2.162   2.412  10.056
  214   HG22  VAL  34          1HG2      VAL  34  -1.894   3.862   9.058
  215   HG23  VAL  34          2HG2      VAL  34  -3.550   3.379   9.500
  216    H    CYS  35           H        CYS  35  -1.347   2.387   4.968
  217    HA   CYS  35           HA       CYS  35  -2.234  -0.054   3.959
  218    HB2  CYS  35           1HB      CYS  35  -2.544   1.213   2.182
  219    HB3  CYS  35           2HB      CYS  35  -1.703   2.530   2.974
  220    H    CYS  36           H        CYS  36   0.853   1.067   5.120
  221    HA   CYS  36           HA       CYS  36   2.617  -0.300   3.520
  222    HB2  CYS  36           1HB      CYS  36   2.814   0.213   6.495
  223    HB3  CYS  36           2HB      CYS  36   4.144  -0.247   5.452
  224    H    GLY  37           H        GLY  37   1.832  -1.393   6.889
  225    HA2  GLY  37           1HA      GLY  37   2.221  -4.153   6.098
  226    HA3  GLY  37           2HA      GLY  37   1.948  -3.525   7.710
  227    H    GLN  38           H        GLN  38   0.047  -3.190   4.629
  228    HA   GLN  38           HA       GLN  38  -2.176  -4.385   6.094
  229    HB2  GLN  38           1HB      GLN  38  -2.028  -1.775   5.097
  230    HB3  GLN  38           2HB      GLN  38  -2.933  -2.619   3.856
  231    HG2  GLN  38           1HG      GLN  38  -4.586  -3.394   5.480
  232    HG3  GLN  38           2HG      GLN  38  -3.617  -2.821   6.823
  233   HE21  GLN  38          1HE2      GLN  38  -5.436  -1.619   7.498
  234   HE22  GLN  38          2HE2      GLN  38  -5.841  -0.094   6.784
  235    H    CYS  39           H        CYS  39  -1.052  -3.586   2.722
  236    HA   CYS  39           HA       CYS  39  -2.121  -6.194   1.926
  237    HB2  CYS  39           1HB      CYS  39  -1.643  -3.753   0.203
  238    HB3  CYS  39           2HB      CYS  39  -2.286  -5.290  -0.340
  239    H    PHE  40           H        PHE  40   0.679  -4.302   2.569
  240    HA   PHE  40           HA       PHE  40   2.312  -6.274   1.155
  241    HB2  PHE  40           1HB      PHE  40   3.161  -3.369   1.447
  242    HB3  PHE  40           2HB      PHE  40   3.634  -4.515   0.208
  243    HD1  PHE  40           2HD      PHE  40   2.097  -5.009  -1.672
  244    HD2  PHE  40           1HD      PHE  40   1.213  -2.003   1.190
  245    HE1  PHE  40           2HE      PHE  40   0.391  -4.028  -3.230
  246    HE2  PHE  40           1HE      PHE  40  -0.493  -1.022  -0.368
  247    HZ   PHE  40           HZ       PHE  40  -0.884  -2.047  -2.559
  248    H    SER  41           H        SER  41   4.751  -5.941   1.952
  249    HA   SER  41           HA       SER  41   4.760  -5.146   4.729
  250    HB2  SER  41           1HB      SER  41   5.181  -7.946   3.704
  251    HB3  SER  41           2HB      SER  41   6.185  -7.408   5.036
  252    HG   SER  41           HG       SER  41   3.986  -6.675   5.991
  253    H    PHE  42           H        PHE  42   7.048  -4.960   5.583
  254    HA   PHE  42           HA       PHE  42   8.661  -3.577   3.841
  255    HB2  PHE  42           1HB      PHE  42   8.570  -4.470   6.568
  256    HB3  PHE  42           2HB      PHE  42  10.115  -5.035   5.964
  257    HD1  PHE  42           1HD      PHE  42   8.029  -1.985   6.320
  258    HD2  PHE  42           2HD      PHE  42  11.931  -3.563   5.775
  259    HE1  PHE  42           1HE      PHE  42   9.004   0.301   6.675
  260    HE2  PHE  42           2HE      PHE  42  12.905  -1.278   6.130
  261    HZ   PHE  42           HZ       PHE  42  11.430   0.627   6.576
  262    HA   PRO  43           HA       PRO  43  10.761  -3.223   3.859
  263    HB2  PRO  43           1HB      PRO  43  12.395  -2.649   1.745
  264    HB3  PRO  43           2HB      PRO  43  12.983  -3.304   3.260
  265    HG2  PRO  43           1HG      PRO  43  12.624  -4.672   0.664
  266    HG3  PRO  43           2HG      PRO  43  13.584  -5.169   2.043
  267    HD2  PRO  43           1HD      PRO  43  11.033  -6.221   1.261
  268    HD3  PRO  43           2HD      PRO  43  11.940  -6.634   2.703
  269    H    VAL  44           H        VAL  44   8.753  -4.570   1.787
  270    HA   VAL  44           HA       VAL  44   8.331  -2.432  -0.023
  271    HB   VAL  44           HB       VAL  44   6.234  -4.431   0.738
  272   HG11  VAL  44          1HG1      VAL  44   5.542  -2.981  -0.987
  273   HG12  VAL  44          2HG1      VAL  44   7.124  -3.050  -1.801
  274   HG13  VAL  44          3HG1      VAL  44   6.049  -4.469  -1.822
  275   HG21  VAL  44          3HG2      VAL  44   7.698  -5.743  -1.197
  276   HG22  VAL  44          1HG2      VAL  44   8.964  -5.060  -0.150
  277   HG23  VAL  44          2HG2      VAL  44   7.710  -6.115   0.543
  278    H    SER  45           H        SER  45   7.083  -3.341   3.210
  279    HA   SER  45           HA       SER  45   4.903  -1.727   3.314
  280    HB2  SER  45           1HB      SER  45   5.032  -2.979   5.229
  281    HB3  SER  45           2HB      SER  45   6.784  -2.929   5.271
  282    HG   SER  45           HG       SER  45   6.615  -0.697   6.063
  283    H    GLN  46           H        GLN  46   8.239  -0.840   2.996
  284    HA   GLN  46           HA       GLN  46   7.837   1.754   4.173
  285    HB2  GLN  46           1HB      GLN  46   9.990   0.447   4.429
  286    HB3  GLN  46           2HB      GLN  46  10.276   0.650   2.712
  287    HG2  GLN  46           1HG      GLN  46  11.231   2.658   3.148
  288    HG3  GLN  46           2HG      GLN  46   9.668   3.255   3.668
  289   HE21  GLN  46          1HE2      GLN  46  12.802   2.259   4.582
  290   HE22  GLN  46          2HE2      GLN  46  12.680   2.476   6.296
  291    H    SER  47           H        SER  47   7.722   0.146   1.050
  292    HA   SER  47           HA       SER  47   8.164   2.489  -0.466
  293    HB2  SER  47           1HB      SER  47   8.409  -0.038  -1.138
  294    HB3  SER  47           2HB      SER  47   6.688   0.033  -1.462
  295    HG   SER  47           HG       SER  47   8.699   0.834  -3.062
  296    H    CYS  48           H        CYS  48   5.333   0.720   0.851
  297    HA   CYS  48           HA       CYS  48   3.331   1.911  -0.587
  298    HB2  CYS  48           1HB      CYS  48   2.527   0.230   0.698
  299    HB3  CYS  48           2HB      CYS  48   3.555   0.612   2.064
  300    H    ALA  49           H        ALA  49   4.424   2.860   2.762
  301    HA   ALA  49           HA       ALA  49   3.106   5.311   2.752
  302    HB1  ALA  49           3HB      ALA  49   5.189   3.917   4.357
  303    HB2  ALA  49           1HB      ALA  49   5.150   5.690   4.508
  304    HB3  ALA  49           2HB      ALA  49   3.696   4.733   4.880
  305    H    GLY  50           H        GLY  50   5.888   4.228   1.010
  306    HA2  GLY  50           1HA      GLY  50   7.207   6.786   0.851
  307    HA3  GLY  50           2HA      GLY  50   7.585   5.323  -0.037
  308    H    MET  51           H        MET  51   5.322   4.666  -1.434
  309    HA   MET  51           HA       MET  51   5.228   6.835  -3.304
  310    HB2  MET  51           1HB      MET  51   5.488   4.305  -3.841
  311    HB3  MET  51           2HB      MET  51   3.797   4.127  -3.417
  312    HG2  MET  51           1HG      MET  51   3.468   4.543  -5.658
  313    HG3  MET  51           2HG      MET  51   3.583   6.218  -5.158
  314    HE1  MET  51           3HE      MET  51   6.328   7.702  -5.780
  315    HE2  MET  51           1HE      MET  51   5.805   7.499  -7.469
  316    HE3  MET  51           2HE      MET  51   4.593   7.644  -6.174
  317    H    ALA  52           H        ALA  52   3.756   6.699  -0.517
  318    HA   ALA  52           HA       ALA  52   1.001   6.911  -1.411
  319    HB1  ALA  52           3HB      ALA  52   0.678   6.056   0.640
  320    HB2  ALA  52           1HB      ALA  52   2.406   6.240   1.027
  321    HB3  ALA  52           2HB      ALA  52   1.277   7.581   1.335
  322    H    ASP  53           H        ASP  53   2.906   8.820  -2.503
  323    HA   ASP  53           HA       ASP  53   3.139  10.947  -2.850
  324    HB2  ASP  53           1HB      ASP  53   0.364  10.629  -2.011
  325    HB3  ASP  53           2HB      ASP  53   0.953  12.197  -1.495
  326    H    SER  54           H        SER  54   3.434  13.197  -1.702
  327    HA   SER  54           HA       SER  54   4.388  12.640   0.976
  328    HB2  SER  54           1HB      SER  54   5.242  14.367  -1.250
  329    HB3  SER  54           2HB      SER  54   5.196  15.236   0.271
  330    HG   SER  54           HG       SER  54   6.743  13.916   1.142
  331    H    ASN  55           H        ASN  55   3.439  15.832  -0.394
  332    HA   ASN  55           HA       ASN  55   1.613  16.080   1.851
  333    HB2  ASN  55           1HB      ASN  55   3.626  17.777   0.988
  334    HB3  ASN  55           2HB      ASN  55   2.241  18.479   0.175
  335   HD21  ASN  55          1HD2      ASN  55   3.955  18.152   3.069
  336   HD22  ASN  55          2HD2      ASN  55   2.871  18.961   4.150
  337    H    ASP  56           H        ASP  56   1.736  15.395  -1.474
  338    HA   ASP  56           HA       ASP  56  -0.418  16.972  -2.361
  339    HB2  ASP  56           1HB      ASP  56   0.437  14.318  -3.572
  340    HB3  ASP  56           2HB      ASP  56  -0.255  15.700  -4.397
  341    H    CYS  57           H        CYS  57  -0.032  13.997  -0.546
  342    HA   CYS  57           HA       CYS  57  -2.512  12.829  -1.297
  343    HB2  CYS  57           1HB      CYS  57  -0.209  12.045   0.139
  344    HB3  CYS  57           2HB      CYS  57  -1.550  11.914   1.259
  345    HA   PRO  58           HA       PRO  58  -5.024  14.990   1.530
  346    HB2  PRO  58           1HB      PRO  58  -7.018  13.191   2.036
  347    HB3  PRO  58           2HB      PRO  58  -6.955  14.169   0.583
  348    HG2  PRO  58           1HG      PRO  58  -6.343  11.295   0.912
  349    HG3  PRO  58           2HG      PRO  58  -6.698  12.181  -0.558
  350    HD2  PRO  58           1HD      PRO  58  -4.117  11.307   0.338
  351    HD3  PRO  58           2HD      PRO  58  -4.460  12.291  -1.071
  352    H    ASN  59           H        ASN  59  -2.826  14.462   2.841
  353    HA   ASN  59           HA       ASN  59  -3.602  12.911   5.140
  354    HB2  ASN  59           1HB      ASN  59  -1.017  14.134   4.120
  355    HB3  ASN  59           2HB      ASN  59  -1.133  13.702   5.814
  356   HD21  ASN  59          1HD2      ASN  59   0.675  12.303   5.020
  357   HD22  ASN  59          2HD2      ASN  59   0.290  10.708   4.467
  358    H    ALA  60           H        ALA  60  -2.991  13.948   7.382
  359    HA   ALA  60           HA       ALA  60  -3.677  15.489   8.856
  360    HB1  ALA  60           3HB      ALA  60  -1.310  16.060   8.298
  361    HB2  ALA  60           1HB      ALA  60  -1.904  17.233   7.099
  362    HB3  ALA  60           2HB      ALA  60  -2.254  17.472   8.827
  Start of MODEL    5
    1    H1   ASP   1           H        ASP   1  10.551  -6.692  -7.200
    2    HA   ASP   1           HA       ASP   1   7.959  -6.430  -7.922
    3    HB2  ASP   1           1HB      ASP   1   9.065  -8.850  -6.433
    4    HB3  ASP   1           2HB      ASP   1   7.784  -8.846  -7.628
    5    H    ILE   2           H        ILE   2   6.116  -5.891  -6.739
    6    HA   ILE   2           HA       ILE   2   6.297  -6.086  -3.832
    7    HB   ILE   2           HB       ILE   2   4.854  -4.340  -3.700
    8   HG12  ILE   2          1HG1      ILE   2   3.714  -5.102  -6.404
    9   HG13  ILE   2          2HG1      ILE   2   2.982  -5.411  -4.842
   10   HG21  ILE   2          1HG2      ILE   2   5.978  -3.841  -6.466
   11   HG22  ILE   2          2HG2      ILE   2   5.504  -2.632  -5.249
   12   HG23  ILE   2          3HG2      ILE   2   6.908  -3.685  -4.957
   13   HD11  ILE   2          3HD1      ILE   2   3.488  -2.674  -4.720
   14   HD12  ILE   2          1HD1      ILE   2   3.042  -2.920  -6.426
   15   HD13  ILE   2          2HD1      ILE   2   1.923  -3.416  -5.133
   16    H    GLU   3           H        GLU   3   4.609  -7.349  -6.691
   17    HA   GLU   3           HA       GLU   3   2.408  -8.407  -5.455
   18    HB2  GLU   3           1HB      GLU   3   2.787  -8.298  -7.922
   19    HB3  GLU   3           2HB      GLU   3   3.988  -9.568  -7.793
   20    HG2  GLU   3           1HG      GLU   3   2.412 -11.226  -7.522
   21    HG3  GLU   3           2HG      GLU   3   1.370 -10.224  -6.531
   22    H    ASP   4           H        ASP   4   5.793  -9.443  -5.418
   23    HA   ASP   4           HA       ASP   4   5.254 -12.074  -4.586
   24    HB2  ASP   4           1HB      ASP   4   7.545 -10.430  -5.208
   25    HB3  ASP   4           2HB      ASP   4   7.825 -11.156  -3.637
   26    H    PHE   5           H        PHE   5   4.786  -9.070  -3.111
   27    HA   PHE   5           HA       PHE   5   5.099 -10.252  -0.443
   28    HB2  PHE   5           1HB      PHE   5   5.852  -7.571  -1.666
   29    HB3  PHE   5           2HB      PHE   5   5.328  -7.568   0.007
   30    HD1  PHE   5           1HD      PHE   5   7.919  -8.744  -2.318
   31    HD2  PHE   5           2HD      PHE   5   6.720  -8.477   1.744
   32    HE1  PHE   5           1HE      PHE   5  10.234  -9.385  -1.592
   33    HE2  PHE   5           2HE      PHE   5   9.035  -9.118   2.470
   34    HZ   PHE   5           HZ       PHE   5  10.765  -9.564   0.794
   35    H    TYR   6           H        TYR   6   2.820  -9.846  -2.570
   36    HA   TYR   6           HA       TYR   6   1.066  -7.984  -1.277
   37    HB2  TYR   6           1HB      TYR   6   1.237  -8.708  -3.779
   38    HB3  TYR   6           2HB      TYR   6   0.564 -10.253  -3.299
   39    HD1  TYR   6           2HD      TYR   6  -0.505  -6.981  -1.903
   40    HD2  TYR   6           1HD      TYR   6  -1.440 -10.171  -4.596
   41    HE1  TYR   6           2HE      TYR   6  -2.854  -6.054  -2.196
   42    HE2  TYR   6           1HE      TYR   6  -3.786  -9.233  -4.880
   43    HH   TYR   6           HH       TYR   6  -4.618  -6.198  -4.107
   44    H    THR   7           H        THR   7  -0.490  -8.372   0.251
   45    HA   THR   7           HA       THR   7  -0.942 -11.197   0.959
   46    HB   THR   7           HB       THR   7  -0.790 -10.595   3.271
   47    HG1  THR   7           1HG      THR   7  -1.115  -7.949   2.069
   48   HG21  THR   7          3HG2      THR   7   1.135  -8.558   2.066
   49   HG22  THR   7          1HG2      THR   7   1.331  -9.502   3.562
   50   HG23  THR   7          2HG2      THR   7   1.463 -10.306   1.979
   51    H    SER   8           H        SER   8  -2.790 -11.399  -0.339
   52    HA   SER   8           HA       SER   8  -4.817  -9.480  -0.280
   53    HB2  SER   8           1HB      SER   8  -5.110 -10.778  -2.142
   54    HB3  SER   8           2HB      SER   8  -4.396 -12.194  -1.396
   55    HG   SER   8           HG       SER   8  -6.526 -12.755  -1.602
   56    H    GLU   9           H        GLU   9  -3.718 -11.617   2.107
   57    HA   GLU   9           HA       GLU   9  -6.169 -12.494   3.143
   58    HB2  GLU   9           1HB      GLU   9  -3.486 -13.026   3.620
   59    HB3  GLU   9           2HB      GLU   9  -3.947 -12.166   5.076
   60    HG2  GLU   9           1HG      GLU   9  -6.083 -13.798   4.948
   61    HG3  GLU   9           2HG      GLU   9  -4.984 -14.792   4.012
   62    H    THR  10           H        THR  10  -3.986  -9.706   3.878
   63    HA   THR  10           HA       THR  10  -6.032  -8.665   5.703
   64    HB   THR  10           HB       THR  10  -3.856  -8.744   6.723
   65    HG1  THR  10           1HG      THR  10  -4.575  -6.648   7.107
   66   HG21  THR  10          3HG2      THR  10  -2.934  -7.943   3.972
   67   HG22  THR  10          1HG2      THR  10  -2.043  -7.251   5.349
   68   HG23  THR  10          2HG2      THR  10  -2.151  -9.017   5.155
   69    H    CYS  11           H        CYS  11  -4.531  -8.184   2.546
   70    HA   CYS  11           HA       CYS  11  -5.233  -5.502   2.232
   71    HB2  CYS  11           1HB      CYS  11  -3.638  -6.932   0.841
   72    HB3  CYS  11           2HB      CYS  11  -5.058  -7.529   0.005
   73    HA   PRO  12           HA       PRO  12  -9.541  -6.004   1.708
   74    HB2  PRO  12           1HB      PRO  12 -10.176  -3.507   0.797
   75    HB3  PRO  12           2HB      PRO  12  -9.956  -3.880   2.495
   76    HG2  PRO  12           1HG      PRO  12  -8.137  -2.438   0.664
   77    HG3  PRO  12           2HG      PRO  12  -8.145  -2.453   2.416
   78    HD2  PRO  12           1HD      PRO  12  -6.341  -3.872   0.695
   79    HD3  PRO  12           2HD      PRO  12  -6.424  -3.977   2.443
   80    H    TYR  13           H        TYR  13  -7.352  -5.695  -0.759
   81    HA   TYR  13           HA       TYR  13  -9.488  -6.300  -2.693
   82    HB2  TYR  13           1HB      TYR  13  -6.734  -4.980  -3.102
   83    HB3  TYR  13           2HB      TYR  13  -7.983  -5.128  -4.322
   84    HD1  TYR  13           2HD      TYR  13 -10.005  -3.704  -4.235
   85    HD2  TYR  13           1HD      TYR  13  -6.831  -3.249  -1.404
   86    HE1  TYR  13           2HE      TYR  13 -10.918  -1.427  -3.568
   87    HE2  TYR  13           1HE      TYR  13  -7.754  -0.974  -0.745
   88    HH   TYR  13           HH       TYR  13 -10.784   0.001  -1.409
   89    H    LYS  14           H        LYS  14  -9.188  -8.075  -4.038
   90    HA   LYS  14           HA       LYS  14  -6.633  -9.482  -3.730
   91    HB2  LYS  14           1HB      LYS  14  -8.126 -11.606  -3.882
   92    HB3  LYS  14           2HB      LYS  14  -7.932 -10.790  -2.344
   93    HG2  LYS  14           1HG      LYS  14 -10.291 -11.221  -2.589
   94    HG3  LYS  14           2HG      LYS  14 -10.076  -9.500  -2.842
   95    HD2  LYS  14           1HD      LYS  14  -9.829 -11.126  -5.322
   96    HD3  LYS  14           2HD      LYS  14 -11.412 -11.204  -4.574
   97    HE2  LYS  14           1HE      LYS  14 -11.049  -8.528  -4.403
   98    HE3  LYS  14           2HE      LYS  14  -9.986  -8.832  -5.763
   99    HZ1  LYS  14           3HZ      LYS  14 -11.746  -9.734  -6.978
  100    HZ2  LYS  14           1HZ      LYS  14 -12.729  -9.860  -5.680
  101    HZ3  LYS  14           2HZ      LYS  14 -12.367  -8.389  -6.291
  102    H    ASN  15           H        ASN  15  -7.429  -7.576  -5.770
  103    HA   ASN  15           HA       ASN  15  -8.073  -9.313  -7.993
  104    HB2  ASN  15           1HB      ASN  15  -9.001  -6.823  -7.426
  105    HB3  ASN  15           2HB      ASN  15  -7.577  -6.352  -8.332
  106   HD21  ASN  15          1HD2      ASN  15  -8.642  -5.552 -10.072
  107   HD22  ASN  15          2HD2      ASN  15  -9.531  -6.510 -11.209
  108    H    ASP  16           H        ASP  16  -5.637  -6.907  -6.793
  109    HA   ASP  16           HA       ASP  16  -3.559  -8.332  -8.061
  110    HB2  ASP  16           1HB      ASP  16  -4.767  -6.548  -9.749
  111    HB3  ASP  16           2HB      ASP  16  -3.620  -5.475  -8.971
  112    H    SER  17           H        SER  17  -1.399  -7.347  -7.420
  113    HA   SER  17           HA       SER  17  -1.600  -6.213  -4.848
  114    HB2  SER  17           1HB      SER  17   0.976  -6.117  -5.111
  115    HB3  SER  17           2HB      SER  17   0.216  -7.696  -5.147
  116    HG   SER  17           HG       SER  17   1.786  -6.586  -7.027
  117    H    GLN  18           H        GLN  18  -0.940  -5.029  -8.152
  118    HA   GLN  18           HA       GLN  18   0.033  -2.524  -7.279
  119    HB2  GLN  18           1HB      GLN  18   0.584  -3.597  -9.492
  120    HB3  GLN  18           2HB      GLN  18  -1.068  -3.325 -10.009
  121    HG2  GLN  18           1HG      GLN  18  -0.768  -0.862  -9.668
  122    HG3  GLN  18           2HG      GLN  18   0.884  -1.135  -9.152
  123   HE21  GLN  18          1HE2      GLN  18   2.466  -1.381 -10.598
  124   HE22  GLN  18          2HE2      GLN  18   2.272  -1.388 -12.319
  125    H    LEU  19           H        LEU  19  -3.120  -3.971  -7.715
  126    HA   LEU  19           HA       LEU  19  -4.572  -1.622  -8.265
  127    HB2  LEU  19           1HB      LEU  19  -5.617  -3.617  -8.805
  128    HB3  LEU  19           2HB      LEU  19  -5.221  -4.372  -7.275
  129    HG   LEU  19           HG       LEU  19  -7.657  -3.749  -7.687
  130   HD11  LEU  19          1HD1      LEU  19  -8.072  -3.478  -5.415
  131   HD12  LEU  19          2HD1      LEU  19  -6.470  -4.252  -5.448
  132   HD13  LEU  19          3HD1      LEU  19  -6.606  -2.502  -5.157
  133   HD21  LEU  19          3HD2      LEU  19  -8.092  -1.304  -6.880
  134   HD22  LEU  19          1HD2      LEU  19  -6.442  -1.014  -7.482
  135   HD23  LEU  19          2HD2      LEU  19  -7.697  -1.626  -8.585
  136    H    ALA  20           H        ALA  20  -4.109  -3.486  -5.175
  137    HA   ALA  20           HA       ALA  20  -5.352  -1.568  -3.575
  138    HB1  ALA  20           3HB      ALA  20  -3.682  -2.807  -1.852
  139    HB2  ALA  20           1HB      ALA  20  -5.159  -3.575  -2.483
  140    HB3  ALA  20           2HB      ALA  20  -3.580  -3.945  -3.216
  141    H    TRP  21           H        TRP  21  -2.050  -1.871  -4.885
  142    HA   TRP  21           HA       TRP  21  -0.869   0.018  -3.152
  143    HB2  TRP  21           1HB      TRP  21   0.595  -1.454  -4.200
  144    HB3  TRP  21           2HB      TRP  21  -0.129  -1.226  -5.779
  145    HD1  TRP  21           HD       TRP  21   0.519   1.166  -7.058
  146    HE1  TRP  21           1HE      TRP  21   2.641   2.732  -6.957
  147    HE3  TRP  21           3HE      TRP  21   2.301  -0.651  -2.656
  148    HZ2  TRP  21           2HZ      TRP  21   4.779   3.028  -5.089
  149    HZ3  TRP  21           3HZ      TRP  21   4.411   0.330  -1.763
  150    HH2  TRP  21           HH       TRP  21   5.640   2.108  -2.905
  151    H    ASP  22           H        ASP  22  -2.534   0.138  -6.347
  152    HA   ASP  22           HA       ASP  22  -1.946   2.803  -6.854
  153    HB2  ASP  22           1HB      ASP  22  -2.896   0.991  -8.436
  154    HB3  ASP  22           2HB      ASP  22  -4.462   1.315  -7.721
  155    H    THR  23           H        THR  23  -3.947   1.276  -4.503
  156    HA   THR  23           HA       THR  23  -5.933   3.384  -4.382
  157    HB   THR  23           HB       THR  23  -5.538   0.629  -3.399
  158    HG1  THR  23           1HG      THR  23  -7.433   0.963  -4.518
  159   HG21  THR  23          3HG2      THR  23  -6.462   2.826  -1.510
  160   HG22  THR  23          1HG2      THR  23  -7.225   1.219  -1.449
  161   HG23  THR  23          2HG2      THR  23  -5.480   1.387  -1.144
  162    H    CYS  24           H        CYS  24  -3.333   2.080  -2.212
  163    HA   CYS  24           HA       CYS  24  -3.585   4.443  -0.589
  164    HB2  CYS  24           1HB      CYS  24  -3.107   2.828   0.879
  165    HB3  CYS  24           2HB      CYS  24  -2.385   1.786  -0.331
  166    H    SER  25           H        SER  25  -0.719   2.735  -2.052
  167    HA   SER  25           HA       SER  25   0.642   5.224  -2.242
  168    HB2  SER  25           1HB      SER  25   2.176   3.389  -3.651
  169    HB3  SER  25           2HB      SER  25   2.315   3.723  -1.936
  170    HG   SER  25           HG       SER  25   0.586   1.706  -3.097
  171    H    GLY  26           H        GLY  26  -1.577   5.676  -3.703
  172    HA2  GLY  26           1HA      GLY  26  -0.698   5.357  -6.512
  173    HA3  GLY  26           2HA      GLY  26  -2.372   5.251  -6.006
  174    H    GLY  27           H        GLY  27  -0.761   7.514  -4.025
  175    HA2  GLY  27           1HA      GLY  27  -0.310   9.786  -4.358
  176    HA3  GLY  27           2HA      GLY  27  -1.224   9.764  -5.853
  177    H    THR  28           H        THR  28  -3.566   8.314  -4.847
  178    HA   THR  28           HA       THR  28  -4.572  10.140  -2.785
  179    HB   THR  28           HB       THR  28  -6.628  10.462  -4.191
  180    HG1  THR  28           1HG      THR  28  -4.891   9.059  -6.098
  181   HG21  THR  28          3HG2      THR  28  -3.982  11.102  -5.594
  182   HG22  THR  28          1HG2      THR  28  -5.562  11.724  -6.130
  183   HG23  THR  28          2HG2      THR  28  -4.915  12.190  -4.539
  184    H    GLY  29           H        GLY  29  -7.110   9.278  -2.480
  185    HA2  GLY  29           1HA      GLY  29  -8.438   7.436  -2.050
  186    HA3  GLY  29           2HA      GLY  29  -7.094   6.362  -2.382
  187    H    ASN  30           H        ASN  30  -6.757   5.170  -0.542
  188    HA   ASN  30           HA       ASN  30  -6.918   6.586   1.978
  189    HB2  ASN  30           1HB      ASN  30  -7.084   4.380   3.010
  190    HB3  ASN  30           2HB      ASN  30  -8.162   4.389   1.628
  191   HD21  ASN  30          1HD2      ASN  30  -7.489   2.018   2.519
  192   HD22  ASN  30          2HD2      ASN  30  -6.342   1.205   1.507
  193    H    CYS  31           H        CYS  31  -4.671   7.269   0.410
  194    HA   CYS  31           HA       CYS  31  -2.470   5.595   0.748
  195    HB2  CYS  31           1HB      CYS  31  -1.245   7.238  -0.235
  196    HB3  CYS  31           2HB      CYS  31  -2.853   7.680  -0.776
  197    H    GLY  32           H        GLY  32  -1.258   5.158   2.569
  198    HA2  GLY  32           1HA      GLY  32  -0.782   7.107   4.594
  199    HA3  GLY  32           2HA      GLY  32  -1.986   5.943   5.109
  200    H    THR  33           H        THR  33   0.135   5.804   6.658
  201    HA   THR  33           HA       THR  33   2.130   4.019   5.540
  202    HB   THR  33           HB       THR  33   1.731   5.251   8.318
  203    HG1  THR  33           1HG      THR  33   3.212   6.785   7.409
  204   HG21  THR  33          3HG2      THR  33   3.255   3.265   8.375
  205   HG22  THR  33          1HG2      THR  33   4.168   3.937   7.003
  206   HG23  THR  33          2HG2      THR  33   4.171   4.778   8.571
  207    H    VAL  34           H        VAL  34  -1.001   3.668   6.702
  208    HA   VAL  34           HA       VAL  34  -0.536   1.291   8.239
  209    HB   VAL  34           HB       VAL  34  -2.998   2.682   7.180
  210   HG11  VAL  34          1HG1      VAL  34  -4.380   1.136   8.358
  211   HG12  VAL  34          2HG1      VAL  34  -3.267   0.170   7.359
  212   HG13  VAL  34          3HG1      VAL  34  -2.973   0.342   9.107
  213   HG21  VAL  34          3HG2      VAL  34  -2.002   2.351  10.028
  214   HG22  VAL  34          1HG2      VAL  34  -1.696   3.784   9.017
  215   HG23  VAL  34          2HG2      VAL  34  -3.363   3.349   9.465
  216    H    CYS  35           H        CYS  35  -1.354   2.191   4.880
  217    HA   CYS  35           HA       CYS  35  -2.189  -0.332   4.050
  218    HB2  CYS  35           1HB      CYS  35  -2.575   0.751   2.166
  219    HB3  CYS  35           2HB      CYS  35  -1.904   2.188   2.912
  220    H    CYS  36           H        CYS  36   0.856   0.858   5.134
  221    HA   CYS  36           HA       CYS  36   2.657  -0.424   3.506
  222    HB2  CYS  36           1HB      CYS  36   2.842   0.045   6.489
  223    HB3  CYS  36           2HB      CYS  36   4.184  -0.367   5.441
  224    H    GLY  37           H        GLY  37   1.578  -1.582   6.790
  225    HA2  GLY  37           1HA      GLY  37   2.110  -4.336   5.932
  226    HA3  GLY  37           2HA      GLY  37   1.924  -3.755   7.575
  227    H    GLN  38           H        GLN  38  -0.158  -3.218   4.651
  228    HA   GLN  38           HA       GLN  38  -2.283  -4.546   6.147
  229    HB2  GLN  38           1HB      GLN  38  -2.470  -1.995   5.914
  230    HB3  GLN  38           2HB      GLN  38  -2.687  -2.245   4.194
  231    HG2  GLN  38           1HG      GLN  38  -4.884  -2.677   4.532
  232    HG3  GLN  38           2HG      GLN  38  -4.462  -4.073   5.505
  233   HE21  GLN  38          1HE2      GLN  38  -3.651  -3.498   7.770
  234   HE22  GLN  38          2HE2      GLN  38  -4.582  -2.340   8.661
  235    H    CYS  39           H        CYS  39  -0.711  -3.872   3.005
  236    HA   CYS  39           HA       CYS  39  -2.209  -6.144   1.920
  237    HB2  CYS  39           1HB      CYS  39  -1.394  -3.618   0.468
  238    HB3  CYS  39           2HB      CYS  39  -2.025  -5.055  -0.311
  239    H    PHE  40           H        PHE  40   0.781  -4.130   2.004
  240    HA   PHE  40           HA       PHE  40   2.236  -6.440   0.925
  241    HB2  PHE  40           1HB      PHE  40   3.324  -3.607   1.079
  242    HB3  PHE  40           2HB      PHE  40   3.667  -4.833  -0.125
  243    HD1  PHE  40           1HD      PHE  40   1.235  -2.292   0.947
  244    HD2  PHE  40           2HD      PHE  40   2.301  -5.065  -2.083
  245    HE1  PHE  40           1HE      PHE  40  -0.423  -1.229  -0.609
  246    HE2  PHE  40           2HE      PHE  40   0.643  -4.002  -3.639
  247    HZ   PHE  40           HZ       PHE  40  -0.699  -2.097  -2.883
  248    H    SER  41           H        SER  41   4.761  -6.101   1.644
  249    HA   SER  41           HA       SER  41   4.787  -5.353   4.440
  250    HB2  SER  41           1HB      SER  41   5.247  -8.106   3.326
  251    HB3  SER  41           2HB      SER  41   6.298  -7.587   4.629
  252    HG   SER  41           HG       SER  41   3.411  -7.427   4.763
  253    H    PHE  42           H        PHE  42   7.084  -5.139   5.277
  254    HA   PHE  42           HA       PHE  42   8.632  -3.646   3.563
  255    HB2  PHE  42           1HB      PHE  42   8.599  -4.628   6.261
  256    HB3  PHE  42           2HB      PHE  42  10.154  -5.124   5.623
  257    HD1  PHE  42           2HD      PHE  42   7.971  -2.126   5.959
  258    HD2  PHE  42           1HD      PHE  42  11.927  -3.618   5.603
  259    HE1  PHE  42           2HE      PHE  42   8.877   0.177   6.378
  260    HE2  PHE  42           1HE      PHE  42  12.834  -1.316   6.022
  261    HZ   PHE  42           HZ       PHE  42  11.298   0.555   6.404
  262    HA   PRO  43           HA       PRO  43  10.741  -3.243   3.609
  263    HB2  PRO  43           1HB      PRO  43  12.366  -2.548   1.525
  264    HB3  PRO  43           2HB      PRO  43  12.965  -3.254   3.013
  265    HG2  PRO  43           1HG      PRO  43  12.638  -4.519   0.361
  266    HG3  PRO  43           2HG      PRO  43  13.606  -5.053   1.720
  267    HD2  PRO  43           1HD      PRO  43  11.079  -6.123   0.889
  268    HD3  PRO  43           2HD      PRO  43  11.992  -6.578   2.314
  269    H    VAL  44           H        VAL  44   8.735  -4.533   1.521
  270    HA   VAL  44           HA       VAL  44   8.281  -2.346  -0.224
  271    HB   VAL  44           HB       VAL  44   6.222  -4.402   0.495
  272   HG11  VAL  44          1HG1      VAL  44   7.024  -2.870  -1.980
  273   HG12  VAL  44          2HG1      VAL  44   6.030  -4.343  -2.082
  274   HG13  VAL  44          3HG1      VAL  44   5.445  -2.936  -1.161
  275   HG21  VAL  44          3HG2      VAL  44   7.677  -5.605  -1.520
  276   HG22  VAL  44          1HG2      VAL  44   8.945  -4.947  -0.458
  277   HG23  VAL  44          2HG2      VAL  44   7.716  -6.053   0.202
  278    H    SER  45           H        SER  45   7.021  -3.395   2.968
  279    HA   SER  45           HA       SER  45   4.848  -1.774   3.126
  280    HB2  SER  45           1HB      SER  45   4.892  -3.035   5.019
  281    HB3  SER  45           2HB      SER  45   6.639  -3.165   5.001
  282    HG   SER  45           HG       SER  45   5.737  -1.979   6.868
  283    H    GLN  46           H        GLN  46   8.200  -0.901   2.905
  284    HA   GLN  46           HA       GLN  46   7.814   1.628   4.210
  285    HB2  GLN  46           1HB      GLN  46   9.988   0.036   4.027
  286    HB3  GLN  46           2HB      GLN  46  10.284   1.023   2.610
  287    HG2  GLN  46           1HG      GLN  46   9.743   3.046   4.256
  288    HG3  GLN  46           2HG      GLN  46  10.113   1.878   5.510
  289   HE21  GLN  46          1HE2      GLN  46  11.680   3.960   5.467
  290   HE22  GLN  46          2HE2      GLN  46  13.248   3.637   4.806
  291    H    SER  47           H        SER  47   7.652   0.206   1.005
  292    HA   SER  47           HA       SER  47   8.115   2.624  -0.382
  293    HB2  SER  47           1HB      SER  47   7.435   1.365  -2.367
  294    HB3  SER  47           2HB      SER  47   8.497   0.376  -1.385
  295    HG   SER  47           HG       SER  47   6.501  -0.601  -0.455
  296    H    CYS  48           H        CYS  48   5.270   0.822   0.860
  297    HA   CYS  48           HA       CYS  48   3.268   2.106  -0.486
  298    HB2  CYS  48           1HB      CYS  48   2.565   0.315   0.766
  299    HB3  CYS  48           2HB      CYS  48   3.481   0.789   2.183
  300    H    ALA  49           H        ALA  49   4.445   2.900   2.875
  301    HA   ALA  49           HA       ALA  49   3.146   5.349   3.027
  302    HB1  ALA  49           3HB      ALA  49   3.849   4.854   5.114
  303    HB2  ALA  49           1HB      ALA  49   5.159   3.811   4.511
  304    HB3  ALA  49           2HB      ALA  49   5.408   5.569   4.636
  305    H    GLY  50           H        GLY  50   5.876   4.347   1.140
  306    HA2  GLY  50           1HA      GLY  50   7.149   6.930   1.011
  307    HA3  GLY  50           2HA      GLY  50   7.523   5.499   0.073
  308    H    MET  51           H        MET  51   5.308   4.828  -1.327
  309    HA   MET  51           HA       MET  51   5.067   7.078  -3.084
  310    HB2  MET  51           1HB      MET  51   5.482   4.706  -3.879
  311    HB3  MET  51           2HB      MET  51   3.920   4.234  -3.241
  312    HG2  MET  51           1HG      MET  51   2.917   4.910  -5.161
  313    HG3  MET  51           2HG      MET  51   3.485   6.547  -4.897
  314    HE1  MET  51           3HE      MET  51   3.211   5.725  -7.913
  315    HE2  MET  51           1HE      MET  51   3.793   7.236  -7.175
  316    HE3  MET  51           2HE      MET  51   4.756   6.434  -8.439
  317    H    ALA  52           H        ALA  52   3.659   6.768  -0.294
  318    HA   ALA  52           HA       ALA  52   0.877   6.829  -1.119
  319    HB1  ALA  52           3HB      ALA  52   1.379   5.584   0.881
  320    HB2  ALA  52           1HB      ALA  52   2.306   6.941   1.563
  321    HB3  ALA  52           2HB      ALA  52   0.540   7.072   1.383
  322    H    ASP  53           H        ASP  53   2.968   8.903  -1.949
  323    HA   ASP  53           HA       ASP  53   3.067  11.046  -2.250
  324    HB2  ASP  53           1HB      ASP  53   0.205  10.606  -1.595
  325    HB3  ASP  53           2HB      ASP  53   0.737  12.248  -1.296
  326    H    SER  54           H        SER  54   3.429  13.141  -1.059
  327    HA   SER  54           HA       SER  54   3.695  12.617   1.784
  328    HB2  SER  54           1HB      SER  54   5.304  14.016  -0.230
  329    HB3  SER  54           2HB      SER  54   5.013  15.036   1.165
  330    HG   SER  54           HG       SER  54   6.614  13.935   2.064
  331    H    ASN  55           H        ASN  55   3.547  15.793   0.083
  332    HA   ASN  55           HA       ASN  55   1.438  16.525   1.919
  333    HB2  ASN  55           1HB      ASN  55   3.716  17.867   1.122
  334    HB3  ASN  55           2HB      ASN  55   2.551  18.546   0.003
  335   HD21  ASN  55          1HD2      ASN  55   1.865  20.417   0.686
  336   HD22  ASN  55          2HD2      ASN  55   1.414  20.850   2.301
  337    H    ASP  56           H        ASP  56   1.876  15.316  -1.227
  338    HA   ASP  56           HA       ASP  56   0.032  16.928  -2.610
  339    HB2  ASP  56           1HB      ASP  56   1.926  15.204  -3.412
  340    HB3  ASP  56           2HB      ASP  56   0.598  14.061  -3.381
  341    H    CYS  57           H        CYS  57  -0.068  14.019  -0.559
  342    HA   CYS  57           HA       CYS  57  -2.645  13.178  -1.397
  343    HB2  CYS  57           1HB      CYS  57  -0.554  12.195   0.272
  344    HB3  CYS  57           2HB      CYS  57  -2.025  12.228   1.224
  345    HA   PRO  58           HA       PRO  58  -5.062  15.522   1.382
  346    HB2  PRO  58           1HB      PRO  58  -6.788  13.778   2.584
  347    HB3  PRO  58           2HB      PRO  58  -7.003  14.364   0.947
  348    HG2  PRO  58           1HG      PRO  58  -6.072  11.710   1.858
  349    HG3  PRO  58           2HG      PRO  58  -6.692  12.176   0.286
  350    HD2  PRO  58           1HD      PRO  58  -3.946  11.726   0.983
  351    HD3  PRO  58           2HD      PRO  58  -4.556  12.303  -0.555
  352    H    ASN  59           H        ASN  59  -2.760  13.583   2.581
  353    HA   ASN  59           HA       ASN  59  -3.430  13.861   5.321
  354    HB2  ASN  59           1HB      ASN  59  -0.661  13.266   4.175
  355    HB3  ASN  59           2HB      ASN  59  -1.292  12.779   5.736
  356   HD21  ASN  59          1HD2      ASN  59  -0.153  11.062   3.825
  357   HD22  ASN  59          2HD2      ASN  59  -1.345   9.928   3.286
  358    H    ALA  60           H        ALA  60  -2.194  15.223   6.876
  359    HA   ALA  60           HA       ALA  60  -0.256  17.072   5.956
  360    HB1  ALA  60           3HB      ALA  60  -2.662  17.888   5.145
  361    HB2  ALA  60           1HB      ALA  60  -2.774  18.457   6.828
  362    HB3  ALA  60           2HB      ALA  60  -1.460  19.038   5.778
  Start of MODEL    6
    1    H1   ASP   1           H        ASP   1  10.572  -7.703  -7.142
    2    HA   ASP   1           HA       ASP   1   8.560  -6.276  -7.463
    3    HB2  ASP   1           1HB      ASP   1   8.358  -9.270  -6.946
    4    HB3  ASP   1           2HB      ASP   1   6.989  -8.357  -7.547
    5    H    ILE   2           H        ILE   2   6.257  -6.040  -6.614
    6    HA   ILE   2           HA       ILE   2   6.289  -6.118  -3.699
    7    HB   ILE   2           HB       ILE   2   4.854  -4.349  -3.717
    8   HG12  ILE   2          1HG1      ILE   2   3.913  -5.134  -6.492
    9   HG13  ILE   2          2HG1      ILE   2   3.066  -5.454  -4.992
   10   HG21  ILE   2          1HG2      ILE   2   6.099  -3.886  -6.428
   11   HG22  ILE   2          2HG2      ILE   2   5.725  -2.701  -5.154
   12   HG23  ILE   2          3HG2      ILE   2   7.047  -3.871  -4.921
   13   HD11  ILE   2          3HD1      ILE   2   3.552  -2.724  -4.799
   14   HD12  ILE   2          1HD1      ILE   2   3.260  -2.945  -6.541
   15   HD13  ILE   2          2HD1      ILE   2   2.031  -3.458  -5.361
   16    H    GLU   3           H        GLU   3   4.512  -7.299  -6.584
   17    HA   GLU   3           HA       GLU   3   2.327  -8.326  -5.320
   18    HB2  GLU   3           1HB      GLU   3   2.708  -8.192  -7.802
   19    HB3  GLU   3           2HB      GLU   3   3.813  -9.548  -7.688
   20    HG2  GLU   3           1HG      GLU   3   1.179 -10.036  -6.397
   21    HG3  GLU   3           2HG      GLU   3   1.079  -9.752  -8.124
   22    H    ASP   4           H        ASP   4   5.674  -9.506  -5.412
   23    HA   ASP   4           HA       ASP   4   5.045 -12.110  -4.561
   24    HB2  ASP   4           1HB      ASP   4   7.624 -10.484  -4.368
   25    HB3  ASP   4           2HB      ASP   4   7.521 -12.199  -4.018
   26    H    PHE   5           H        PHE   5   4.739  -9.111  -3.062
   27    HA   PHE   5           HA       PHE   5   5.123 -10.310  -0.412
   28    HB2  PHE   5           1HB      PHE   5   5.981  -7.686  -1.671
   29    HB3  PHE   5           2HB      PHE   5   5.474  -7.618   0.005
   30    HD1  PHE   5           1HD      PHE   5   6.764  -8.776   1.742
   31    HD2  PHE   5           2HD      PHE   5   8.043  -8.768  -2.304
   32    HE1  PHE   5           1HE      PHE   5   9.050  -9.524   2.463
   33    HE2  PHE   5           2HE      PHE   5  10.329  -9.516  -1.583
   34    HZ   PHE   5           HZ       PHE   5  10.804  -9.884   0.791
   35    H    TYR   6           H        TYR   6   2.807  -9.679  -2.504
   36    HA   TYR   6           HA       TYR   6   1.190  -7.803  -1.064
   37    HB2  TYR   6           1HB      TYR   6   1.291  -8.447  -3.615
   38    HB3  TYR   6           2HB      TYR   6   0.458  -9.923  -3.170
   39    HD1  TYR   6           1HD      TYR   6  -0.187  -6.561  -1.710
   40    HD2  TYR   6           2HD      TYR   6  -1.572  -9.615  -4.366
   41    HE1  TYR   6           1HE      TYR   6  -2.423  -5.369  -1.927
   42    HE2  TYR   6           2HE      TYR   6  -3.803  -8.413  -4.573
   43    HH   TYR   6           HH       TYR   6  -4.973  -6.688  -4.024
   44    H    THR   7           H        THR   7  -0.612  -8.207   0.248
   45    HA   THR   7           HA       THR   7  -1.050 -11.034   0.942
   46    HB   THR   7           HB       THR   7  -1.137 -10.373   3.297
   47    HG1  THR   7           1HG      THR   7  -0.548  -7.703   2.244
   48   HG21  THR   7          3HG2      THR   7   1.210 -10.614   2.425
   49   HG22  THR   7          1HG2      THR   7   1.194  -8.895   1.965
   50   HG23  THR   7          2HG2      THR   7   1.102  -9.358   3.681
   51    H    SER   8           H        SER   8  -2.835 -11.186  -0.462
   52    HA   SER   8           HA       SER   8  -4.855  -9.275  -0.470
   53    HB2  SER   8           1HB      SER   8  -4.238 -11.631  -1.872
   54    HB3  SER   8           2HB      SER   8  -5.757 -12.008  -1.084
   55    HG   SER   8           HG       SER   8  -6.456  -9.792  -1.968
   56    H    GLU   9           H        GLU   9  -3.892 -11.511   1.927
   57    HA   GLU   9           HA       GLU   9  -6.415 -12.271   2.880
   58    HB2  GLU   9           1HB      GLU   9  -3.786 -12.977   3.406
   59    HB3  GLU   9           2HB      GLU   9  -4.217 -12.110   4.867
   60    HG2  GLU   9           1HG      GLU   9  -6.300 -14.011   3.899
   61    HG3  GLU   9           2HG      GLU   9  -4.799 -14.769   4.393
   62    H    THR  10           H        THR  10  -4.069  -9.670   3.810
   63    HA   THR  10           HA       THR  10  -6.081  -8.558   5.616
   64    HB   THR  10           HB       THR  10  -3.897  -8.734   6.606
   65    HG1  THR  10           1HG      THR  10  -4.874  -6.598   6.802
   66   HG21  THR  10          3HG2      THR  10  -2.053  -7.273   5.231
   67   HG22  THR  10          1HG2      THR  10  -2.216  -9.033   5.018
   68   HG23  THR  10          2HG2      THR  10  -2.981  -7.921   3.858
   69    H    CYS  11           H        CYS  11  -4.565  -8.044   2.462
   70    HA   CYS  11           HA       CYS  11  -5.211  -5.340   2.217
   71    HB2  CYS  11           1HB      CYS  11  -3.645  -6.796   0.795
   72    HB3  CYS  11           2HB      CYS  11  -5.083  -7.290  -0.078
   73    HA   PRO  12           HA       PRO  12  -9.527  -5.751   1.668
   74    HB2  PRO  12           1HB      PRO  12 -10.113  -3.208   0.854
   75    HB3  PRO  12           2HB      PRO  12  -9.908  -3.653   2.537
   76    HG2  PRO  12           1HG      PRO  12  -8.056  -2.171   0.772
   77    HG3  PRO  12           2HG      PRO  12  -8.072  -2.256   2.522
   78    HD2  PRO  12           1HD      PRO  12  -6.285  -3.637   0.754
   79    HD3  PRO  12           2HD      PRO  12  -6.378  -3.809   2.495
   80    H    TYR  13           H        TYR  13  -7.336  -5.173  -0.814
   81    HA   TYR  13           HA       TYR  13  -9.471  -5.630  -2.785
   82    HB2  TYR  13           1HB      TYR  13  -6.601  -4.512  -2.933
   83    HB3  TYR  13           2HB      TYR  13  -7.647  -4.680  -4.328
   84    HD1  TYR  13           2HD      TYR  13  -9.695  -3.251  -4.534
   85    HD2  TYR  13           1HD      TYR  13  -6.824  -2.661  -1.418
   86    HE1  TYR  13           2HE      TYR  13 -10.629  -0.926  -4.104
   87    HE2  TYR  13           1HE      TYR  13  -7.767  -0.338  -0.998
   88    HH   TYR  13           HH       TYR  13 -10.580   0.822  -2.826
   89    H    LYS  14           H        LYS  14  -9.397  -7.424  -4.107
   90    HA   LYS  14           HA       LYS  14  -7.044  -9.150  -3.757
   91    HB2  LYS  14           1HB      LYS  14  -8.791 -11.020  -4.212
   92    HB3  LYS  14           2HB      LYS  14  -8.657 -10.334  -2.606
   93    HG2  LYS  14           1HG      LYS  14 -11.011 -10.402  -3.119
   94    HG3  LYS  14           2HG      LYS  14 -10.534  -8.718  -3.219
   95    HD2  LYS  14           1HD      LYS  14 -10.230 -10.193  -5.780
   96    HD3  LYS  14           2HD      LYS  14 -11.884 -10.125  -5.204
   97    HE2  LYS  14           1HE      LYS  14 -11.216  -7.532  -4.776
   98    HE3  LYS  14           2HE      LYS  14 -10.075  -7.877  -6.060
   99    HZ1  LYS  14           3HZ      LYS  14 -12.101  -8.862  -7.222
  100    HZ2  LYS  14           1HZ      LYS  14 -12.986  -8.005  -6.150
  101    HZ3  LYS  14           2HZ      LYS  14 -11.962  -7.236  -7.163
  102    H    ASN  15           H        ASN  15  -7.409  -7.009  -5.720
  103    HA   ASN  15           HA       ASN  15  -8.051  -8.479  -8.118
  104    HB2  ASN  15           1HB      ASN  15  -8.763  -6.011  -7.590
  105    HB3  ASN  15           2HB      ASN  15  -7.101  -5.583  -7.946
  106   HD21  ASN  15          1HD2      ASN  15  -7.922  -4.316  -9.667
  107   HD22  ASN  15          2HD2      ASN  15  -8.346  -5.018 -11.192
  108    H    ASP  16           H        ASP  16  -5.433  -6.244  -6.890
  109    HA   ASP  16           HA       ASP  16  -3.421  -8.056  -7.684
  110    HB2  ASP  16           1HB      ASP  16  -4.191  -6.772  -9.843
  111    HB3  ASP  16           2HB      ASP  16  -3.392  -5.383  -9.133
  112    H    SER  17           H        SER  17  -1.233  -7.176  -7.007
  113    HA   SER  17           HA       SER  17  -1.442  -5.711  -4.661
  114    HB2  SER  17           1HB      SER  17   1.095  -5.672  -4.793
  115    HB3  SER  17           2HB      SER  17   0.373  -7.265  -4.915
  116    HG   SER  17           HG       SER  17   0.507  -6.327  -7.430
  117    H    GLN  18           H        GLN  18  -0.754  -4.827  -8.052
  118    HA   GLN  18           HA       GLN  18   0.280  -2.295  -7.494
  119    HB2  GLN  18           1HB      GLN  18  -0.721  -3.768  -9.891
  120    HB3  GLN  18           2HB      GLN  18  -0.746  -2.020 -10.015
  121    HG2  GLN  18           1HG      GLN  18   1.591  -1.826  -9.803
  122    HG3  GLN  18           2HG      GLN  18   1.747  -3.338  -8.931
  123   HE21  GLN  18          1HE2      GLN  18   2.910  -2.125 -11.471
  124   HE22  GLN  18          2HE2      GLN  18   2.774  -3.368 -12.670
  125    H    LEU  19           H        LEU  19  -3.011  -3.611  -7.806
  126    HA   LEU  19           HA       LEU  19  -4.343  -1.179  -8.201
  127    HB2  LEU  19           1HB      LEU  19  -5.405  -3.246  -8.700
  128    HB3  LEU  19           2HB      LEU  19  -5.183  -3.842  -7.066
  129    HG   LEU  19           HG       LEU  19  -6.672  -1.720  -6.457
  130   HD11  LEU  19          1HD1      LEU  19  -7.775  -2.399  -9.186
  131   HD12  LEU  19          2HD1      LEU  19  -8.263  -1.093  -8.080
  132   HD13  LEU  19          3HD1      LEU  19  -6.686  -1.021  -8.901
  133   HD21  LEU  19          3HD2      LEU  19  -7.041  -4.363  -6.358
  134   HD22  LEU  19          1HD2      LEU  19  -8.334  -3.195  -5.994
  135   HD23  LEU  19          2HD2      LEU  19  -8.257  -3.967  -7.596
  136    H    ALA  20           H        ALA  20  -4.074  -3.147  -5.151
  137    HA   ALA  20           HA       ALA  20  -5.040  -1.154  -3.491
  138    HB1  ALA  20           3HB      ALA  20  -2.996  -2.898  -2.293
  139    HB2  ALA  20           1HB      ALA  20  -4.732  -2.755  -1.926
  140    HB3  ALA  20           2HB      ALA  20  -4.188  -3.787  -3.270
  141    H    TRP  21           H        TRP  21  -1.799  -1.730  -4.868
  142    HA   TRP  21           HA       TRP  21  -0.413   0.007  -3.138
  143    HB2  TRP  21           1HB      TRP  21   0.859  -1.576  -4.296
  144    HB3  TRP  21           2HB      TRP  21   0.141  -1.177  -5.844
  145    HD1  TRP  21           HD       TRP  21   1.147   1.015  -7.123
  146    HE1  TRP  21           1HE      TRP  21   3.375   2.416  -6.920
  147    HE3  TRP  21           3HE      TRP  21   2.481  -0.781  -2.556
  148    HZ2  TRP  21           2HZ      TRP  21   5.399   2.611  -4.918
  149    HZ3  TRP  21           3HZ      TRP  21   4.598   0.067  -1.548
  150    HH2  TRP  21           HH       TRP  21   6.037   1.704  -2.653
  151    H    ASP  22           H        ASP  22  -2.042   0.373  -6.349
  152    HA   ASP  22           HA       ASP  22  -1.281   3.013  -6.717
  153    HB2  ASP  22           1HB      ASP  22  -2.398   1.258  -8.335
  154    HB3  ASP  22           2HB      ASP  22  -3.916   1.858  -7.696
  155    H    THR  23           H        THR  23  -3.696   1.426  -4.706
  156    HA   THR  23           HA       THR  23  -5.479   3.636  -4.460
  157    HB   THR  23           HB       THR  23  -5.065   0.900  -3.292
  158    HG1  THR  23           1HG      THR  23  -7.451   1.097  -3.774
  159   HG21  THR  23          3HG2      THR  23  -5.387   2.474  -1.270
  160   HG22  THR  23          1HG2      THR  23  -6.946   2.933  -1.996
  161   HG23  THR  23          2HG2      THR  23  -6.659   1.249  -1.495
  162    H    CYS  24           H        CYS  24  -3.163   2.187  -2.065
  163    HA   CYS  24           HA       CYS  24  -3.280   4.628  -0.566
  164    HB2  CYS  24           1HB      CYS  24  -3.039   3.043   0.987
  165    HB3  CYS  24           2HB      CYS  24  -2.356   1.889  -0.140
  166    H    SER  25           H        SER  25  -0.656   2.635  -2.132
  167    HA   SER  25           HA       SER  25   1.134   4.824  -2.026
  168    HB2  SER  25           1HB      SER  25   2.249   3.006  -3.804
  169    HB3  SER  25           2HB      SER  25   2.489   3.007  -2.068
  170    HG   SER  25           HG       SER  25   1.289   1.235  -1.871
  171    H    GLY  26           H        GLY  26  -0.934   5.983  -3.255
  172    HA2  GLY  26           1HA      GLY  26  -0.092   6.134  -6.078
  173    HA3  GLY  26           2HA      GLY  26  -1.786   5.960  -5.662
  174    H    GLY  27           H        GLY  27  -2.821   7.892  -5.903
  175    HA2  GLY  27           1HA      GLY  27  -1.360  10.341  -5.154
  176    HA3  GLY  27           2HA      GLY  27  -2.707  10.233  -6.270
  177    H    THR  28           H        THR  28  -4.669   8.825  -4.999
  178    HA   THR  28           HA       THR  28  -5.022  10.206  -2.423
  179    HB   THR  28           HB       THR  28  -7.350  10.670  -3.104
  180    HG1  THR  28           1HG      THR  28  -8.099   9.656  -4.974
  181   HG21  THR  28          3HG2      THR  28  -5.061  11.636  -4.707
  182   HG22  THR  28          1HG2      THR  28  -6.583  11.633  -5.631
  183   HG23  THR  28          2HG2      THR  28  -6.471  12.540  -4.104
  184    H    GLY  29           H        GLY  29  -7.732   8.986  -2.199
  185    HA2  GLY  29           1HA      GLY  29  -8.697   6.935  -1.786
  186    HA3  GLY  29           2HA      GLY  29  -7.178   6.128  -2.120
  187    H    ASN  30           H        ASN  30  -6.390   5.099  -0.341
  188    HA   ASN  30           HA       ASN  30  -6.689   6.526   2.186
  189    HB2  ASN  30           1HB      ASN  30  -6.457   4.014   3.094
  190    HB3  ASN  30           2HB      ASN  30  -8.016   4.635   2.587
  191   HD21  ASN  30          1HD2      ASN  30  -8.827   4.128   0.516
  192   HD22  ASN  30          2HD2      ASN  30  -8.323   2.711  -0.343
  193    H    CYS  31           H        CYS  31  -4.476   7.274   0.924
  194    HA   CYS  31           HA       CYS  31  -2.346   5.398   1.085
  195    HB2  CYS  31           1HB      CYS  31  -0.984   7.065   0.197
  196    HB3  CYS  31           2HB      CYS  31  -2.549   7.317  -0.551
  197    H    GLY  32           H        GLY  32  -0.936   5.068   2.810
  198    HA2  GLY  32           1HA      GLY  32  -0.402   6.995   4.804
  199    HA3  GLY  32           2HA      GLY  32  -1.628   5.885   5.383
  200    H    THR  33           H        THR  33   0.501   5.677   6.886
  201    HA   THR  33           HA       THR  33   2.431   3.834   5.751
  202    HB   THR  33           HB       THR  33   2.103   5.045   8.548
  203    HG1  THR  33           1HG      THR  33   2.707   6.751   7.240
  204   HG21  THR  33          3HG2      THR  33   4.509   3.771   7.140
  205   HG22  THR  33          1HG2      THR  33   4.540   4.558   8.736
  206   HG23  THR  33          2HG2      THR  33   3.625   3.048   8.505
  207    H    VAL  34           H        VAL  34  -0.699   3.553   6.903
  208    HA   VAL  34           HA       VAL  34  -0.266   1.151   8.431
  209    HB   VAL  34           HB       VAL  34  -2.716   2.638   7.479
  210   HG11  VAL  34          1HG1      VAL  34  -2.684   0.284   9.389
  211   HG12  VAL  34          2HG1      VAL  34  -4.097   1.132   8.715
  212   HG13  VAL  34          3HG1      VAL  34  -3.066   0.139   7.656
  213   HG21  VAL  34          3HG2      VAL  34  -0.950   2.941   9.720
  214   HG22  VAL  34          1HG2      VAL  34  -2.398   3.886   9.298
  215   HG23  VAL  34          2HG2      VAL  34  -2.549   2.430  10.310
  216    H    CYS  35           H        CYS  35  -1.160   2.140   5.117
  217    HA   CYS  35           HA       CYS  35  -2.123  -0.334   4.276
  218    HB2  CYS  35           1HB      CYS  35  -2.524   0.794   2.421
  219    HB3  CYS  35           2HB      CYS  35  -1.778   2.191   3.170
  220    H    CYS  36           H        CYS  36   0.994   0.696   5.298
  221    HA   CYS  36           HA       CYS  36   2.704  -0.597   3.591
  222    HB2  CYS  36           1HB      CYS  36   2.968  -0.272   6.587
  223    HB3  CYS  36           2HB      CYS  36   4.271  -0.681   5.489
  224    H    GLY  37           H        GLY  37   1.949  -1.884   6.900
  225    HA2  GLY  37           1HA      GLY  37   2.272  -4.598   5.915
  226    HA3  GLY  37           2HA      GLY  37   2.092  -4.073   7.577
  227    H    GLN  38           H        GLN  38   0.002  -3.293   4.725
  228    HA   GLN  38           HA       GLN  38  -2.123  -4.743   6.101
  229    HB2  GLN  38           1HB      GLN  38  -2.227  -2.145   6.127
  230    HB3  GLN  38           2HB      GLN  38  -2.591  -2.257   4.417
  231    HG2  GLN  38           1HG      GLN  38  -4.744  -2.265   5.346
  232    HG3  GLN  38           2HG      GLN  38  -4.443  -3.982   5.162
  233   HE21  GLN  38          1HE2      GLN  38  -6.282  -2.884   6.949
  234   HE22  GLN  38          2HE2      GLN  38  -5.795  -3.223   8.576
  235    H    CYS  39           H        CYS  39  -0.731  -3.580   2.990
  236    HA   CYS  39           HA       CYS  39  -2.310  -5.658   1.657
  237    HB2  CYS  39           1HB      CYS  39  -1.399  -2.947   0.759
  238    HB3  CYS  39           2HB      CYS  39  -1.629  -4.216  -0.426
  239    H    PHE  40           H        PHE  40   0.861  -4.219   2.368
  240    HA   PHE  40           HA       PHE  40   2.097  -6.529   1.063
  241    HB2  PHE  40           1HB      PHE  40   3.427  -3.795   1.167
  242    HB3  PHE  40           2HB      PHE  40   3.678  -5.074  -0.004
  243    HD1  PHE  40           2HD      PHE  40   1.257  -2.476   1.061
  244    HD2  PHE  40           1HD      PHE  40   2.509  -5.082  -2.045
  245    HE1  PHE  40           2HE      PHE  40  -0.297  -1.320  -0.535
  246    HE2  PHE  40           1HE      PHE  40   0.955  -3.926  -3.641
  247    HZ   PHE  40           HZ       PHE  40  -0.429  -2.059  -2.867
  248    H    SER  41           H        SER  41   4.685  -6.298   1.755
  249    HA   SER  41           HA       SER  41   4.740  -5.594   4.563
  250    HB2  SER  41           1HB      SER  41   5.112  -8.345   3.402
  251    HB3  SER  41           2HB      SER  41   6.151  -7.884   4.736
  252    HG   SER  41           HG       SER  41   3.382  -7.321   5.037
  253    H    PHE  42           H        PHE  42   7.029  -5.444   5.401
  254    HA   PHE  42           HA       PHE  42   8.641  -4.013   3.695
  255    HB2  PHE  42           1HB      PHE  42   8.555  -4.989   6.394
  256    HB3  PHE  42           2HB      PHE  42  10.096  -5.539   5.767
  257    HD1  PHE  42           2HD      PHE  42   8.017  -2.473   6.116
  258    HD2  PHE  42           1HD      PHE  42  11.920  -4.091   5.726
  259    HE1  PHE  42           2HE      PHE  42   9.000  -0.203   6.539
  260    HE2  PHE  42           1HE      PHE  42  12.903  -1.820   6.149
  261    HZ   PHE  42           HZ       PHE  42  11.431   0.097   6.550
  262    HA   PRO  43           HA       PRO  43  10.758  -3.681   3.747
  263    HB2  PRO  43           1HB      PRO  43  12.413  -3.047   1.667
  264    HB3  PRO  43           2HB      PRO  43  12.982  -3.768   3.159
  265    HG2  PRO  43           1HG      PRO  43  12.623  -5.031   0.511
  266    HG3  PRO  43           2HG      PRO  43  13.569  -5.592   1.875
  267    HD2  PRO  43           1HD      PRO  43  11.009  -6.580   1.037
  268    HD3  PRO  43           2HD      PRO  43  11.901  -7.061   2.467
  269    H    VAL  44           H        VAL  44   8.724  -4.913   1.647
  270    HA   VAL  44           HA       VAL  44   8.348  -2.713  -0.102
  271    HB   VAL  44           HB       VAL  44   6.220  -4.703   0.603
  272   HG11  VAL  44          1HG1      VAL  44   6.000  -4.641  -1.949
  273   HG12  VAL  44          2HG1      VAL  44   5.541  -3.169  -1.059
  274   HG13  VAL  44          3HG1      VAL  44   7.109  -3.249  -1.897
  275   HG21  VAL  44          3HG2      VAL  44   7.659  -5.950  -1.401
  276   HG22  VAL  44          1HG2      VAL  44   8.933  -5.338  -0.319
  277   HG23  VAL  44          2HG2      VAL  44   7.658  -6.404   0.321
  278    H    SER  45           H        SER  45   7.050  -3.715   3.089
  279    HA   SER  45           HA       SER  45   4.919  -2.040   3.237
  280    HB2  SER  45           1HB      SER  45   4.931  -3.287   5.139
  281    HB3  SER  45           2HB      SER  45   6.674  -3.465   5.119
  282    HG   SER  45           HG       SER  45   5.674  -2.207   6.961
  283    H    GLN  46           H        GLN  46   8.292  -1.250   3.015
  284    HA   GLN  46           HA       GLN  46   7.971   1.293   4.306
  285    HB2  GLN  46           1HB      GLN  46  10.097  -0.302   4.212
  286    HB3  GLN  46           2HB      GLN  46  10.407   0.519   2.696
  287    HG2  GLN  46           1HG      GLN  46   9.797   2.650   4.370
  288    HG3  GLN  46           2HG      GLN  46  10.597   1.551   5.476
  289   HE21  GLN  46          1HE2      GLN  46  12.319   3.001   5.655
  290   HE22  GLN  46          2HE2      GLN  46  13.544   3.148   4.439
  291    H    SER  47           H        SER  47   7.745  -0.135   1.111
  292    HA   SER  47           HA       SER  47   8.265   2.265  -0.290
  293    HB2  SER  47           1HB      SER  47   6.612   0.120  -1.563
  294    HB3  SER  47           2HB      SER  47   7.993   0.989  -2.201
  295    HG   SER  47           HG       SER  47   9.389  -0.295  -0.849
  296    H    CYS  48           H        CYS  48   5.381   0.538   0.971
  297    HA   CYS  48           HA       CYS  48   3.407   1.877  -0.366
  298    HB2  CYS  48           1HB      CYS  48   2.678   0.091   0.888
  299    HB3  CYS  48           2HB      CYS  48   3.591   0.559   2.309
  300    H    ALA  49           H        ALA  49   4.629   2.628   2.990
  301    HA   ALA  49           HA       ALA  49   3.389   5.102   3.172
  302    HB1  ALA  49           3HB      ALA  49   5.740   5.220   4.711
  303    HB2  ALA  49           1HB      ALA  49   4.137   4.665   5.248
  304    HB3  ALA  49           2HB      ALA  49   5.327   3.491   4.636
  305    H    GLY  50           H        GLY  50   6.100   4.053   1.264
  306    HA2  GLY  50           1HA      GLY  50   7.400   6.618   1.110
  307    HA3  GLY  50           2HA      GLY  50   7.740   5.181   0.167
  308    H    MET  51           H        MET  51   5.530   4.541  -1.229
  309    HA   MET  51           HA       MET  51   5.270   6.821  -2.950
  310    HB2  MET  51           1HB      MET  51   5.659   4.278  -3.576
  311    HB3  MET  51           2HB      MET  51   3.938   4.095  -3.302
  312    HG2  MET  51           1HG      MET  51   4.288   4.527  -5.680
  313    HG3  MET  51           2HG      MET  51   3.502   5.929  -4.982
  314    HE1  MET  51           3HE      MET  51   7.578   5.524  -6.833
  315    HE2  MET  51           1HE      MET  51   6.368   4.273  -6.463
  316    HE3  MET  51           2HE      MET  51   6.034   5.490  -7.718
  317    H    ALA  52           H        ALA  52   3.914   6.653  -0.206
  318    HA   ALA  52           HA       ALA  52   1.114   6.472  -0.906
  319    HB1  ALA  52           3HB      ALA  52   2.679   6.098   1.413
  320    HB2  ALA  52           1HB      ALA  52   1.700   7.550   1.731
  321    HB3  ALA  52           2HB      ALA  52   0.905   6.020   1.287
  322    H    ASP  53           H        ASP  53   2.379   8.386  -2.502
  323    HA   ASP  53           HA       ASP  53   2.285  10.458  -3.133
  324    HB2  ASP  53           1HB      ASP  53  -0.203   9.976  -2.623
  325    HB3  ASP  53           2HB      ASP  53   0.024  10.859  -1.126
  326    H    SER  54           H        SER  54   2.303  12.915  -2.261
  327    HA   SER  54           HA       SER  54   3.882  12.845   0.179
  328    HB2  SER  54           1HB      SER  54   4.002  14.386  -2.347
  329    HB3  SER  54           2HB      SER  54   4.206  15.382  -0.920
  330    HG   SER  54           HG       SER  54   5.770  13.084  -1.712
  331    H    ASN  55           H        ASN  55   2.314  15.724  -1.279
  332    HA   ASN  55           HA       ASN  55   0.729  15.908   1.161
  333    HB2  ASN  55           1HB      ASN  55   2.590  17.728   0.147
  334    HB3  ASN  55           2HB      ASN  55   1.083  18.378  -0.469
  335   HD21  ASN  55          1HD2      ASN  55  -0.686  18.698   1.053
  336   HD22  ASN  55          2HD2      ASN  55  -0.344  19.174   2.683
  337    H    ASP  56           H        ASP  56   0.699  15.335  -2.203
  338    HA   ASP  56           HA       ASP  56  -1.609  16.789  -2.891
  339    HB2  ASP  56           1HB      ASP  56  -0.130  14.438  -4.138
  340    HB3  ASP  56           2HB      ASP  56  -1.595  15.074  -4.859
  341    H    CYS  57           H        CYS  57  -1.121  14.198  -0.806
  342    HA   CYS  57           HA       CYS  57  -3.386  12.623  -1.612
  343    HB2  CYS  57           1HB      CYS  57  -1.064  12.175  -0.096
  344    HB3  CYS  57           2HB      CYS  57  -2.389  12.049   1.043
  345    HA   PRO  58           HA       PRO  58  -6.205  14.722   0.961
  346    HB2  PRO  58           1HB      PRO  58  -8.016  12.767   1.565
  347    HB3  PRO  58           2HB      PRO  58  -8.006  13.625   0.037
  348    HG2  PRO  58           1HG      PRO  58  -7.109  10.869   0.620
  349    HG3  PRO  58           2HG      PRO  58  -7.505  11.591  -0.927
  350    HD2  PRO  58           1HD      PRO  58  -4.879  11.072   0.104
  351    HD3  PRO  58           2HD      PRO  58  -5.274  11.898  -1.390
  352    H    ASN  59           H        ASN  59  -4.009  14.536   2.366
  353    HA   ASN  59           HA       ASN  59  -4.668  13.083   4.756
  354    HB2  ASN  59           1HB      ASN  59  -2.240  14.738   3.904
  355    HB3  ASN  59           2HB      ASN  59  -2.374  14.022   5.498
  356   HD21  ASN  59          1HD2      ASN  59  -0.285  13.195   4.312
  357   HD22  ASN  59          2HD2      ASN  59  -0.415  11.620   3.603
  358    H    ALA  60           H        ALA  60  -4.378  14.316   6.932
  359    HA   ALA  60           HA       ALA  60  -5.236  15.863   8.284
  360    HB1  ALA  60           3HB      ALA  60  -4.041  17.885   8.245
  361    HB2  ALA  60           1HB      ALA  60  -2.974  16.774   7.353
  362    HB3  ALA  60           2HB      ALA  60  -3.992  17.935   6.467
  Start of MODEL    7
    1    H1   ASP   1           H        ASP   1  10.106  -5.211  -5.859
    2    HA   ASP   1           HA       ASP   1   8.340  -7.100  -7.207
    3    HB2  ASP   1           1HB      ASP   1   9.291  -8.671  -5.295
    4    HB3  ASP   1           2HB      ASP   1  10.213  -8.416  -6.763
    5    H    ILE   2           H        ILE   2   6.372  -6.109  -6.427
    6    HA   ILE   2           HA       ILE   2   6.153  -5.887  -3.512
    7    HB   ILE   2           HB       ILE   2   4.624  -4.203  -3.783
    8   HG12  ILE   2          1HG1      ILE   2   4.148  -5.022  -6.663
    9   HG13  ILE   2          2HG1      ILE   2   3.137  -5.497  -5.313
   10   HG21  ILE   2          1HG2      ILE   2   6.961  -3.688  -4.697
   11   HG22  ILE   2          2HG2      ILE   2   6.207  -3.743  -6.308
   12   HG23  ILE   2          3HG2      ILE   2   5.645  -2.560  -5.102
   13   HD11  ILE   2          3HD1      ILE   2   2.461  -3.235  -4.874
   14   HD12  ILE   2          1HD1      ILE   2   3.750  -2.575  -5.909
   15   HD13  ILE   2          2HD1      ILE   2   2.371  -3.429  -6.641
   16    H    GLU   3           H        GLU   3   4.635  -7.207  -6.499
   17    HA   GLU   3           HA       GLU   3   2.418  -8.296  -5.345
   18    HB2  GLU   3           1HB      GLU   3   2.889  -8.180  -7.796
   19    HB3  GLU   3           2HB      GLU   3   4.086  -9.448  -7.625
   20    HG2  GLU   3           1HG      GLU   3   2.504 -11.104  -7.469
   21    HG3  GLU   3           2HG      GLU   3   1.457 -10.148  -6.439
   22    H    ASP   4           H        ASP   4   5.799  -9.279  -5.124
   23    HA   ASP   4           HA       ASP   4   5.264 -11.932  -4.358
   24    HB2  ASP   4           1HB      ASP   4   7.697 -10.148  -3.875
   25    HB3  ASP   4           2HB      ASP   4   7.669 -11.875  -3.579
   26    H    PHE   5           H        PHE   5   4.772  -8.900  -2.870
   27    HA   PHE   5           HA       PHE   5   4.895 -10.127  -0.205
   28    HB2  PHE   5           1HB      PHE   5   5.725  -7.445  -1.362
   29    HB3  PHE   5           2HB      PHE   5   5.073  -7.432   0.264
   30    HD1  PHE   5           2HD      PHE   5   6.270  -8.546   2.093
   31    HD2  PHE   5           1HD      PHE   5   7.889  -8.409  -1.827
   32    HE1  PHE   5           2HE      PHE   5   8.521  -9.184   3.001
   33    HE2  PHE   5           1HE      PHE   5  10.141  -9.048  -0.919
   34    HZ   PHE   5           HZ       PHE   5  10.430  -9.427   1.484
   35    H    TYR   6           H        TYR   6   2.742  -9.699  -2.460
   36    HA   TYR   6           HA       TYR   6   0.908  -7.861  -1.253
   37    HB2  TYR   6           1HB      TYR   6   1.210  -8.552  -3.744
   38    HB3  TYR   6           2HB      TYR   6   0.551 -10.119  -3.319
   39    HD1  TYR   6           1HD      TYR   6  -0.768  -7.063  -1.750
   40    HD2  TYR   6           2HD      TYR   6  -1.285  -9.894  -4.916
   41    HE1  TYR   6           1HE      TYR   6  -3.120  -6.188  -2.159
   42    HE2  TYR   6           2HE      TYR   6  -3.635  -9.009  -5.314
   43    HH   TYR   6           HH       TYR   6  -4.731  -6.509  -4.776
   44    H    THR   7           H        THR   7  -0.274  -8.288   0.538
   45    HA   THR   7           HA       THR   7  -0.897 -11.109   1.091
   46    HB   THR   7           HB       THR   7  -0.821 -10.501   3.400
   47    HG1  THR   7           1HG      THR   7  -1.163  -7.853   2.199
   48   HG21  THR   7          3HG2      THR   7   1.247  -9.312   3.755
   49   HG22  THR   7          1HG2      THR   7   1.462 -10.153   2.201
   50   HG23  THR   7          2HG2      THR   7   1.076  -8.416   2.226
   51    H    SER   8           H        SER   8  -2.705 -11.384  -0.231
   52    HA   SER   8           HA       SER   8  -4.769  -9.498  -0.269
   53    HB2  SER   8           1HB      SER   8  -4.106 -11.897  -1.623
   54    HB3  SER   8           2HB      SER   8  -5.654 -12.221  -0.869
   55    HG   SER   8           HG       SER   8  -6.172  -9.923  -1.824
   56    H    GLU   9           H        GLU   9  -3.704 -11.600   2.171
   57    HA   GLU   9           HA       GLU   9  -6.176 -12.494   3.144
   58    HB2  GLU   9           1HB      GLU   9  -3.504 -13.008   3.693
   59    HB3  GLU   9           2HB      GLU   9  -4.005 -12.141   5.131
   60    HG2  GLU   9           1HG      GLU   9  -6.148 -13.889   4.682
   61    HG3  GLU   9           2HG      GLU   9  -4.759 -14.849   4.216
   62    H    THR  10           H        THR  10  -3.971  -9.766   4.081
   63    HA   THR  10           HA       THR  10  -6.061  -8.717   5.824
   64    HB   THR  10           HB       THR  10  -3.852  -8.756   6.798
   65    HG1  THR  10           1HG      THR  10  -5.131  -6.682   6.825
   66   HG21  THR  10          3HG2      THR  10  -2.163  -8.914   5.201
   67   HG22  THR  10          1HG2      THR  10  -3.026  -7.871   4.045
   68   HG23  THR  10          2HG2      THR  10  -2.144  -7.146   5.411
   69    H    CYS  11           H        CYS  11  -4.618  -8.220   2.644
   70    HA   CYS  11           HA       CYS  11  -5.381  -5.558   2.321
   71    HB2  CYS  11           1HB      CYS  11  -3.788  -6.975   0.910
   72    HB3  CYS  11           2HB      CYS  11  -5.215  -7.596   0.105
   73    HA   PRO  12           HA       PRO  12  -9.688  -6.144   1.887
   74    HB2  PRO  12           1HB      PRO  12 -10.387  -3.667   0.970
   75    HB3  PRO  12           2HB      PRO  12 -10.127  -4.023   2.666
   76    HG2  PRO  12           1HG      PRO  12  -8.372  -2.561   0.789
   77    HG3  PRO  12           2HG      PRO  12  -8.346  -2.563   2.541
   78    HD2  PRO  12           1HD      PRO  12  -6.549  -3.961   0.796
   79    HD3  PRO  12           2HD      PRO  12  -6.596  -4.054   2.545
   80    H    TYR  13           H        TYR  13  -7.681  -5.232  -0.746
   81    HA   TYR  13           HA       TYR  13  -9.792  -6.139  -2.579
   82    HB2  TYR  13           1HB      TYR  13  -7.161  -4.593  -3.015
   83    HB3  TYR  13           2HB      TYR  13  -8.399  -4.837  -4.231
   84    HD1  TYR  13           2HD      TYR  13 -10.766  -3.851  -3.702
   85    HD2  TYR  13           1HD      TYR  13  -7.179  -2.653  -1.703
   86    HE1  TYR  13           2HE      TYR  13 -11.876  -1.675  -2.999
   87    HE2  TYR  13           1HE      TYR  13  -8.301  -0.481  -1.006
   88    HH   TYR  13           HH       TYR  13 -11.640   0.223  -2.004
   89    H    LYS  14           H        LYS  14  -8.547  -6.988  -4.756
   90    HA   LYS  14           HA       LYS  14  -6.278  -8.628  -4.090
   91    HB2  LYS  14           1HB      LYS  14  -7.335 -10.756  -4.583
   92    HB3  LYS  14           2HB      LYS  14  -8.119  -9.991  -3.215
   93    HG2  LYS  14           1HG      LYS  14  -9.164  -9.744  -6.072
   94    HG3  LYS  14           2HG      LYS  14  -9.688 -11.006  -4.974
   95    HD2  LYS  14           1HD      LYS  14 -11.207  -9.577  -4.091
   96    HD3  LYS  14           2HD      LYS  14  -9.897  -8.577  -3.497
   97    HE2  LYS  14           1HE      LYS  14 -10.909  -6.999  -4.848
   98    HE3  LYS  14           2HE      LYS  14  -9.880  -7.728  -6.065
   99    HZ1  LYS  14           3HZ      LYS  14 -12.432  -8.996  -5.636
  100    HZ2  LYS  14           1HZ      LYS  14 -12.473  -7.521  -6.336
  101    HZ3  LYS  14           2HZ      LYS  14 -11.621  -8.730  -7.029
  102    H    ASN  15           H        ASN  15  -7.256 -10.392  -6.481
  103    HA   ASN  15           HA       ASN  15  -7.175 -10.390  -8.658
  104    HB2  ASN  15           1HB      ASN  15  -8.154  -7.737  -8.146
  105    HB3  ASN  15           2HB      ASN  15  -6.906  -7.570  -9.366
  106   HD21  ASN  15          1HD2      ASN  15  -8.292  -7.071 -11.004
  107   HD22  ASN  15          2HD2      ASN  15  -9.384  -8.199 -11.736
  108    H    ASP  16           H        ASP  16  -5.445  -7.290  -7.798
  109    HA   ASP  16           HA       ASP  16  -2.954  -8.601  -8.464
  110    HB2  ASP  16           1HB      ASP  16  -4.285  -6.603 -10.095
  111    HB3  ASP  16           2HB      ASP  16  -2.817  -5.901  -9.445
  112    H    SER  17           H        SER  17  -1.052  -7.314  -7.581
  113    HA   SER  17           HA       SER  17  -1.760  -6.178  -5.090
  114    HB2  SER  17           1HB      SER  17   0.235  -7.469  -5.102
  115    HB3  SER  17           2HB      SER  17   0.843  -6.695  -6.551
  116    HG   SER  17           HG       SER  17   1.021  -5.881  -3.869
  117    H    GLN  18           H        GLN  18  -0.840  -5.005  -8.320
  118    HA   GLN  18           HA       GLN  18  -0.106  -2.433  -7.541
  119    HB2  GLN  18           1HB      GLN  18   0.267  -3.678  -9.796
  120    HB3  GLN  18           2HB      GLN  18  -1.346  -3.142 -10.222
  121    HG2  GLN  18           1HG      GLN  18  -0.742  -0.852 -10.207
  122    HG3  GLN  18           2HG      GLN  18   0.643  -1.118  -9.167
  123   HE21  GLN  18          1HE2      GLN  18   2.570  -1.241 -10.045
  124   HE22  GLN  18          2HE2      GLN  18   2.940  -1.496 -11.718
  125    H    LEU  19           H        LEU  19  -3.163  -4.045  -7.623
  126    HA   LEU  19           HA       LEU  19  -4.779  -1.795  -8.224
  127    HB2  LEU  19           1HB      LEU  19  -5.634  -3.962  -8.628
  128    HB3  LEU  19           2HB      LEU  19  -5.293  -4.494  -6.993
  129    HG   LEU  19           HG       LEU  19  -7.028  -2.950  -6.133
  130   HD11  LEU  19          1HD1      LEU  19  -8.062  -2.505  -8.906
  131   HD12  LEU  19          2HD1      LEU  19  -8.313  -1.556  -7.421
  132   HD13  LEU  19          3HD1      LEU  19  -6.761  -1.460  -8.287
  133   HD21  LEU  19          3HD2      LEU  19  -8.830  -4.276  -7.858
  134   HD22  LEU  19          1HD2      LEU  19  -7.416  -5.342  -7.674
  135   HD23  LEU  19          2HD2      LEU  19  -8.291  -4.769  -6.234
  136    H    ALA  20           H        ALA  20  -4.267  -3.585  -5.097
  137    HA   ALA  20           HA       ALA  20  -5.426  -1.615  -3.521
  138    HB1  ALA  20           3HB      ALA  20  -3.665  -3.994  -3.149
  139    HB2  ALA  20           1HB      ALA  20  -3.702  -2.817  -1.814
  140    HB3  ALA  20           2HB      ALA  20  -5.211  -3.581  -2.368
  141    H    TRP  21           H        TRP  21  -2.170  -1.944  -4.922
  142    HA   TRP  21           HA       TRP  21  -0.963   0.009  -3.260
  143    HB2  TRP  21           1HB      TRP  21   0.501  -1.511  -4.229
  144    HB3  TRP  21           2HB      TRP  21  -0.232  -1.379  -5.815
  145    HD1  TRP  21           HD       TRP  21   0.352   1.003  -7.192
  146    HE1  TRP  21           1HE      TRP  21   2.489   2.551  -7.215
  147    HE3  TRP  21           3HE      TRP  21   2.284  -0.710  -2.812
  148    HZ2  TRP  21           2HZ      TRP  21   4.699   2.877  -5.438
  149    HZ3  TRP  21           3HZ      TRP  21   4.435   0.276  -2.027
  150    HH2  TRP  21           HH       TRP  21   5.635   2.009  -3.263
  151    H    ASP  22           H        ASP  22  -2.737  -0.033  -6.382
  152    HA   ASP  22           HA       ASP  22  -2.105   2.554  -7.134
  153    HB2  ASP  22           1HB      ASP  22  -3.956   0.434  -7.925
  154    HB3  ASP  22           2HB      ASP  22  -4.755   1.990  -8.022
  155    H    THR  23           H        THR  23  -3.978   1.313  -4.523
  156    HA   THR  23           HA       THR  23  -5.783   3.600  -4.416
  157    HB   THR  23           HB       THR  23  -5.562   0.860  -3.192
  158    HG1  THR  23           1HG      THR  23  -7.929   1.222  -3.646
  159   HG21  THR  23          3HG2      THR  23  -5.718   2.532  -1.223
  160   HG22  THR  23          1HG2      THR  23  -7.259   3.069  -1.934
  161   HG23  THR  23          2HG2      THR  23  -7.075   1.389  -1.374
  162    H    CYS  24           H        CYS  24  -3.566   1.968  -2.048
  163    HA   CYS  24           HA       CYS  24  -3.451   4.267  -0.444
  164    HB2  CYS  24           1HB      CYS  24  -2.892   2.550   0.868
  165    HB3  CYS  24           2HB      CYS  24  -2.291   1.582  -0.464
  166    H    SER  25           H        SER  25  -0.730   2.632  -2.231
  167    HA   SER  25           HA       SER  25   0.643   5.123  -2.360
  168    HB2  SER  25           1HB      SER  25   2.045   3.330  -3.975
  169    HB3  SER  25           2HB      SER  25   2.340   3.627  -2.274
  170    HG   SER  25           HG       SER  25   0.546   1.621  -3.354
  171    H    GLY  26           H        GLY  26  -1.667   5.653  -3.649
  172    HA2  GLY  26           1HA      GLY  26  -0.997   5.448  -6.525
  173    HA3  GLY  26           2HA      GLY  26  -2.630   5.393  -5.894
  174    H    GLY  27           H        GLY  27  -0.823   7.501  -3.934
  175    HA2  GLY  27           1HA      GLY  27  -0.281   9.765  -4.220
  176    HA3  GLY  27           2HA      GLY  27  -1.300   9.842  -5.644
  177    H    THR  28           H        THR  28  -3.605   8.408  -4.479
  178    HA   THR  28           HA       THR  28  -4.390  10.213  -2.307
  179    HB   THR  28           HB       THR  28  -6.562  10.589  -3.550
  180    HG1  THR  28           1HG      THR  28  -6.552   9.790  -5.755
  181   HG21  THR  28          3HG2      THR  28  -4.867  12.338  -3.892
  182   HG22  THR  28          1HG2      THR  28  -3.999  11.315  -5.063
  183   HG23  THR  28          2HG2      THR  28  -5.606  11.964  -5.467
  184    H    GLY  29           H        GLY  29  -7.079   9.335  -2.153
  185    HA2  GLY  29           1HA      GLY  29  -8.369   7.514  -1.634
  186    HA3  GLY  29           2HA      GLY  29  -7.026   6.440  -1.971
  187    H    ASN  30           H        ASN  30  -6.641   5.258  -0.139
  188    HA   ASN  30           HA       ASN  30  -6.774   6.691   2.380
  189    HB2  ASN  30           1HB      ASN  30  -6.962   4.483   3.430
  190    HB3  ASN  30           2HB      ASN  30  -8.094   4.545   2.094
  191   HD21  ASN  30          1HD2      ASN  30  -7.613   2.140   2.808
  192   HD22  ASN  30          2HD2      ASN  30  -6.497   1.289   1.792
  193    H    CYS  31           H        CYS  31  -4.524   7.213   0.681
  194    HA   CYS  31           HA       CYS  31  -2.376   5.509   1.024
  195    HB2  CYS  31           1HB      CYS  31  -1.120   7.113   0.020
  196    HB3  CYS  31           2HB      CYS  31  -2.722   7.627  -0.472
  197    H    GLY  32           H        GLY  32  -0.797   5.308   2.667
  198    HA2  GLY  32           1HA      GLY  32  -0.255   7.093   4.697
  199    HA3  GLY  32           2HA      GLY  32  -1.575   6.104   5.289
  200    H    THR  33           H        THR  33   0.519   5.737   6.809
  201    HA   THR  33           HA       THR  33   2.331   3.763   5.732
  202    HB   THR  33           HB       THR  33   1.957   4.856   8.570
  203    HG1  THR  33           1HG      THR  33   3.800   5.560   6.403
  204   HG21  THR  33          3HG2      THR  33   4.319   3.556   7.113
  205   HG22  THR  33          1HG2      THR  33   4.426   4.347   8.704
  206   HG23  THR  33          2HG2      THR  33   3.446   2.874   8.506
  207    H    VAL  34           H        VAL  34  -0.863   3.672   6.742
  208    HA   VAL  34           HA       VAL  34  -0.742   1.289   8.299
  209    HB   VAL  34           HB       VAL  34  -2.982   2.750   6.890
  210   HG11  VAL  34          1HG1      VAL  34  -4.561   1.358   8.000
  211   HG12  VAL  34          2HG1      VAL  34  -3.385   0.264   7.232
  212   HG13  VAL  34          3HG1      VAL  34  -3.296   0.580   8.982
  213   HG21  VAL  34          3HG2      VAL  34  -2.947   4.130   8.639
  214   HG22  VAL  34          1HG2      VAL  34  -3.200   2.754   9.740
  215   HG23  VAL  34          2HG2      VAL  34  -1.548   3.256   9.308
  216    H    CYS  35           H        CYS  35  -1.336   2.130   4.846
  217    HA   CYS  35           HA       CYS  35  -2.069  -0.435   4.049
  218    HB2  CYS  35           1HB      CYS  35  -2.471   0.670   2.184
  219    HB3  CYS  35           2HB      CYS  35  -1.687   2.089   2.848
  220    H    CYS  36           H        CYS  36   0.903   0.874   5.210
  221    HA   CYS  36           HA       CYS  36   2.793  -0.414   3.690
  222    HB2  CYS  36           1HB      CYS  36   4.290   0.242   5.252
  223    HB3  CYS  36           2HB      CYS  36   2.953   1.286   5.694
  224    H    GLY  37           H        GLY  37   1.113  -1.494   6.734
  225    HA2  GLY  37           1HA      GLY  37   1.902  -4.267   6.070
  226    HA3  GLY  37           2HA      GLY  37   1.666  -3.646   7.692
  227    H    GLN  38           H        GLN  38  -0.343  -3.098   4.727
  228    HA   GLN  38           HA       GLN  38  -2.507  -4.425   6.167
  229    HB2  GLN  38           1HB      GLN  38  -2.592  -1.830   5.814
  230    HB3  GLN  38           2HB      GLN  38  -2.953  -2.210   4.142
  231    HG2  GLN  38           1HG      GLN  38  -5.099  -2.047   5.119
  232    HG3  GLN  38           2HG      GLN  38  -4.816  -3.776   5.087
  233   HE21  GLN  38          1HE2      GLN  38  -6.336  -3.989   6.765
  234   HE22  GLN  38          2HE2      GLN  38  -5.933  -3.668   8.419
  235    H    CYS  39           H        CYS  39  -0.951  -3.690   3.010
  236    HA   CYS  39           HA       CYS  39  -2.385  -6.006   1.927
  237    HB2  CYS  39           1HB      CYS  39  -1.605  -3.444   0.526
  238    HB3  CYS  39           2HB      CYS  39  -2.110  -4.896  -0.315
  239    H    PHE  40           H        PHE  40   0.600  -4.024   2.172
  240    HA   PHE  40           HA       PHE  40   2.082  -6.313   1.079
  241    HB2  PHE  40           1HB      PHE  40   3.161  -3.478   1.244
  242    HB3  PHE  40           2HB      PHE  40   3.524  -4.706   0.048
  243    HD1  PHE  40           2HD      PHE  40   1.141  -2.107   1.045
  244    HD2  PHE  40           1HD      PHE  40   2.125  -4.997  -1.901
  245    HE1  PHE  40           2HE      PHE  40  -0.491  -1.046  -0.540
  246    HE2  PHE  40           1HE      PHE  40   0.493  -3.937  -3.486
  247    HZ   PHE  40           HZ       PHE  40  -0.796  -1.974  -2.787
  248    H    SER  41           H        SER  41   4.621  -5.832   1.834
  249    HA   SER  41           HA       SER  41   4.609  -5.066   4.607
  250    HB2  SER  41           1HB      SER  41   4.586  -7.170   5.421
  251    HB3  SER  41           2HB      SER  41   4.482  -7.823   3.798
  252    HG   SER  41           HG       SER  41   6.830  -7.294   5.376
  253    H    PHE  42           H        PHE  42   6.870  -4.816   5.457
  254    HA   PHE  42           HA       PHE  42   8.509  -3.514   3.683
  255    HB2  PHE  42           1HB      PHE  42   8.383  -4.297   6.442
  256    HB3  PHE  42           2HB      PHE  42   9.935  -4.886   5.880
  257    HD1  PHE  42           2HD      PHE  42   7.846  -1.807   5.971
  258    HD2  PHE  42           1HD      PHE  42  11.758  -3.440   5.772
  259    HE1  PHE  42           2HE      PHE  42   8.818   0.490   6.247
  260    HE2  PHE  42           1HE      PHE  42  12.730  -1.143   6.048
  261    HZ   PHE  42           HZ       PHE  42  11.249   0.795   6.282
  262    HA   PRO  43           HA       PRO  43  10.624  -3.170   3.745
  263    HB2  PRO  43           1HB      PRO  43  12.311  -2.677   1.653
  264    HB3  PRO  43           2HB      PRO  43  12.858  -3.289   3.201
  265    HG2  PRO  43           1HG      PRO  43  12.546  -4.735   0.642
  266    HG3  PRO  43           2HG      PRO  43  13.471  -5.196   2.058
  267    HD2  PRO  43           1HD      PRO  43  10.929  -6.251   1.250
  268    HD3  PRO  43           2HD      PRO  43  11.799  -6.626   2.724
  269    H    VAL  44           H        VAL  44   8.607  -4.544   1.735
  270    HA   VAL  44           HA       VAL  44   8.260  -2.502  -0.197
  271    HB   VAL  44           HB       VAL  44   6.127  -4.419   0.693
  272   HG11  VAL  44          1HG1      VAL  44   5.770  -4.524  -1.807
  273   HG12  VAL  44          2HG1      VAL  44   5.457  -2.940  -1.059
  274   HG13  VAL  44          3HG1      VAL  44   6.968  -3.216  -1.960
  275   HG21  VAL  44          3HG2      VAL  44   7.516  -6.157   0.455
  276   HG22  VAL  44          1HG2      VAL  44   7.569  -5.760  -1.280
  277   HG23  VAL  44          2HG2      VAL  44   8.819  -5.125  -0.182
  278    H    SER  45           H        SER  45   6.887  -3.227   3.045
  279    HA   SER  45           HA       SER  45   4.803  -1.495   3.032
  280    HB2  SER  45           1HB      SER  45   4.747  -2.556   5.038
  281    HB3  SER  45           2HB      SER  45   6.478  -2.827   5.037
  282    HG   SER  45           HG       SER  45   5.932  -1.460   6.794
  283    H    GLN  46           H        GLN  46   8.216  -0.807   2.865
  284    HA   GLN  46           HA       GLN  46   7.981   1.811   3.969
  285    HB2  GLN  46           1HB      GLN  46  10.066   0.285   3.996
  286    HB3  GLN  46           2HB      GLN  46  10.290   0.722   2.314
  287    HG2  GLN  46           1HG      GLN  46  10.211   3.183   3.052
  288    HG3  GLN  46           2HG      GLN  46  10.255   2.613   4.709
  289   HE21  GLN  46          1HE2      GLN  46  11.953   2.691   1.635
  290   HE22  GLN  46          2HE2      GLN  46  13.552   2.407   2.236
  291    H    SER  47           H        SER  47   7.847   0.248   0.777
  292    HA   SER  47           HA       SER  47   8.164   2.672  -0.645
  293    HB2  SER  47           1HB      SER  47   7.322   1.230  -2.592
  294    HB3  SER  47           2HB      SER  47   8.789   0.685  -1.804
  295    HG   SER  47           HG       SER  47   6.249  -0.513  -1.903
  296    H    CYS  48           H        CYS  48   5.441   0.683   0.580
  297    HA   CYS  48           HA       CYS  48   3.378   1.803  -0.830
  298    HB2  CYS  48           1HB      CYS  48   2.666   0.029   0.381
  299    HB3  CYS  48           2HB      CYS  48   3.667   0.413   1.767
  300    H    ALA  49           H        ALA  49   4.726   2.775   2.413
  301    HA   ALA  49           HA       ALA  49   3.144   5.114   2.563
  302    HB1  ALA  49           3HB      ALA  49   5.262   5.525   4.266
  303    HB2  ALA  49           1HB      ALA  49   3.807   4.580   4.668
  304    HB3  ALA  49           2HB      ALA  49   5.277   3.753   4.100
  305    H    GLY  50           H        GLY  50   5.992   4.240   0.782
  306    HA2  GLY  50           1HA      GLY  50   7.156   6.862   0.664
  307    HA3  GLY  50           2HA      GLY  50   7.579   5.455  -0.291
  308    H    MET  51           H        MET  51   5.295   4.750  -1.645
  309    HA   MET  51           HA       MET  51   5.067   6.970  -3.440
  310    HB2  MET  51           1HB      MET  51   5.410   4.528  -4.137
  311    HB3  MET  51           2HB      MET  51   3.797   4.178  -3.548
  312    HG2  MET  51           1HG      MET  51   2.993   4.777  -5.587
  313    HG3  MET  51           2HG      MET  51   3.452   6.430  -5.229
  314    HE1  MET  51           3HE      MET  51   4.361   5.222  -8.852
  315    HE2  MET  51           1HE      MET  51   3.063   5.773  -7.766
  316    HE3  MET  51           2HE      MET  51   4.362   6.894  -8.242
  317    H    ALA  52           H        ALA  52   3.686   6.687  -0.612
  318    HA   ALA  52           HA       ALA  52   0.901   6.860  -1.427
  319    HB1  ALA  52           3HB      ALA  52   1.055   7.363   1.299
  320    HB2  ALA  52           1HB      ALA  52   0.781   5.772   0.550
  321    HB3  ALA  52           2HB      ALA  52   2.427   6.264   1.017
  322    H    ASP  53           H        ASP  53   2.844   8.871  -2.389
  323    HA   ASP  53           HA       ASP  53   3.014  11.018  -2.633
  324    HB2  ASP  53           1HB      ASP  53   0.228  10.630  -1.744
  325    HB3  ASP  53           2HB      ASP  53   0.823  12.228  -1.339
  326    H    SER  54           H        SER  54   3.347  13.172  -1.393
  327    HA   SER  54           HA       SER  54   4.144  12.511   1.316
  328    HB2  SER  54           1HB      SER  54   5.210  14.224  -0.824
  329    HB3  SER  54           2HB      SER  54   5.109  15.081   0.701
  330    HG   SER  54           HG       SER  54   6.242  13.169   1.667
  331    H    ASN  55           H        ASN  55   3.403  15.759  -0.062
  332    HA   ASN  55           HA       ASN  55   1.495  16.071   2.105
  333    HB2  ASN  55           1HB      ASN  55   3.606  17.691   1.328
  334    HB3  ASN  55           2HB      ASN  55   2.282  18.448   0.464
  335   HD21  ASN  55          1HD2      ASN  55   0.324  18.961   1.693
  336   HD22  ASN  55          2HD2      ASN  55   0.463  19.490   3.336
  337    H    ASP  56           H        ASP  56   1.718  15.376  -1.210
  338    HA   ASP  56           HA       ASP  56  -0.326  17.043  -2.186
  339    HB2  ASP  56           1HB      ASP  56   1.564  15.661  -3.424
  340    HB3  ASP  56           2HB      ASP  56   0.403  14.349  -3.376
  341    H    CYS  57           H        CYS  57  -0.177  14.137  -0.269
  342    HA   CYS  57           HA       CYS  57  -2.636  13.009  -1.141
  343    HB2  CYS  57           1HB      CYS  57  -0.470  12.264   0.556
  344    HB3  CYS  57           2HB      CYS  57  -1.946  12.144   1.493
  345    HA   PRO  58           HA       PRO  58  -5.317  15.107   1.591
  346    HB2  PRO  58           1HB      PRO  58  -6.881  13.198   2.763
  347    HB3  PRO  58           2HB      PRO  58  -7.126  13.763   1.123
  348    HG2  PRO  58           1HG      PRO  58  -5.951  11.213   2.050
  349    HG3  PRO  58           2HG      PRO  58  -6.588  11.617   0.468
  350    HD2  PRO  58           1HD      PRO  58  -3.823  11.442   1.211
  351    HD3  PRO  58           2HD      PRO  58  -4.462  11.958  -0.337
  352    H    ASN  59           H        ASN  59  -2.862  13.385   2.834
  353    HA   ASN  59           HA       ASN  59  -3.613  13.649   5.563
  354    HB2  ASN  59           1HB      ASN  59  -0.881  13.068   4.299
  355    HB3  ASN  59           2HB      ASN  59  -1.272  12.855   5.994
  356   HD21  ASN  59          1HD2      ASN  59  -2.929  11.335   6.582
  357   HD22  ASN  59          2HD2      ASN  59  -3.215   9.923   5.620
  358    H    ALA  60           H        ALA  60  -2.550  15.137   7.102
  359    HA   ALA  60           HA       ALA  60  -1.988  17.212   7.689
  360    HB1  ALA  60           3HB      ALA  60   0.308  17.573   5.984
  361    HB2  ALA  60           1HB      ALA  60   0.255  17.134   7.708
  362    HB3  ALA  60           2HB      ALA  60   0.204  15.862   6.464
  Start of MODEL    8
    1    H1   ASP   1           H        ASP   1   9.930  -5.218  -5.755
    2    HA   ASP   1           HA       ASP   1   8.241  -6.253  -7.571
    3    HB2  ASP   1           1HB      ASP   1   9.589  -8.467  -5.955
    4    HB3  ASP   1           2HB      ASP   1   8.105  -8.688  -6.859
    5    H    ILE   2           H        ILE   2   6.197  -6.066  -6.578
    6    HA   ILE   2           HA       ILE   2   6.210  -6.029  -3.641
    7    HB   ILE   2           HB       ILE   2   4.773  -4.277  -3.640
    8   HG12  ILE   2          1HG1      ILE   2   3.823  -5.069  -6.409
    9   HG13  ILE   2          2HG1      ILE   2   2.987  -5.370  -4.899
   10   HG21  ILE   2          1HG2      ILE   2   6.910  -3.640  -4.761
   11   HG22  ILE   2          2HG2      ILE   2   6.087  -3.818  -6.330
   12   HG23  ILE   2          3HG2      ILE   2   5.530  -2.591  -5.166
   13   HD11  ILE   2          3HD1      ILE   2   3.084  -2.921  -6.511
   14   HD12  ILE   2          1HD1      ILE   2   1.960  -3.370  -5.205
   15   HD13  ILE   2          2HD1      ILE   2   3.522  -2.612  -4.813
   16    H    GLU   3           H        GLU   3   4.652  -7.227  -6.625
   17    HA   GLU   3           HA       GLU   3   2.414  -8.323  -5.493
   18    HB2  GLU   3           1HB      GLU   3   2.374  -9.807  -7.482
   19    HB3  GLU   3           2HB      GLU   3   2.757  -8.154  -7.919
   20    HG2  GLU   3           1HG      GLU   3   5.131  -8.670  -8.119
   21    HG3  GLU   3           2HG      GLU   3   4.908 -10.257  -7.410
   22    H    ASP   4           H        ASP   4   5.797  -9.422  -5.477
   23    HA   ASP   4           HA       ASP   4   5.194 -12.053  -4.693
   24    HB2  ASP   4           1HB      ASP   4   7.520 -10.464  -5.310
   25    HB3  ASP   4           2HB      ASP   4   7.796 -11.210  -3.748
   26    H    PHE   5           H        PHE   5   4.777  -9.086  -3.155
   27    HA   PHE   5           HA       PHE   5   5.093 -10.323  -0.513
   28    HB2  PHE   5           1HB      PHE   5   5.894  -7.628  -1.680
   29    HB3  PHE   5           2HB      PHE   5   5.399  -7.664   0.001
   30    HD1  PHE   5           1HD      PHE   5   7.952  -8.727  -2.396
   31    HD2  PHE   5           2HD      PHE   5   6.770  -8.755   1.679
   32    HE1  PHE   5           1HE      PHE   5  10.264  -9.439  -1.731
   33    HE2  PHE   5           2HE      PHE   5   9.083  -9.467   2.345
   34    HZ   PHE   5           HZ       PHE   5  10.803  -9.801   0.632
   35    H    TYR   6           H        TYR   6   2.804  -9.856  -2.595
   36    HA   TYR   6           HA       TYR   6   1.107  -7.956  -1.282
   37    HB2  TYR   6           1HB      TYR   6   1.233  -8.695  -3.785
   38    HB3  TYR   6           2HB      TYR   6   0.523 -10.219  -3.289
   39    HD1  TYR   6           2HD      TYR   6  -0.444  -6.925  -1.878
   40    HD2  TYR   6           1HD      TYR   6  -1.485 -10.071  -4.583
   41    HE1  TYR   6           2HE      TYR   6  -2.769  -5.933  -2.148
   42    HE2  TYR   6           1HE      TYR   6  -3.807  -9.069  -4.844
   43    HH   TYR   6           HH       TYR   6  -5.300  -7.660  -3.658
   44    H    THR   7           H        THR   7  -0.499  -8.313   0.215
   45    HA   THR   7           HA       THR   7  -0.953 -11.124   0.973
   46    HB   THR   7           HB       THR   7  -0.891 -10.440   3.291
   47    HG1  THR   7           1HG      THR   7  -0.612  -7.988   3.578
   48   HG21  THR   7          3HG2      THR   7   1.322  -9.703   3.571
   49   HG22  THR   7          1HG2      THR   7   1.397 -10.255   1.880
   50   HG23  THR   7          2HG2      THR   7   1.200  -8.524   2.244
   51    H    SER   8           H        SER   8  -2.789 -11.348  -0.339
   52    HA   SER   8           HA       SER   8  -4.817  -9.430  -0.333
   53    HB2  SER   8           1HB      SER   8  -5.252 -10.733  -2.135
   54    HB3  SER   8           2HB      SER   8  -4.313 -12.065  -1.492
   55    HG   SER   8           HG       SER   8  -7.097 -11.548  -1.297
   56    H    GLU   9           H        GLU   9  -3.747 -11.560   2.089
   57    HA   GLU   9           HA       GLU   9  -6.211 -12.388   3.127
   58    HB2  GLU   9           1HB      GLU   9  -3.529 -12.931   3.630
   59    HB3  GLU   9           2HB      GLU   9  -4.007 -12.064   5.076
   60    HG2  GLU   9           1HG      GLU   9  -6.171 -13.762   4.719
   61    HG3  GLU   9           2HG      GLU   9  -4.856 -14.749   4.112
   62    H    THR  10           H        THR  10  -3.943  -9.685   3.979
   63    HA   THR  10           HA       THR  10  -5.998  -8.579   5.738
   64    HB   THR  10           HB       THR  10  -3.811  -8.677   6.741
   65    HG1  THR  10           1HG      THR  10  -4.212  -6.552   7.209
   66   HG21  THR  10          3HG2      THR  10  -2.081  -8.920   5.215
   67   HG22  THR  10          1HG2      THR  10  -2.912  -7.949   3.977
   68   HG23  THR  10          2HG2      THR  10  -2.040  -7.143   5.303
   69    H    CYS  11           H        CYS  11  -4.489  -8.119   2.577
   70    HA   CYS  11           HA       CYS  11  -5.194  -5.437   2.253
   71    HB2  CYS  11           1HB      CYS  11  -3.583  -6.860   0.877
   72    HB3  CYS  11           2HB      CYS  11  -4.993  -7.471   0.034
   73    HA   PRO  12           HA       PRO  12  -9.496  -5.950   1.693
   74    HB2  PRO  12           1HB      PRO  12 -10.128  -3.463   0.753
   75    HB3  PRO  12           2HB      PRO  12  -9.920  -3.819   2.456
   76    HG2  PRO  12           1HG      PRO  12  -8.090  -2.392   0.625
   77    HG3  PRO  12           2HG      PRO  12  -8.112  -2.390   2.378
   78    HD2  PRO  12           1HD      PRO  12  -6.292  -3.822   0.685
   79    HD3  PRO  12           2HD      PRO  12  -6.388  -3.910   2.433
   80    H    TYR  13           H        TYR  13  -7.286  -5.780  -0.730
   81    HA   TYR  13           HA       TYR  13  -9.409  -6.335  -2.691
   82    HB2  TYR  13           1HB      TYR  13  -6.605  -5.162  -3.159
   83    HB3  TYR  13           2HB      TYR  13  -7.926  -5.188  -4.311
   84    HD1  TYR  13           1HD      TYR  13  -9.970  -3.732  -3.864
   85    HD2  TYR  13           2HD      TYR  13  -6.330  -3.351  -1.649
   86    HE1  TYR  13           1HE      TYR  13 -10.666  -1.407  -3.106
   87    HE2  TYR  13           2HE      TYR  13  -7.038  -1.027  -0.899
   88    HH   TYR  13           HH       TYR  13 -10.049   0.414  -2.096
   89    H    LYS  14           H        LYS  14  -8.956  -7.979  -4.260
   90    HA   LYS  14           HA       LYS  14  -6.507  -9.497  -3.812
   91    HB2  LYS  14           1HB      LYS  14  -7.585 -11.545  -3.426
   92    HB3  LYS  14           2HB      LYS  14  -8.398 -10.407  -2.370
   93    HG2  LYS  14           1HG      LYS  14  -9.411 -11.251  -5.127
   94    HG3  LYS  14           2HG      LYS  14  -9.995 -11.900  -3.608
   95    HD2  LYS  14           1HD      LYS  14 -11.503 -10.206  -3.556
   96    HD3  LYS  14           2HD      LYS  14 -10.170  -9.110  -3.252
   97    HE2  LYS  14           1HE      LYS  14 -11.411  -8.299  -5.195
   98    HE3  LYS  14           2HE      LYS  14  -9.838  -8.853  -5.734
   99    HZ1  LYS  14           3HZ      LYS  14 -12.139  -9.650  -6.780
  100    HZ2  LYS  14           1HZ      LYS  14 -10.757 -10.515  -6.868
  101    HZ3  LYS  14           2HZ      LYS  14 -11.870 -10.870  -5.728
  102    H    ASN  15           H        ASN  15  -7.518  -7.582  -5.871
  103    HA   ASN  15           HA       ASN  15  -8.073  -9.362  -8.070
  104    HB2  ASN  15           1HB      ASN  15  -9.006  -6.849  -7.490
  105    HB3  ASN  15           2HB      ASN  15  -7.648  -6.415  -8.510
  106   HD21  ASN  15          1HD2      ASN  15 -10.651  -6.383  -8.811
  107   HD22  ASN  15          2HD2      ASN  15 -10.977  -7.150 -10.329
  108    H    ASP  16           H        ASP  16  -5.665  -6.934  -6.876
  109    HA   ASP  16           HA       ASP  16  -3.585  -8.302  -8.203
  110    HB2  ASP  16           1HB      ASP  16  -4.836  -5.977  -9.496
  111    HB3  ASP  16           2HB      ASP  16  -3.141  -5.677  -9.168
  112    H    SER  17           H        SER  17  -1.437  -7.344  -7.536
  113    HA   SER  17           HA       SER  17  -1.626  -6.242  -4.951
  114    HB2  SER  17           1HB      SER  17   0.997  -6.058  -5.402
  115    HB3  SER  17           2HB      SER  17   0.233  -7.609  -5.119
  116    HG   SER  17           HG       SER  17   1.516  -6.679  -7.380
  117    H    GLN  18           H        GLN  18  -0.998  -5.005  -8.239
  118    HA   GLN  18           HA       GLN  18   0.003  -2.521  -7.355
  119    HB2  GLN  18           1HB      GLN  18  -1.074  -3.496 -10.031
  120    HB3  GLN  18           2HB      GLN  18  -0.459  -1.871  -9.801
  121    HG2  GLN  18           1HG      GLN  18   1.754  -2.635  -9.339
  122    HG3  GLN  18           2HG      GLN  18   1.218  -4.263  -8.972
  123   HE21  GLN  18          1HE2      GLN  18   3.242  -3.344 -10.836
  124   HE22  GLN  18          2HE2      GLN  18   2.814  -3.927 -12.409
  125    H    LEU  19           H        LEU  19  -3.194  -3.921  -7.850
  126    HA   LEU  19           HA       LEU  19  -4.626  -1.548  -8.246
  127    HB2  LEU  19           1HB      LEU  19  -5.719  -3.499  -8.825
  128    HB3  LEU  19           2HB      LEU  19  -5.274  -4.325  -7.345
  129    HG   LEU  19           HG       LEU  19  -7.715  -3.682  -7.627
  130   HD11  LEU  19          1HD1      LEU  19  -6.427  -4.240  -5.451
  131   HD12  LEU  19          2HD1      LEU  19  -6.577  -2.500  -5.106
  132   HD13  LEU  19          3HD1      LEU  19  -8.038  -3.491  -5.336
  133   HD21  LEU  19          3HD2      LEU  19  -7.858  -1.547  -8.431
  134   HD22  LEU  19          1HD2      LEU  19  -8.058  -1.236  -6.690
  135   HD23  LEU  19          2HD2      LEU  19  -6.479  -0.966  -7.467
  136    H    ALA  20           H        ALA  20  -4.075  -3.502  -5.229
  137    HA   ALA  20           HA       ALA  20  -5.281  -1.639  -3.536
  138    HB1  ALA  20           3HB      ALA  20  -4.131  -2.914  -1.760
  139    HB2  ALA  20           1HB      ALA  20  -4.856  -4.003  -2.967
  140    HB3  ALA  20           2HB      ALA  20  -3.103  -3.696  -2.985
  141    H    TRP  21           H        TRP  21  -1.995  -1.916  -4.909
  142    HA   TRP  21           HA       TRP  21  -0.799  -0.044  -3.168
  143    HB2  TRP  21           1HB      TRP  21   0.651  -1.509  -4.250
  144    HB3  TRP  21           2HB      TRP  21  -0.082  -1.250  -5.821
  145    HD1  TRP  21           HD       TRP  21   0.602   1.113  -7.097
  146    HE1  TRP  21           1HE      TRP  21   2.714   2.690  -6.969
  147    HE3  TRP  21           3HE      TRP  21   2.315  -0.669  -2.654
  148    HZ2  TRP  21           2HZ      TRP  21   4.817   3.008  -5.066
  149    HZ3  TRP  21           3HZ      TRP  21   4.405   0.329  -1.730
  150    HH2  TRP  21           HH       TRP  21   5.645   2.106  -2.861
  151    H    ASP  22           H        ASP  22  -2.417   0.112  -6.396
  152    HA   ASP  22           HA       ASP  22  -1.867   2.793  -6.835
  153    HB2  ASP  22           1HB      ASP  22  -3.570   0.682  -7.974
  154    HB3  ASP  22           2HB      ASP  22  -4.360   2.244  -8.053
  155    H    THR  23           H        THR  23  -3.908   1.184  -4.565
  156    HA   THR  23           HA       THR  23  -5.950   3.220  -4.442
  157    HB   THR  23           HB       THR  23  -5.452   0.500  -3.464
  158    HG1  THR  23           1HG      THR  23  -7.729   0.616  -3.717
  159   HG21  THR  23          3HG2      THR  23  -6.468   2.619  -1.509
  160   HG22  THR  23          1HG2      THR  23  -6.930   0.905  -1.383
  161   HG23  THR  23          2HG2      THR  23  -5.223   1.382  -1.215
  162    H    CYS  24           H        CYS  24  -3.341   2.066  -2.193
  163    HA   CYS  24           HA       CYS  24  -3.669   4.503  -0.690
  164    HB2  CYS  24           1HB      CYS  24  -3.199   3.030   0.907
  165    HB3  CYS  24           2HB      CYS  24  -2.552   1.861  -0.227
  166    H    SER  25           H        SER  25  -0.801   2.717  -2.064
  167    HA   SER  25           HA       SER  25   0.611   5.178  -2.271
  168    HB2  SER  25           1HB      SER  25   2.117   3.280  -3.637
  169    HB3  SER  25           2HB      SER  25   2.260   3.663  -1.933
  170    HG   SER  25           HG       SER  25   1.406   1.765  -1.417
  171    H    GLY  26           H        GLY  26  -1.584   5.644  -3.766
  172    HA2  GLY  26           1HA      GLY  26  -0.655   5.302  -6.556
  173    HA3  GLY  26           2HA      GLY  26  -2.338   5.160  -6.087
  174    H    GLY  27           H        GLY  27  -0.861   7.464  -4.064
  175    HA2  GLY  27           1HA      GLY  27  -0.400   9.749  -4.490
  176    HA3  GLY  27           2HA      GLY  27  -1.418   9.689  -5.915
  177    H    THR  28           H        THR  28  -3.724   8.363  -4.940
  178    HA   THR  28           HA       THR  28  -4.596  10.084  -2.721
  179    HB   THR  28           HB       THR  28  -6.694  10.504  -4.002
  180    HG1  THR  28           1HG      THR  28  -6.396   8.408  -5.207
  181   HG21  THR  28          3HG2      THR  28  -4.099  11.070  -5.516
  182   HG22  THR  28          1HG2      THR  28  -5.680  11.675  -6.065
  183   HG23  THR  28          2HG2      THR  28  -5.024  12.198  -4.496
  184    H    GLY  29           H        GLY  29  -7.168   9.207  -2.411
  185    HA2  GLY  29           1HA      GLY  29  -8.464   7.318  -2.033
  186    HA3  GLY  29           2HA      GLY  29  -7.075   6.285  -2.306
  187    H    ASN  30           H        ASN  30  -6.692   5.147  -0.449
  188    HA   ASN  30           HA       ASN  30  -6.985   6.598   2.046
  189    HB2  ASN  30           1HB      ASN  30  -6.697   4.156   2.983
  190    HB3  ASN  30           2HB      ASN  30  -8.207   4.565   2.193
  191   HD21  ASN  30          1HD2      ASN  30  -8.917   3.153   0.805
  192   HD22  ASN  30          2HD2      ASN  30  -7.985   2.063  -0.165
  193    H    CYS  31           H        CYS  31  -4.693   7.138   0.345
  194    HA   CYS  31           HA       CYS  31  -2.485   5.575   0.793
  195    HB2  CYS  31           1HB      CYS  31  -1.272   7.247  -0.152
  196    HB3  CYS  31           2HB      CYS  31  -2.878   7.688  -0.698
  197    H    GLY  32           H        GLY  32  -1.067   5.312   2.534
  198    HA2  GLY  32           1HA      GLY  32  -0.701   7.163   4.607
  199    HA3  GLY  32           2HA      GLY  32  -1.919   6.011   5.117
  200    H    THR  33           H        THR  33   0.219   5.877   6.666
  201    HA   THR  33           HA       THR  33   2.184   4.053   5.560
  202    HB   THR  33           HB       THR  33   1.818   5.294   8.339
  203    HG1  THR  33           1HG      THR  33   2.903   6.973   7.349
  204   HG21  THR  33          3HG2      THR  33   3.357   3.313   8.349
  205   HG22  THR  33          1HG2      THR  33   4.246   4.014   6.976
  206   HG23  THR  33          2HG2      THR  33   4.260   4.833   8.556
  207    H    VAL  34           H        VAL  34  -0.947   3.749   6.726
  208    HA   VAL  34           HA       VAL  34  -0.491   1.366   8.271
  209    HB   VAL  34           HB       VAL  34  -3.006   2.692   7.239
  210   HG11  VAL  34          1HG1      VAL  34  -2.852   0.098   7.989
  211   HG12  VAL  34          2HG1      VAL  34  -3.103   0.862   9.577
  212   HG13  VAL  34          3HG1      VAL  34  -4.281   1.122   8.268
  213   HG21  VAL  34          3HG2      VAL  34  -1.800   2.739  10.025
  214   HG22  VAL  34          1HG2      VAL  34  -1.656   4.054   8.834
  215   HG23  VAL  34          2HG2      VAL  34  -3.256   3.598   9.467
  216    H    CYS  35           H        CYS  35  -1.350   2.300   4.935
  217    HA   CYS  35           HA       CYS  35  -2.285  -0.188   4.111
  218    HB2  CYS  35           1HB      CYS  35  -2.654   0.911   2.232
  219    HB3  CYS  35           2HB      CYS  35  -1.929   2.322   2.976
  220    H    CYS  36           H        CYS  36   0.823   0.895   5.141
  221    HA   CYS  36           HA       CYS  36   2.540  -0.466   3.482
  222    HB2  CYS  36           1HB      CYS  36   2.835  -0.015   6.460
  223    HB3  CYS  36           2HB      CYS  36   4.127  -0.412   5.344
  224    H    GLY  37           H        GLY  37   1.744  -1.571   6.852
  225    HA2  GLY  37           1HA      GLY  37   2.110  -4.335   6.023
  226    HA3  GLY  37           2HA      GLY  37   1.911  -3.720   7.652
  227    H    GLN  38           H        GLN  38  -0.140  -3.179   4.711
  228    HA   GLN  38           HA       GLN  38  -2.290  -4.482   6.193
  229    HB2  GLN  38           1HB      GLN  38  -2.472  -1.944   5.974
  230    HB3  GLN  38           2HB      GLN  38  -2.625  -2.165   4.243
  231    HG2  GLN  38           1HG      GLN  38  -4.779  -2.948   4.397
  232    HG3  GLN  38           2HG      GLN  38  -4.439  -3.904   5.825
  233   HE21  GLN  38          1HE2      GLN  38  -5.504  -0.879   4.557
  234   HE22  GLN  38          2HE2      GLN  38  -5.994  -0.125   6.038
  235    H    CYS  39           H        CYS  39  -0.664  -3.860   3.074
  236    HA   CYS  39           HA       CYS  39  -2.189  -6.109   1.980
  237    HB2  CYS  39           1HB      CYS  39  -1.324  -3.604   0.522
  238    HB3  CYS  39           2HB      CYS  39  -1.970  -5.036  -0.254
  239    H    PHE  40           H        PHE  40   0.818  -4.098   1.979
  240    HA   PHE  40           HA       PHE  40   2.257  -6.451   0.976
  241    HB2  PHE  40           1HB      PHE  40   3.370  -3.626   1.081
  242    HB3  PHE  40           2HB      PHE  40   3.702  -4.876  -0.101
  243    HD1  PHE  40           2HD      PHE  40   1.229  -2.351   0.956
  244    HD2  PHE  40           1HD      PHE  40   2.399  -5.070  -2.084
  245    HE1  PHE  40           2HE      PHE  40  -0.418  -1.299  -0.618
  246    HE2  PHE  40           1HE      PHE  40   0.752  -4.018  -3.659
  247    HZ   PHE  40           HZ       PHE  40  -0.637  -2.145  -2.907
  248    H    SER  41           H        SER  41   4.776  -6.148   1.695
  249    HA   SER  41           HA       SER  41   4.799  -5.356   4.483
  250    HB2  SER  41           1HB      SER  41   6.301  -7.571   4.728
  251    HB3  SER  41           2HB      SER  41   4.566  -7.594   4.974
  252    HG   SER  41           HG       SER  41   5.698  -9.215   3.409
  253    H    PHE  42           H        PHE  42   7.085  -5.106   5.323
  254    HA   PHE  42           HA       PHE  42   8.634  -3.629   3.601
  255    HB2  PHE  42           1HB      PHE  42   8.595  -4.583   6.308
  256    HB3  PHE  42           2HB      PHE  42  10.155  -5.079   5.682
  257    HD1  PHE  42           2HD      PHE  42   7.959  -2.085   5.969
  258    HD2  PHE  42           1HD      PHE  42  11.923  -3.569   5.660
  259    HE1  PHE  42           2HE      PHE  42   8.855   0.225   6.368
  260    HE2  PHE  42           1HE      PHE  42  12.819  -1.258   6.059
  261    HZ   PHE  42           HZ       PHE  42  11.274   0.611   6.408
  262    HA   PRO  43           HA       PRO  43  10.739  -3.213   3.648
  263    HB2  PRO  43           1HB      PRO  43  12.365  -2.529   1.561
  264    HB3  PRO  43           2HB      PRO  43  12.964  -3.216   3.058
  265    HG2  PRO  43           1HG      PRO  43  12.652  -4.511   0.419
  266    HG3  PRO  43           2HG      PRO  43  13.621  -5.025   1.786
  267    HD2  PRO  43           1HD      PRO  43  11.102  -6.119   0.959
  268    HD3  PRO  43           2HD      PRO  43  12.013  -6.553   2.391
  269    H    VAL  44           H        VAL  44   8.748  -4.537   1.567
  270    HA   VAL  44           HA       VAL  44   8.285  -2.372  -0.203
  271    HB   VAL  44           HB       VAL  44   6.239  -4.436   0.538
  272   HG11  VAL  44          1HG1      VAL  44   5.476  -2.947  -1.126
  273   HG12  VAL  44          2HG1      VAL  44   7.039  -2.959  -1.978
  274   HG13  VAL  44          3HG1      VAL  44   5.994  -4.400  -2.015
  275   HG21  VAL  44          3HG2      VAL  44   8.965  -4.973  -0.391
  276   HG22  VAL  44          1HG2      VAL  44   7.727  -6.087   0.238
  277   HG23  VAL  44          2HG2      VAL  44   7.718  -5.625  -1.481
  278    H    SER  45           H        SER  45   7.020  -3.393   2.997
  279    HA   SER  45           HA       SER  45   4.840  -1.781   3.131
  280    HB2  SER  45           1HB      SER  45   4.885  -3.022   5.038
  281    HB3  SER  45           2HB      SER  45   6.634  -3.140   5.027
  282    HG   SER  45           HG       SER  45   5.965  -1.958   6.877
  283    H    GLN  46           H        GLN  46   8.191  -0.896   2.921
  284    HA   GLN  46           HA       GLN  46   7.798   1.641   4.201
  285    HB2  GLN  46           1HB      GLN  46   9.972   1.015   4.614
  286    HB3  GLN  46           2HB      GLN  46  10.100   0.071   3.143
  287    HG2  GLN  46           1HG      GLN  46  10.389   2.095   1.789
  288    HG3  GLN  46           2HG      GLN  46  10.046   3.123   3.166
  289   HE21  GLN  46          1HE2      GLN  46  11.565   3.500   4.713
  290   HE22  GLN  46          2HE2      GLN  46  13.226   3.026   4.589
  291    H    SER  47           H        SER  47   7.616   0.202   1.004
  292    HA   SER  47           HA       SER  47   8.054   2.615  -0.399
  293    HB2  SER  47           1HB      SER  47   6.539   0.221  -1.484
  294    HB3  SER  47           2HB      SER  47   7.544   1.356  -2.362
  295    HG   SER  47           HG       SER  47   9.230   0.373  -0.624
  296    H    CYS  48           H        CYS  48   5.231   0.810   0.884
  297    HA   CYS  48           HA       CYS  48   3.213   2.084  -0.454
  298    HB2  CYS  48           1HB      CYS  48   2.513   0.294   0.794
  299    HB3  CYS  48           2HB      CYS  48   3.453   0.749   2.201
  300    H    ALA  49           H        ALA  49   4.488   2.887   2.869
  301    HA   ALA  49           HA       ALA  49   3.154   5.330   3.048
  302    HB1  ALA  49           3HB      ALA  49   5.105   3.760   4.538
  303    HB2  ALA  49           1HB      ALA  49   5.489   5.497   4.610
  304    HB3  ALA  49           2HB      ALA  49   3.890   4.916   5.134
  305    H    GLY  50           H        GLY  50   5.829   4.334   1.101
  306    HA2  GLY  50           1HA      GLY  50   7.106   6.923   0.972
  307    HA3  GLY  50           2HA      GLY  50   7.485   5.489   0.039
  308    H    MET  51           H        MET  51   5.260   4.796  -1.339
  309    HA   MET  51           HA       MET  51   4.998   7.032  -3.111
  310    HB2  MET  51           1HB      MET  51   5.415   4.638  -3.871
  311    HB3  MET  51           2HB      MET  51   3.839   4.192  -3.249
  312    HG2  MET  51           1HG      MET  51   2.903   4.825  -5.217
  313    HG3  MET  51           2HG      MET  51   3.401   6.477  -4.910
  314    HE1  MET  51           3HE      MET  51   4.052   7.541  -6.467
  315    HE2  MET  51           1HE      MET  51   5.802   7.518  -6.789
  316    HE3  MET  51           2HE      MET  51   4.660   6.969  -8.039
  317    H    ALA  52           H        ALA  52   3.606   6.718  -0.306
  318    HA   ALA  52           HA       ALA  52   0.821   6.771  -1.115
  319    HB1  ALA  52           3HB      ALA  52   2.346   6.709   1.491
  320    HB2  ALA  52           1HB      ALA  52   0.628   7.173   1.466
  321    HB3  ALA  52           2HB      ALA  52   1.126   5.570   0.873
  322    H    ASP  53           H        ASP  53   2.932   8.852  -1.933
  323    HA   ASP  53           HA       ASP  53   3.029  10.996  -2.234
  324    HB2  ASP  53           1HB      ASP  53   0.152  10.567  -1.585
  325    HB3  ASP  53           2HB      ASP  53   0.698  12.217  -1.359
  326    H    SER  54           H        SER  54   3.415  13.068  -1.043
  327    HA   SER  54           HA       SER  54   3.523  12.578   1.823
  328    HB2  SER  54           1HB      SER  54   5.349  13.797  -0.120
  329    HB3  SER  54           2HB      SER  54   5.051  14.878   1.227
  330    HG   SER  54           HG       SER  54   6.062  13.534   2.603
  331    H    ASN  55           H        ASN  55   3.710  15.707   0.039
  332    HA   ASN  55           HA       ASN  55   1.669  16.713   1.788
  333    HB2  ASN  55           1HB      ASN  55   3.969  17.827   0.740
  334    HB3  ASN  55           2HB      ASN  55   2.782  18.449  -0.389
  335   HD21  ASN  55          1HD2      ASN  55   2.213  20.412   0.116
  336   HD22  ASN  55          2HD2      ASN  55   1.881  21.043   1.695
  337    H    ASP  56           H        ASP  56   1.952  15.241  -1.300
  338    HA   ASP  56           HA       ASP  56   0.047  16.779  -2.686
  339    HB2  ASP  56           1HB      ASP  56   1.883  14.809  -3.341
  340    HB3  ASP  56           2HB      ASP  56   0.379  13.915  -3.441
  341    H    CYS  57           H        CYS  57   0.044  13.992  -0.467
  342    HA   CYS  57           HA       CYS  57  -2.640  13.227  -1.113
  343    HB2  CYS  57           1HB      CYS  57  -0.425  12.092   0.291
  344    HB3  CYS  57           2HB      CYS  57  -1.797  12.136   1.381
  345    HA   PRO  58           HA       PRO  58  -4.601  15.631   1.951
  346    HB2  PRO  58           1HB      PRO  58  -6.429  13.973   3.125
  347    HB3  PRO  58           2HB      PRO  58  -6.676  14.713   1.556
  348    HG2  PRO  58           1HG      PRO  58  -5.977  11.913   2.195
  349    HG3  PRO  58           2HG      PRO  58  -6.635  12.568   0.709
  350    HD2  PRO  58           1HD      PRO  58  -3.916  11.790   1.186
  351    HD3  PRO  58           2HD      PRO  58  -4.550  12.552  -0.259
  352    H    ASN  59           H        ASN  59  -2.183  15.287   2.858
  353    HA   ASN  59           HA       ASN  59  -2.516  14.192   5.517
  354    HB2  ASN  59           1HB      ASN  59  -0.396  14.143   3.643
  355    HB3  ASN  59           2HB      ASN  59   0.145  15.293   4.849
  356   HD21  ASN  59          1HD2      ASN  59   1.654  13.225   4.744
  357   HD22  ASN  59          2HD2      ASN  59   1.388  12.071   6.008
  358    H    ALA  60           H        ALA  60  -0.306  15.822   6.652
  359    HA   ALA  60           HA       ALA  60  -0.717  18.559   6.280
  360    HB1  ALA  60           3HB      ALA  60  -2.913  17.491   7.501
  361    HB2  ALA  60           1HB      ALA  60  -1.907  17.881   8.916
  362    HB3  ALA  60           2HB      ALA  60  -2.345  19.158   7.756
  Start of MODEL    9
    1    H1   ASP   1           H        ASP   1   9.457  -8.765  -5.993
    2    HA   ASP   1           HA       ASP   1   8.830  -6.133  -7.081
    3    HB2  ASP   1           1HB      ASP   1   7.634  -8.864  -7.618
    4    HB3  ASP   1           2HB      ASP   1   6.615  -7.446  -7.772
    5    H    ILE   2           H        ILE   2   6.252  -5.745  -6.523
    6    HA   ILE   2           HA       ILE   2   6.115  -5.985  -3.649
    7    HB   ILE   2           HB       ILE   2   4.698  -4.227  -3.703
    8   HG12  ILE   2          1HG1      ILE   2   3.672  -5.166  -6.397
    9   HG13  ILE   2          2HG1      ILE   2   2.872  -5.360  -4.850
   10   HG21  ILE   2          1HG2      ILE   2   5.575  -2.601  -5.084
   11   HG22  ILE   2          2HG2      ILE   2   6.857  -3.835  -5.118
   12   HG23  ILE   2          3HG2      ILE   2   5.715  -3.701  -6.477
   13   HD11  ILE   2          3HD1      ILE   2   1.921  -3.323  -5.089
   14   HD12  ILE   2          1HD1      ILE   2   3.537  -2.576  -5.114
   15   HD13  ILE   2          2HD1      ILE   2   2.776  -3.103  -6.634
   16    H    GLU   3           H        GLU   3   4.690  -7.402  -6.572
   17    HA   GLU   3           HA       GLU   3   2.407  -8.435  -5.414
   18    HB2  GLU   3           1HB      GLU   3   2.433 -10.033  -7.338
   19    HB3  GLU   3           2HB      GLU   3   2.708  -8.374  -7.832
   20    HG2  GLU   3           1HG      GLU   3   5.046  -8.731  -8.176
   21    HG3  GLU   3           2HG      GLU   3   5.058 -10.197  -7.217
   22    H    ASP   4           H        ASP   4   5.802  -9.465  -5.304
   23    HA   ASP   4           HA       ASP   4   5.242 -12.083  -4.446
   24    HB2  ASP   4           1HB      ASP   4   7.732 -10.340  -4.138
   25    HB3  ASP   4           2HB      ASP   4   7.686 -12.052  -3.766
   26    H    PHE   5           H        PHE   5   4.748  -9.068  -3.015
   27    HA   PHE   5           HA       PHE   5   5.027 -10.214  -0.328
   28    HB2  PHE   5           1HB      PHE   5   5.805  -7.550  -1.572
   29    HB3  PHE   5           2HB      PHE   5   5.260  -7.527   0.093
   30    HD1  PHE   5           2HD      PHE   5   6.543  -8.748   1.831
   31    HD2  PHE   5           1HD      PHE   5   7.958  -8.410  -2.155
   32    HE1  PHE   5           2HE      PHE   5   8.847  -9.388   2.595
   33    HE2  PHE   5           1HE      PHE   5  10.262  -9.050  -1.392
   34    HZ   PHE   5           HZ       PHE   5  10.679  -9.531   0.974
   35    H    TYR   6           H        TYR   6   2.796  -9.749  -2.536
   36    HA   TYR   6           HA       TYR   6   1.027  -7.905  -1.240
   37    HB2  TYR   6           1HB      TYR   6   1.242  -8.555  -3.751
   38    HB3  TYR   6           2HB      TYR   6   0.573 -10.120  -3.334
   39    HD1  TYR   6           1HD      TYR   6  -0.616  -7.008  -1.739
   40    HD2  TYR   6           2HD      TYR   6  -1.343  -9.908  -4.799
   41    HE1  TYR   6           1HE      TYR   6  -2.966  -6.093  -2.057
   42    HE2  TYR   6           2HE      TYR   6  -3.691  -8.984  -5.107
   43    HH   TYR   6           HH       TYR   6  -5.193  -7.116  -2.915
   44    H    THR   7           H        THR   7  -0.465  -8.310   0.327
   45    HA   THR   7           HA       THR   7  -0.957 -11.146   0.962
   46    HB   THR   7           HB       THR   7  -0.933 -10.527   3.276
   47    HG1  THR   7           1HG      THR   7  -0.938  -8.107   3.696
   48   HG21  THR   7          3HG2      THR   7   0.993  -8.400   2.307
   49   HG22  THR   7          1HG2      THR   7   1.188  -9.565   3.638
   50   HG23  THR   7          2HG2      THR   7   1.357 -10.106   1.951
   51    H    SER   8           H        SER   8  -2.740 -11.411  -0.407
   52    HA   SER   8           HA       SER   8  -4.827  -9.531  -0.396
   53    HB2  SER   8           1HB      SER   8  -4.471 -10.985  -2.321
   54    HB3  SER   8           2HB      SER   8  -4.667 -12.424  -1.339
   55    HG   SER   8           HG       SER   8  -6.783 -12.299  -1.601
   56    H    GLU   9           H        GLU   9  -3.756 -11.649   1.981
   57    HA   GLU   9           HA       GLU   9  -6.238 -12.682   2.834
   58    HB2  GLU   9           1HB      GLU   9  -3.557 -13.178   3.402
   59    HB3  GLU   9           2HB      GLU   9  -4.122 -12.436   4.886
   60    HG2  GLU   9           1HG      GLU   9  -6.210 -14.167   4.323
   61    HG3  GLU   9           2HG      GLU   9  -4.845 -15.065   3.690
   62    H    THR  10           H        THR  10  -4.112  -9.939   3.873
   63    HA   THR  10           HA       THR  10  -6.261  -9.020   5.639
   64    HB   THR  10           HB       THR  10  -4.123  -9.147   6.743
   65    HG1  THR  10           1HG      THR  10  -4.192  -6.982   7.305
   66   HG21  THR  10          3HG2      THR  10  -3.103  -8.059   4.114
   67   HG22  THR  10          1HG2      THR  10  -2.260  -7.570   5.604
   68   HG23  THR  10          2HG2      THR  10  -2.382  -9.293   5.175
   69    H    CYS  11           H        CYS  11  -4.668  -8.363   2.571
   70    HA   CYS  11           HA       CYS  11  -5.355  -5.664   2.383
   71    HB2  CYS  11           1HB      CYS  11  -3.702  -6.926   0.967
   72    HB3  CYS  11           2HB      CYS  11  -5.057  -7.628   0.105
   73    HA   PRO  12           HA       PRO  12  -9.649  -6.138   1.722
   74    HB2  PRO  12           1HB      PRO  12 -10.264  -3.583   0.971
   75    HB3  PRO  12           2HB      PRO  12 -10.090  -4.075   2.644
   76    HG2  PRO  12           1HG      PRO  12  -8.226  -2.507   0.970
   77    HG3  PRO  12           2HG      PRO  12  -8.282  -2.645   2.716
   78    HD2  PRO  12           1HD      PRO  12  -6.428  -3.938   0.950
   79    HD3  PRO  12           2HD      PRO  12  -6.558  -4.166   2.683
   80    H    TYR  13           H        TYR  13  -7.463  -5.201  -0.721
   81    HA   TYR  13           HA       TYR  13  -9.524  -5.667  -2.748
   82    HB2  TYR  13           1HB      TYR  13  -6.660  -4.542  -2.666
   83    HB3  TYR  13           2HB      TYR  13  -7.509  -4.788  -4.179
   84    HD1  TYR  13           1HD      TYR  13  -9.543  -3.430  -4.708
   85    HD2  TYR  13           2HD      TYR  13  -7.146  -2.660  -1.249
   86    HE1  TYR  13           1HE      TYR  13 -10.594  -1.126  -4.484
   87    HE2  TYR  13           2HE      TYR  13  -8.204  -0.358  -1.037
   88    HH   TYR  13           HH       TYR  13 -10.633   0.587  -1.861
   89    H    LYS  14           H        LYS  14  -8.372  -6.709  -4.859
   90    HA   LYS  14           HA       LYS  14  -6.503  -8.777  -4.180
   91    HB2  LYS  14           1HB      LYS  14  -8.101 -10.589  -5.005
   92    HB3  LYS  14           2HB      LYS  14  -8.335  -9.991  -3.375
   93    HG2  LYS  14           1HG      LYS  14 -10.527  -9.895  -4.162
   94    HG3  LYS  14           2HG      LYS  14  -9.994  -8.271  -4.546
   95    HD2  LYS  14           1HD      LYS  14  -9.246 -10.010  -6.736
   96    HD3  LYS  14           2HD      LYS  14 -10.931 -10.304  -6.353
   97    HE2  LYS  14           1HE      LYS  14 -11.273  -7.755  -6.392
   98    HE3  LYS  14           2HE      LYS  14  -9.648  -7.620  -7.033
   99    HZ1  LYS  14           3HZ      LYS  14 -11.676  -7.858  -8.597
  100    HZ2  LYS  14           1HZ      LYS  14 -10.263  -8.584  -8.975
  101    HZ3  LYS  14           2HZ      LYS  14 -11.482  -9.457  -8.330
  102    H    ASN  15           H        ASN  15  -7.176 -10.415  -6.503
  103    HA   ASN  15           HA       ASN  15  -7.057 -10.459  -8.688
  104    HB2  ASN  15           1HB      ASN  15  -8.158  -7.867  -8.318
  105    HB3  ASN  15           2HB      ASN  15  -6.777  -7.603  -9.363
  106   HD21  ASN  15          1HD2      ASN  15  -8.187  -7.047 -11.043
  107   HD22  ASN  15          2HD2      ASN  15  -9.039  -8.235 -11.973
  108    H    ASP  16           H        ASP  16  -5.390  -7.338  -7.776
  109    HA   ASP  16           HA       ASP  16  -2.862  -8.640  -8.307
  110    HB2  ASP  16           1HB      ASP  16  -3.936  -7.148 -10.286
  111    HB3  ASP  16           2HB      ASP  16  -3.255  -5.836  -9.345
  112    H    SER  17           H        SER  17  -1.002  -7.235  -7.418
  113    HA   SER  17           HA       SER  17  -1.826  -6.135  -4.939
  114    HB2  SER  17           1HB      SER  17   0.622  -5.811  -4.572
  115    HB3  SER  17           2HB      SER  17   0.229  -7.446  -5.066
  116    HG   SER  17           HG       SER  17   0.957  -6.995  -7.188
  117    H    GLN  18           H        GLN  18  -0.851  -4.945  -8.145
  118    HA   GLN  18           HA       GLN  18  -0.205  -2.352  -7.362
  119    HB2  GLN  18           1HB      GLN  18  -1.093  -3.585  -9.992
  120    HB3  GLN  18           2HB      GLN  18  -0.762  -1.869  -9.862
  121    HG2  GLN  18           1HG      GLN  18   1.527  -2.186  -9.495
  122    HG3  GLN  18           2HG      GLN  18   1.305  -3.759  -8.755
  123   HE21  GLN  18          1HE2      GLN  18   1.467  -1.956 -11.739
  124   HE22  GLN  18          2HE2      GLN  18   1.717  -3.285 -12.821
  125    H    LEU  19           H        LEU  19  -3.226  -4.047  -7.553
  126    HA   LEU  19           HA       LEU  19  -4.881  -1.835  -8.170
  127    HB2  LEU  19           1HB      LEU  19  -5.636  -4.055  -8.591
  128    HB3  LEU  19           2HB      LEU  19  -5.383  -4.534  -6.925
  129    HG   LEU  19           HG       LEU  19  -7.182  -2.901  -6.256
  130   HD11  LEU  19          1HD1      LEU  19  -8.580  -2.759  -8.733
  131   HD12  LEU  19          2HD1      LEU  19  -7.979  -1.432  -7.710
  132   HD13  LEU  19          3HD1      LEU  19  -6.941  -2.113  -8.985
  133   HD21  LEU  19          3HD2      LEU  19  -8.987  -4.423  -7.605
  134   HD22  LEU  19          1HD2      LEU  19  -7.521  -5.423  -7.749
  135   HD23  LEU  19          2HD2      LEU  19  -8.115  -4.941  -6.142
  136    H    ALA  20           H        ALA  20  -4.067  -3.532  -5.062
  137    HA   ALA  20           HA       ALA  20  -5.424  -1.622  -3.487
  138    HB1  ALA  20           3HB      ALA  20  -3.321  -2.980  -2.052
  139    HB2  ALA  20           1HB      ALA  20  -5.080  -3.240  -1.969
  140    HB3  ALA  20           2HB      ALA  20  -4.106  -4.125  -3.167
  141    H    TRP  21           H        TRP  21  -2.116  -1.933  -4.796
  142    HA   TRP  21           HA       TRP  21  -0.973   0.052  -3.143
  143    HB2  TRP  21           1HB      TRP  21   0.508  -1.469  -4.108
  144    HB3  TRP  21           2HB      TRP  21  -0.186  -1.296  -5.708
  145    HD1  TRP  21           HD       TRP  21   0.427   1.122  -7.007
  146    HE1  TRP  21           1HE      TRP  21   2.560   2.674  -6.935
  147    HE3  TRP  21           3HE      TRP  21   2.252  -0.701  -2.625
  148    HZ2  TRP  21           2HZ      TRP  21   4.723   2.959  -5.096
  149    HZ3  TRP  21           3HZ      TRP  21   4.380   0.269  -1.761
  150    HH2  TRP  21           HH       TRP  21   5.606   2.037  -2.921
  151    H    ASP  22           H        ASP  22  -2.700  -0.013  -6.293
  152    HA   ASP  22           HA       ASP  22  -2.100   2.590  -7.023
  153    HB2  ASP  22           1HB      ASP  22  -4.039   0.479  -7.787
  154    HB3  ASP  22           2HB      ASP  22  -4.643   2.100  -8.066
  155    H    THR  23           H        THR  23  -4.050   1.273  -4.489
  156    HA   THR  23           HA       THR  23  -5.939   3.471  -4.413
  157    HB   THR  23           HB       THR  23  -5.613   0.759  -3.274
  158    HG1  THR  23           1HG      THR  23  -7.814   0.933  -3.764
  159   HG21  THR  23          3HG2      THR  23  -5.466   1.727  -1.084
  160   HG22  THR  23          1HG2      THR  23  -6.504   3.101  -1.536
  161   HG23  THR  23          2HG2      THR  23  -7.212   1.482  -1.328
  162    H    CYS  24           H        CYS  24  -3.662   2.097  -1.944
  163    HA   CYS  24           HA       CYS  24  -3.657   4.531  -0.526
  164    HB2  CYS  24           1HB      CYS  24  -3.144   2.927   0.947
  165    HB3  CYS  24           2HB      CYS  24  -2.452   1.872  -0.269
  166    H    SER  25           H        SER  25  -0.861   2.773  -2.065
  167    HA   SER  25           HA       SER  25   0.533   5.228  -2.331
  168    HB2  SER  25           1HB      SER  25   1.966   3.393  -3.822
  169    HB3  SER  25           2HB      SER  25   2.167   3.668  -2.103
  170    HG   SER  25           HG       SER  25   0.393   1.712  -3.299
  171    H    GLY  26           H        GLY  26  -1.732   5.769  -3.672
  172    HA2  GLY  26           1HA      GLY  26  -0.995   5.474  -6.523
  173    HA3  GLY  26           2HA      GLY  26  -2.646   5.354  -5.947
  174    H    GLY  27           H        GLY  27  -1.034   7.578  -3.958
  175    HA2  GLY  27           1HA      GLY  27  -0.546   9.865  -4.353
  176    HA3  GLY  27           2HA      GLY  27  -1.634   9.859  -5.727
  177    H    THR  28           H        THR  28  -3.871   8.454  -4.569
  178    HA   THR  28           HA       THR  28  -4.618  10.196  -2.325
  179    HB   THR  28           HB       THR  28  -6.775  10.642  -3.462
  180    HG1  THR  28           1HG      THR  28  -6.925   8.685  -4.692
  181   HG21  THR  28          3HG2      THR  28  -5.846  11.644  -5.711
  182   HG22  THR  28          1HG2      THR  28  -5.238  12.326  -4.183
  183   HG23  THR  28          2HG2      THR  28  -4.252  11.154  -5.090
  184    H    GLY  29           H        GLY  29  -7.331   9.194  -2.241
  185    HA2  GLY  29           1HA      GLY  29  -8.528   7.323  -1.695
  186    HA3  GLY  29           2HA      GLY  29  -7.124   6.316  -1.984
  187    H    ASN  30           H        ASN  30  -6.583   5.228  -0.145
  188    HA   ASN  30           HA       ASN  30  -6.847   6.709   2.346
  189    HB2  ASN  30           1HB      ASN  30  -6.557   4.221   3.270
  190    HB3  ASN  30           2HB      ASN  30  -8.113   4.751   2.660
  191   HD21  ASN  30          1HD2      ASN  30  -5.523   2.584   2.340
  192   HD22  ASN  30          2HD2      ASN  30  -6.016   1.750   0.905
  193    H    CYS  31           H        CYS  31  -4.596   7.278   0.727
  194    HA   CYS  31           HA       CYS  31  -2.422   5.591   1.099
  195    HB2  CYS  31           1HB      CYS  31  -1.179   7.198   0.084
  196    HB3  CYS  31           2HB      CYS  31  -2.782   7.670  -0.444
  197    H    GLY  32           H        GLY  32  -1.042   5.277   2.848
  198    HA2  GLY  32           1HA      GLY  32  -0.566   7.197   4.858
  199    HA3  GLY  32           2HA      GLY  32  -1.796   6.079   5.414
  200    H    THR  33           H        THR  33   0.261   5.840   6.974
  201    HA   THR  33           HA       THR  33   2.256   4.046   5.874
  202    HB   THR  33           HB       THR  33   1.804   5.200   8.677
  203    HG1  THR  33           1HG      THR  33   3.632   6.564   7.766
  204   HG21  THR  33          3HG2      THR  33   3.336   3.243   8.735
  205   HG22  THR  33          1HG2      THR  33   4.237   3.895   7.345
  206   HG23  THR  33          2HG2      THR  33   4.271   4.748   8.908
  207    H    VAL  34           H        VAL  34  -0.911   3.724   6.957
  208    HA   VAL  34           HA       VAL  34  -0.500   1.281   8.419
  209    HB   VAL  34           HB       VAL  34  -2.940   2.765   7.435
  210   HG11  VAL  34          1HG1      VAL  34  -2.852   0.310   9.221
  211   HG12  VAL  34          2HG1      VAL  34  -4.300   1.227   8.742
  212   HG13  VAL  34          3HG1      VAL  34  -3.373   0.327   7.519
  213   HG21  VAL  34          3HG2      VAL  34  -2.688   3.984   9.284
  214   HG22  VAL  34          1HG2      VAL  34  -2.832   2.507  10.268
  215   HG23  VAL  34          2HG2      VAL  34  -1.231   3.058   9.718
  216    H    CYS  35           H        CYS  35  -1.296   2.349   5.107
  217    HA   CYS  35           HA       CYS  35  -2.231  -0.100   4.171
  218    HB2  CYS  35           1HB      CYS  35  -2.595   1.113   2.367
  219    HB3  CYS  35           2HB      CYS  35  -1.781   2.462   3.135
  220    H    CYS  36           H        CYS  36   0.906   1.008   5.188
  221    HA   CYS  36           HA       CYS  36   2.603  -0.361   3.528
  222    HB2  CYS  36           1HB      CYS  36   2.917   0.095   6.503
  223    HB3  CYS  36           2HB      CYS  36   4.202  -0.320   5.387
  224    H    GLY  37           H        GLY  37   1.861  -1.477   6.905
  225    HA2  GLY  37           1HA      GLY  37   2.218  -4.237   6.069
  226    HA3  GLY  37           2HA      GLY  37   2.021  -3.624   7.699
  227    H    GLN  38           H        GLN  38  -0.008  -3.209   4.713
  228    HA   GLN  38           HA       GLN  38  -2.176  -4.419   6.246
  229    HB2  GLN  38           1HB      GLN  38  -2.060  -1.783   5.376
  230    HB3  GLN  38           2HB      GLN  38  -2.971  -2.549   4.090
  231    HG2  GLN  38           1HG      GLN  38  -4.540  -1.784   5.797
  232    HG3  GLN  38           2HG      GLN  38  -4.527  -3.537   5.801
  233   HE21  GLN  38          1HE2      GLN  38  -5.420  -3.273   7.940
  234   HE22  GLN  38          2HE2      GLN  38  -4.377  -3.049   9.305
  235    H    CYS  39           H        CYS  39  -0.905  -3.683   2.928
  236    HA   CYS  39           HA       CYS  39  -2.234  -6.141   2.044
  237    HB2  CYS  39           1HB      CYS  39  -1.516  -3.679   0.440
  238    HB3  CYS  39           2HB      CYS  39  -2.156  -5.164  -0.234
  239    H    PHE  40           H        PHE  40   0.719  -4.122   2.168
  240    HA   PHE  40           HA       PHE  40   2.204  -6.397   1.051
  241    HB2  PHE  40           1HB      PHE  40   3.238  -3.540   1.174
  242    HB3  PHE  40           2HB      PHE  40   3.611  -4.775  -0.012
  243    HD1  PHE  40           1HD      PHE  40   1.230  -2.178   0.966
  244    HD2  PHE  40           2HD      PHE  40   2.147  -5.154  -1.916
  245    HE1  PHE  40           1HE      PHE  40  -0.447  -1.171  -0.607
  246    HE2  PHE  40           2HE      PHE  40   0.471  -4.148  -3.489
  247    HZ   PHE  40           HZ       PHE  40  -0.806  -2.168  -2.816
  248    H    SER  41           H        SER  41   4.705  -6.081   1.769
  249    HA   SER  41           HA       SER  41   4.753  -5.254   4.543
  250    HB2  SER  41           1HB      SER  41   6.252  -7.513   4.752
  251    HB3  SER  41           2HB      SER  41   4.545  -7.453   5.141
  252    HG   SER  41           HG       SER  41   4.571  -7.866   2.528
  253    H    PHE  42           H        PHE  42   7.058  -5.050   5.366
  254    HA   PHE  42           HA       PHE  42   8.616  -3.619   3.610
  255    HB2  PHE  42           1HB      PHE  42   8.586  -4.539   6.330
  256    HB3  PHE  42           2HB      PHE  42  10.130  -5.070   5.695
  257    HD1  PHE  42           1HD      PHE  42   7.989  -2.039   5.989
  258    HD2  PHE  42           2HD      PHE  42  11.923  -3.587   5.615
  259    HE1  PHE  42           1HE      PHE  42   8.929   0.261   6.350
  260    HE2  PHE  42           2HE      PHE  42  12.862  -1.287   5.977
  261    HZ   PHE  42           HZ       PHE  42  11.354   0.609   6.340
  262    HA   PRO  43           HA       PRO  43  10.728  -3.241   3.632
  263    HB2  PRO  43           1HB      PRO  43  12.346  -2.615   1.521
  264    HB3  PRO  43           2HB      PRO  43  12.947  -3.293   3.021
  265    HG2  PRO  43           1HG      PRO  43  12.586  -4.616   0.402
  266    HG3  PRO  43           2HG      PRO  43  13.558  -5.130   1.767
  267    HD2  PRO  43           1HD      PRO  43  11.011  -6.189   0.978
  268    HD3  PRO  43           2HD      PRO  43  11.929  -6.621   2.407
  269    H    VAL  44           H        VAL  44   8.698  -4.558   1.579
  270    HA   VAL  44           HA       VAL  44   8.257  -2.403  -0.209
  271    HB   VAL  44           HB       VAL  44   6.180  -4.423   0.563
  272   HG11  VAL  44          1HG1      VAL  44   5.939  -4.415  -1.994
  273   HG12  VAL  44          2HG1      VAL  44   5.435  -2.950  -1.119
  274   HG13  VAL  44          3HG1      VAL  44   6.999  -2.986  -1.968
  275   HG21  VAL  44          3HG2      VAL  44   7.670  -6.088   0.309
  276   HG22  VAL  44          1HG2      VAL  44   7.601  -5.693  -1.426
  277   HG23  VAL  44          2HG2      VAL  44   8.893  -5.011  -0.409
  278    H    SER  45           H        SER  45   7.012  -3.367   3.015
  279    HA   SER  45           HA       SER  45   4.849  -1.734   3.155
  280    HB2  SER  45           1HB      SER  45   4.912  -2.939   5.084
  281    HB3  SER  45           2HB      SER  45   6.658  -3.079   5.046
  282    HG   SER  45           HG       SER  45   6.114  -1.854   6.875
  283    H    GLN  46           H        GLN  46   8.204  -0.878   2.883
  284    HA   GLN  46           HA       GLN  46   7.845   1.684   4.122
  285    HB2  GLN  46           1HB      GLN  46  10.013   0.971   4.521
  286    HB3  GLN  46           2HB      GLN  46  10.135   0.114   2.998
  287    HG2  GLN  46           1HG      GLN  46  10.456   2.185   1.758
  288    HG3  GLN  46           2HG      GLN  46  10.042   3.158   3.156
  289   HE21  GLN  46          1HE2      GLN  46  12.501   1.814   1.360
  290   HE22  GLN  46          2HE2      GLN  46  13.828   1.977   2.461
  291    H    SER  47           H        SER  47   7.641   0.188   0.948
  292    HA   SER  47           HA       SER  47   8.062   2.583  -0.493
  293    HB2  SER  47           1HB      SER  47   6.587   0.121  -1.497
  294    HB3  SER  47           2HB      SER  47   7.490   1.289  -2.441
  295    HG   SER  47           HG       SER  47   8.459  -0.960  -1.675
  296    H    CYS  48           H        CYS  48   5.258   0.784   0.837
  297    HA   CYS  48           HA       CYS  48   3.222   2.014  -0.515
  298    HB2  CYS  48           1HB      CYS  48   2.482   0.285   0.762
  299    HB3  CYS  48           2HB      CYS  48   3.507   0.686   2.125
  300    H    ALA  49           H        ALA  49   4.440   2.890   2.811
  301    HA   ALA  49           HA       ALA  49   3.115   5.331   2.923
  302    HB1  ALA  49           3HB      ALA  49   5.176   3.852   4.418
  303    HB2  ALA  49           1HB      ALA  49   5.360   5.619   4.526
  304    HB3  ALA  49           2HB      ALA  49   3.830   4.853   5.014
  305    H    GLY  50           H        GLY  50   5.827   4.310   1.028
  306    HA2  GLY  50           1HA      GLY  50   7.087   6.898   0.842
  307    HA3  GLY  50           2HA      GLY  50   7.464   5.450  -0.070
  308    H    MET  51           H        MET  51   5.199   4.743  -1.407
  309    HA   MET  51           HA       MET  51   4.959   6.935  -3.236
  310    HB2  MET  51           1HB      MET  51   5.321   4.500  -3.917
  311    HB3  MET  51           2HB      MET  51   3.727   4.124  -3.294
  312    HG2  MET  51           1HG      MET  51   2.851   4.701  -5.308
  313    HG3  MET  51           2HG      MET  51   3.334   6.359  -5.007
  314    HE1  MET  51           3HE      MET  51   3.859   5.526  -8.491
  315    HE2  MET  51           1HE      MET  51   4.252   3.817  -8.186
  316    HE3  MET  51           2HE      MET  51   2.856   4.568  -7.375
  317    H    ALA  52           H        ALA  52   3.595   6.737  -0.412
  318    HA   ALA  52           HA       ALA  52   0.801   6.813  -1.191
  319    HB1  ALA  52           3HB      ALA  52   1.243   5.640   0.836
  320    HB2  ALA  52           1HB      ALA  52   2.312   6.929   1.440
  321    HB3  ALA  52           2HB      ALA  52   0.557   7.206   1.333
  322    H    ASP  53           H        ASP  53   2.912   8.826  -2.124
  323    HA   ASP  53           HA       ASP  53   3.029  10.956  -2.508
  324    HB2  ASP  53           1HB      ASP  53   0.186  10.542  -1.855
  325    HB3  ASP  53           2HB      ASP  53   0.702  12.172  -1.469
  326    H    SER  54           H        SER  54   3.543  13.037  -1.404
  327    HA   SER  54           HA       SER  54   3.770  12.638   1.465
  328    HB2  SER  54           1HB      SER  54   5.507  13.766  -0.600
  329    HB3  SER  54           2HB      SER  54   5.271  14.918   0.699
  330    HG   SER  54           HG       SER  54   7.046  13.101   0.796
  331    H    ASN  55           H        ASN  55   3.883  15.720  -0.404
  332    HA   ASN  55           HA       ASN  55   1.955  16.793   1.427
  333    HB2  ASN  55           1HB      ASN  55   4.186  17.858   0.205
  334    HB3  ASN  55           2HB      ASN  55   2.939  18.440  -0.880
  335   HD21  ASN  55          1HD2      ASN  55   4.454  20.162   0.597
  336   HD22  ASN  55          2HD2      ASN  55   3.499  20.949   1.809
  337    H    ASP  56           H        ASP  56   2.029  15.213  -1.619
  338    HA   ASP  56           HA       ASP  56   0.040  16.714  -2.928
  339    HB2  ASP  56           1HB      ASP  56   1.349  14.017  -3.310
  340    HB3  ASP  56           2HB      ASP  56  -0.113  14.363  -4.212
  341    H    CYS  57           H        CYS  57   0.188  13.940  -0.679
  342    HA   CYS  57           HA       CYS  57  -2.498  13.122  -1.116
  343    HB2  CYS  57           1HB      CYS  57  -0.207  12.184   0.332
  344    HB3  CYS  57           2HB      CYS  57  -1.579  12.241   1.421
  345    HA   PRO  58           HA       PRO  58  -4.416  15.830   1.705
  346    HB2  PRO  58           1HB      PRO  58  -6.456  14.333   2.738
  347    HB3  PRO  58           2HB      PRO  58  -6.524  15.083   1.156
  348    HG2  PRO  58           1HG      PRO  58  -6.107  12.238   1.842
  349    HG3  PRO  58           2HG      PRO  58  -6.596  12.938   0.312
  350    HD2  PRO  58           1HD      PRO  58  -3.993  11.941   0.989
  351    HD3  PRO  58           2HD      PRO  58  -4.453  12.746  -0.498
  352    H    ASN  59           H        ASN  59  -2.099  15.256   2.782
  353    HA   ASN  59           HA       ASN  59  -2.637  14.111   5.361
  354    HB2  ASN  59           1HB      ASN  59  -0.050  15.307   4.234
  355    HB3  ASN  59           2HB      ASN  59  -0.177  14.350   5.697
  356   HD21  ASN  59          1HD2      ASN  59  -1.199  12.172   5.443
  357   HD22  ASN  59          2HD2      ASN  59  -0.771  11.225   4.057
  358    H    ALA  60           H        ALA  60  -1.671  15.388   7.340
  359    HA   ALA  60           HA       ALA  60  -2.919  17.880   7.507
  360    HB1  ALA  60           3HB      ALA  60  -2.306  17.763   9.718
  361    HB2  ALA  60           1HB      ALA  60  -2.021  16.062   9.279
  362    HB3  ALA  60           2HB      ALA  60  -0.657  17.204   9.345
  Start of MODEL   10
    1    H1   ASP   1           H        ASP   1   7.734  -8.651  -7.890
    2    HA   ASP   1           HA       ASP   1   9.399  -7.986  -6.555
    3    HB2  ASP   1           1HB      ASP   1   9.570  -5.831  -8.040
    4    HB3  ASP   1           2HB      ASP   1   8.560  -5.075  -6.824
    5    H    ILE   2           H        ILE   2   6.372  -5.974  -6.542
    6    HA   ILE   2           HA       ILE   2   6.256  -6.160  -3.643
    7    HB   ILE   2           HB       ILE   2   4.893  -4.357  -3.684
    8   HG12  ILE   2          1HG1      ILE   2   3.890  -5.170  -6.428
    9   HG13  ILE   2          2HG1      ILE   2   3.065  -5.440  -4.906
   10   HG21  ILE   2          1HG2      ILE   2   6.077  -3.915  -6.424
   11   HG22  ILE   2          2HG2      ILE   2   5.767  -2.730  -5.132
   12   HG23  ILE   2          3HG2      ILE   2   7.072  -3.926  -4.949
   13   HD11  ILE   2          3HD1      ILE   2   2.107  -3.403  -5.133
   14   HD12  ILE   2          1HD1      ILE   2   3.717  -2.674  -4.918
   15   HD13  ILE   2          2HD1      ILE   2   3.118  -3.044  -6.553
   16    H    GLU   3           H        GLU   3   4.692  -7.378  -6.613
   17    HA   GLU   3           HA       GLU   3   2.410  -8.379  -5.473
   18    HB2  GLU   3           1HB      GLU   3   2.371  -9.934  -7.432
   19    HB3  GLU   3           2HB      GLU   3   2.715  -8.278  -7.889
   20    HG2  GLU   3           1HG      GLU   3   4.583  -9.032  -8.932
   21    HG3  GLU   3           2HG      GLU   3   5.259  -9.372  -7.351
   22    H    ASP   4           H        ASP   4   5.758  -9.548  -5.375
   23    HA   ASP   4           HA       ASP   4   5.092 -12.162  -4.584
   24    HB2  ASP   4           1HB      ASP   4   7.650 -10.538  -4.187
   25    HB3  ASP   4           2HB      ASP   4   7.523 -12.265  -3.916
   26    H    PHE   5           H        PHE   5   4.696  -9.169  -3.083
   27    HA   PHE   5           HA       PHE   5   4.929 -10.385  -0.423
   28    HB2  PHE   5           1HB      PHE   5   5.816  -7.741  -1.617
   29    HB3  PHE   5           2HB      PHE   5   5.208  -7.689   0.026
   30    HD1  PHE   5           1HD      PHE   5   6.418  -8.804   1.836
   31    HD2  PHE   5           2HD      PHE   5   7.922  -8.814  -2.132
   32    HE1  PHE   5           1HE      PHE   5   8.668  -9.518   2.691
   33    HE2  PHE   5           2HE      PHE   5  10.172  -9.528  -1.277
   34    HZ   PHE   5           HZ       PHE   5  10.518  -9.871   1.124
   35    H    TYR   6           H        TYR   6   2.694  -9.919  -2.569
   36    HA   TYR   6           HA       TYR   6   0.974  -8.004  -1.309
   37    HB2  TYR   6           1HB      TYR   6   1.149  -8.741  -3.802
   38    HB3  TYR   6           2HB      TYR   6   0.447 -10.274  -3.324
   39    HD1  TYR   6           2HD      TYR   6  -0.609  -7.022  -1.894
   40    HD2  TYR   6           1HD      TYR   6  -1.517 -10.123  -4.699
   41    HE1  TYR   6           2HE      TYR   6  -2.941  -6.060  -2.215
   42    HE2  TYR   6           1HE      TYR   6  -3.845  -9.150  -5.010
   43    HH   TYR   6           HH       TYR   6  -5.277  -7.670  -4.352
   44    H    THR   7           H        THR   7  -0.493  -8.336   0.298
   45    HA   THR   7           HA       THR   7  -1.054 -11.143   1.001
   46    HB   THR   7           HB       THR   7  -0.930 -10.499   3.304
   47    HG1  THR   7           1HG      THR   7  -1.218  -7.884   2.035
   48   HG21  THR   7          3HG2      THR   7   1.336 -10.216   1.951
   49   HG22  THR   7          1HG2      THR   7   1.043  -8.477   2.186
   50   HG23  THR   7          2HG2      THR   7   1.224  -9.547   3.596
   51    H    SER   8           H        SER   8  -2.900 -11.388  -0.266
   52    HA   SER   8           HA       SER   8  -4.905  -9.423  -0.264
   53    HB2  SER   8           1HB      SER   8  -4.326 -11.782  -1.694
   54    HB3  SER   8           2HB      SER   8  -5.841 -12.136  -0.887
   55    HG   SER   8           HG       SER   8  -6.501  -9.894  -1.751
   56    H    GLU   9           H        GLU   9  -3.838 -11.492   2.164
   57    HA   GLU   9           HA       GLU   9  -6.316 -12.382   3.156
   58    HB2  GLU   9           1HB      GLU   9  -3.640 -12.937   3.665
   59    HB3  GLU   9           2HB      GLU   9  -4.118 -12.082   5.118
   60    HG2  GLU   9           1HG      GLU   9  -6.274 -13.717   4.887
   61    HG3  GLU   9           2HG      GLU   9  -5.101 -14.715   4.050
   62    H    THR  10           H        THR  10  -4.141  -9.587   3.852
   63    HA   THR  10           HA       THR  10  -6.194  -8.530   5.667
   64    HB   THR  10           HB       THR  10  -4.048  -8.642   6.741
   65    HG1  THR  10           1HG      THR  10  -3.763  -6.371   6.996
   66   HG21  THR  10          3HG2      THR  10  -3.042  -7.890   4.009
   67   HG22  THR  10          1HG2      THR  10  -2.179  -7.181   5.395
   68   HG23  THR  10          2HG2      THR  10  -2.301  -8.950   5.232
   69    H    CYS  11           H        CYS  11  -4.613  -8.077   2.545
   70    HA   CYS  11           HA       CYS  11  -5.264  -5.382   2.217
   71    HB2  CYS  11           1HB      CYS  11  -3.651  -6.820   0.867
   72    HB3  CYS  11           2HB      CYS  11  -5.052  -7.419   0.001
   73    HA   PRO  12           HA       PRO  12  -9.564  -5.820   1.577
   74    HB2  PRO  12           1HB      PRO  12 -10.136  -3.317   0.641
   75    HB3  PRO  12           2HB      PRO  12  -9.966  -3.687   2.346
   76    HG2  PRO  12           1HG      PRO  12  -8.079  -2.280   0.558
   77    HG3  PRO  12           2HG      PRO  12  -8.133  -2.288   2.309
   78    HD2  PRO  12           1HD      PRO  12  -6.306  -3.741   0.642
   79    HD3  PRO  12           2HD      PRO  12  -6.436  -3.837   2.387
   80    H    TYR  13           H        TYR  13  -7.306  -5.638  -0.812
   81    HA   TYR  13           HA       TYR  13  -9.402  -6.149  -2.815
   82    HB2  TYR  13           1HB      TYR  13  -6.560  -5.056  -3.233
   83    HB3  TYR  13           2HB      TYR  13  -7.873  -5.016  -4.393
   84    HD1  TYR  13           2HD      TYR  13  -9.899  -3.523  -3.876
   85    HD2  TYR  13           1HD      TYR  13  -6.197  -3.252  -1.750
   86    HE1  TYR  13           2HE      TYR  13 -10.517  -1.187  -3.085
   87    HE2  TYR  13           1HE      TYR  13  -6.827  -0.917  -0.966
   88    HH   TYR  13           HH       TYR  13  -9.591   0.225  -0.751
   89    H    LYS  14           H        LYS  14  -8.972  -7.803  -4.372
   90    HA   LYS  14           HA       LYS  14  -6.560  -9.374  -3.910
   91    HB2  LYS  14           1HB      LYS  14  -7.683 -11.401  -3.527
   92    HB3  LYS  14           2HB      LYS  14  -8.465 -10.245  -2.467
   93    HG2  LYS  14           1HG      LYS  14  -9.508 -11.064  -5.220
   94    HG3  LYS  14           2HG      LYS  14 -10.103 -11.697  -3.699
   95    HD2  LYS  14           1HD      LYS  14 -11.570  -9.967  -3.645
   96    HD3  LYS  14           2HD      LYS  14 -10.209  -8.905  -3.342
   97    HE2  LYS  14           1HE      LYS  14 -11.414  -8.049  -5.279
   98    HE3  LYS  14           2HE      LYS  14  -9.874  -8.675  -5.835
   99    HZ1  LYS  14           3HZ      LYS  14 -10.919 -10.614  -6.608
  100    HZ2  LYS  14           1HZ      LYS  14 -12.332 -10.276  -5.862
  101    HZ3  LYS  14           2HZ      LYS  14 -11.844  -9.375  -7.134
  102    H    ASN  15           H        ASN  15  -7.508  -7.445  -5.975
  103    HA   ASN  15           HA       ASN  15  -8.079  -9.230  -8.172
  104    HB2  ASN  15           1HB      ASN  15  -8.972  -6.676  -7.578
  105    HB3  ASN  15           2HB      ASN  15  -7.664  -6.310  -8.686
  106   HD21  ASN  15          1HD2      ASN  15  -7.640  -7.329 -10.773
  107   HD22  ASN  15          2HD2      ASN  15  -9.120  -7.765 -11.562
  108    H    ASP  16           H        ASP  16  -5.677  -6.817  -6.951
  109    HA   ASP  16           HA       ASP  16  -3.595  -8.166  -8.296
  110    HB2  ASP  16           1HB      ASP  16  -4.843  -5.823  -9.556
  111    HB3  ASP  16           2HB      ASP  16  -3.150  -5.523  -9.215
  112    H    SER  17           H        SER  17  -1.463  -7.296  -7.550
  113    HA   SER  17           HA       SER  17  -1.661  -6.197  -4.973
  114    HB2  SER  17           1HB      SER  17   0.972  -6.047  -5.399
  115    HB3  SER  17           2HB      SER  17   0.180  -7.586  -5.124
  116    HG   SER  17           HG       SER  17   0.438  -8.162  -7.214
  117    H    GLN  18           H        GLN  18  -0.920  -4.944  -8.240
  118    HA   GLN  18           HA       GLN  18   0.100  -2.490  -7.329
  119    HB2  GLN  18           1HB      GLN  18  -0.765  -3.649  -9.962
  120    HB3  GLN  18           2HB      GLN  18  -0.649  -1.904  -9.858
  121    HG2  GLN  18           1HG      GLN  18   1.652  -1.924  -9.622
  122    HG3  GLN  18           2HG      GLN  18   1.654  -3.401  -8.679
  123   HE21  GLN  18          1HE2      GLN  18   1.525  -5.414  -9.701
  124   HE22  GLN  18          2HE2      GLN  18   1.945  -5.641 -11.366
  125    H    LEU  19           H        LEU  19  -3.128  -3.810  -7.856
  126    HA   LEU  19           HA       LEU  19  -4.503  -1.400  -8.222
  127    HB2  LEU  19           1HB      LEU  19  -5.635  -3.322  -8.828
  128    HB3  LEU  19           2HB      LEU  19  -5.220  -4.172  -7.353
  129    HG   LEU  19           HG       LEU  19  -7.645  -3.459  -7.654
  130   HD11  LEU  19          1HD1      LEU  19  -7.985  -3.288  -5.359
  131   HD12  LEU  19          2HD1      LEU  19  -6.408  -4.105  -5.480
  132   HD13  LEU  19          3HD1      LEU  19  -6.483  -2.367  -5.101
  133   HD21  LEU  19          3HD2      LEU  19  -7.191  -0.815  -6.512
  134   HD22  LEU  19          1HD2      LEU  19  -6.535  -0.971  -8.159
  135   HD23  LEU  19          2HD2      LEU  19  -8.251  -1.325  -7.848
  136    H    ALA  20           H        ALA  20  -4.005  -3.404  -5.229
  137    HA   ALA  20           HA       ALA  20  -5.181  -1.555  -3.509
  138    HB1  ALA  20           3HB      ALA  20  -4.079  -2.865  -1.754
  139    HB2  ALA  20           1HB      ALA  20  -4.730  -3.949  -3.007
  140    HB3  ALA  20           2HB      ALA  20  -2.987  -3.593  -2.956
  141    H    TRP  21           H        TRP  21  -1.904  -1.820  -4.905
  142    HA   TRP  21           HA       TRP  21  -0.723   0.058  -3.141
  143    HB2  TRP  21           1HB      TRP  21   0.743  -1.435  -4.165
  144    HB3  TRP  21           2HB      TRP  21   0.048  -1.198  -5.756
  145    HD1  TRP  21           HD       TRP  21   0.691   1.252  -6.974
  146    HE1  TRP  21           1HE      TRP  21   2.840   2.778  -6.850
  147    HE3  TRP  21           3HE      TRP  21   2.492  -0.732  -2.652
  148    HZ2  TRP  21           2HZ      TRP  21   5.004   2.980  -5.000
  149    HZ3  TRP  21           3HZ      TRP  21   4.628   0.187  -1.755
  150    HH2  TRP  21           HH       TRP  21   5.874   1.979  -2.855
  151    H    ASP  22           H        ASP  22  -2.374   0.157  -6.341
  152    HA   ASP  22           HA       ASP  22  -1.756   2.793  -6.911
  153    HB2  ASP  22           1HB      ASP  22  -3.591   0.705  -7.881
  154    HB3  ASP  22           2HB      ASP  22  -4.317   2.296  -8.001
  155    H    THR  23           H        THR  23  -3.739   1.371  -4.477
  156    HA   THR  23           HA       THR  23  -5.668   3.528  -4.354
  157    HB   THR  23           HB       THR  23  -5.302   0.794  -3.303
  158    HG1  THR  23           1HG      THR  23  -7.464   2.769  -3.532
  159   HG21  THR  23          3HG2      THR  23  -5.171   1.614  -1.074
  160   HG22  THR  23          1HG2      THR  23  -6.130   3.064  -1.457
  161   HG23  THR  23          2HG2      THR  23  -6.927   1.478  -1.329
  162    H    CYS  24           H        CYS  24  -3.417   2.142  -1.871
  163    HA   CYS  24           HA       CYS  24  -3.461   4.559  -0.423
  164    HB2  CYS  24           1HB      CYS  24  -2.950   2.975   1.061
  165    HB3  CYS  24           2HB      CYS  24  -2.291   1.899  -0.154
  166    H    SER  25           H        SER  25  -0.638   2.832  -1.948
  167    HA   SER  25           HA       SER  25   0.771   5.285  -2.128
  168    HB2  SER  25           1HB      SER  25   2.173   3.443  -3.680
  169    HB3  SER  25           2HB      SER  25   2.423   3.744  -1.972
  170    HG   SER  25           HG       SER  25   0.710   1.733  -3.155
  171    H    GLY  26           H        GLY  26  -1.487   5.863  -3.479
  172    HA2  GLY  26           1HA      GLY  26  -0.701   5.679  -6.326
  173    HA3  GLY  26           2HA      GLY  26  -2.360   5.513  -5.786
  174    H    GLY  27           H        GLY  27  -0.979   7.667  -3.627
  175    HA2  GLY  27           1HA      GLY  27  -0.534   9.971  -3.806
  176    HA3  GLY  27           2HA      GLY  27  -1.378  10.024  -5.341
  177    H    THR  28           H        THR  28  -3.781   8.657  -4.765
  178    HA   THR  28           HA       THR  28  -4.924  10.307  -2.608
  179    HB   THR  28           HB       THR  28  -6.915  10.564  -4.091
  180    HG1  THR  28           1HG      THR  28  -6.738   9.571  -6.197
  181   HG21  THR  28          3HG2      THR  28  -5.558  11.553  -6.203
  182   HG22  THR  28          1HG2      THR  28  -5.566  12.403  -4.639
  183   HG23  THR  28          2HG2      THR  28  -4.182  11.377  -5.088
  184    H    GLY  29           H        GLY  29  -7.463   9.296  -2.503
  185    HA2  GLY  29           1HA      GLY  29  -8.693   7.369  -2.149
  186    HA3  GLY  29           2HA      GLY  29  -7.249   6.389  -2.319
  187    H    ASN  30           H        ASN  30  -6.159   5.703  -0.494
  188    HA   ASN  30           HA       ASN  30  -6.711   7.144   1.958
  189    HB2  ASN  30           1HB      ASN  30  -6.775   4.689   3.017
  190    HB3  ASN  30           2HB      ASN  30  -8.234   5.399   2.353
  191   HD21  ASN  30          1HD2      ASN  30  -5.916   2.910   2.145
  192   HD22  ASN  30          2HD2      ASN  30  -6.524   2.069   0.759
  193    H    CYS  31           H        CYS  31  -4.366   7.502   0.613
  194    HA   CYS  31           HA       CYS  31  -2.433   5.511   1.011
  195    HB2  CYS  31           1HB      CYS  31  -0.939   6.963   0.076
  196    HB3  CYS  31           2HB      CYS  31  -2.452   7.562  -0.577
  197    H    GLY  32           H        GLY  32  -0.881   5.269   2.702
  198    HA2  GLY  32           1HA      GLY  32  -0.471   7.115   4.774
  199    HA3  GLY  32           2HA      GLY  32  -1.704   5.981   5.290
  200    H    THR  33           H        THR  33   0.377   5.753   6.853
  201    HA   THR  33           HA       THR  33   2.356   3.952   5.734
  202    HB   THR  33           HB       THR  33   1.962   5.029   8.575
  203    HG1  THR  33           1HG      THR  33   3.288   6.734   7.750
  204   HG21  THR  33          3HG2      THR  33   3.611   3.196   8.508
  205   HG22  THR  33          1HG2      THR  33   4.367   3.893   7.055
  206   HG23  THR  33          2HG2      THR  33   4.484   4.744   8.614
  207    H    VAL  34           H        VAL  34  -0.801   3.642   6.842
  208    HA   VAL  34           HA       VAL  34  -0.404   1.220   8.330
  209    HB   VAL  34           HB       VAL  34  -2.828   2.682   7.279
  210   HG11  VAL  34          1HG1      VAL  34  -3.448   0.367   7.327
  211   HG12  VAL  34          2HG1      VAL  34  -2.671   0.130   8.911
  212   HG13  VAL  34          3HG1      VAL  34  -4.134   1.135   8.779
  213   HG21  VAL  34          3HG2      VAL  34  -3.190   3.347   9.555
  214   HG22  VAL  34          1HG2      VAL  34  -1.885   2.284  10.135
  215   HG23  VAL  34          2HG2      VAL  34  -1.496   3.715   9.149
  216    H    CYS  35           H        CYS  35  -1.189   2.219   4.988
  217    HA   CYS  35           HA       CYS  35  -2.064  -0.266   4.092
  218    HB2  CYS  35           1HB      CYS  35  -2.415   0.871   2.233
  219    HB3  CYS  35           2HB      CYS  35  -1.719   2.275   3.017
  220    H    CYS  36           H        CYS  36   1.004   0.848   5.207
  221    HA   CYS  36           HA       CYS  36   2.779  -0.449   3.560
  222    HB2  CYS  36           1HB      CYS  36   2.974  -0.012   6.548
  223    HB3  CYS  36           2HB      CYS  36   4.308  -0.445   5.497
  224    H    GLY  37           H        GLY  37   1.645  -1.617   6.824
  225    HA2  GLY  37           1HA      GLY  37   2.138  -4.373   5.943
  226    HA3  GLY  37           2HA      GLY  37   1.954  -3.805   7.591
  227    H    GLN  38           H        GLN  38  -0.097  -3.213   4.655
  228    HA   GLN  38           HA       GLN  38  -2.259  -4.501   6.132
  229    HB2  GLN  38           1HB      GLN  38  -2.388  -1.943   5.894
  230    HB3  GLN  38           2HB      GLN  38  -2.609  -2.196   4.174
  231    HG2  GLN  38           1HG      GLN  38  -4.823  -2.046   5.057
  232    HG3  GLN  38           2HG      GLN  38  -4.570  -3.757   4.775
  233   HE21  GLN  38          1HE2      GLN  38  -6.475  -2.738   6.521
  234   HE22  GLN  38          2HE2      GLN  38  -6.092  -3.190   8.149
  235    H    CYS  39           H        CYS  39  -0.665  -3.841   2.995
  236    HA   CYS  39           HA       CYS  39  -2.189  -6.091   1.901
  237    HB2  CYS  39           1HB      CYS  39  -1.328  -3.578   0.454
  238    HB3  CYS  39           2HB      CYS  39  -1.985  -5.004  -0.326
  239    H    PHE  40           H        PHE  40   0.834  -4.144   2.056
  240    HA   PHE  40           HA       PHE  40   2.258  -6.465   0.956
  241    HB2  PHE  40           1HB      PHE  40   3.389  -3.649   1.133
  242    HB3  PHE  40           2HB      PHE  40   3.726  -4.876  -0.072
  243    HD1  PHE  40           1HD      PHE  40   1.343  -2.283   0.976
  244    HD2  PHE  40           2HD      PHE  40   2.353  -5.098  -2.034
  245    HE1  PHE  40           1HE      PHE  40  -0.283  -1.190  -0.592
  246    HE2  PHE  40           2HE      PHE  40   0.727  -4.005  -3.602
  247    HZ   PHE  40           HZ       PHE  40  -0.572  -2.064  -2.862
  248    H    SER  41           H        SER  41   4.767  -6.220   1.702
  249    HA   SER  41           HA       SER  41   4.793  -5.465   4.499
  250    HB2  SER  41           1HB      SER  41   4.778  -7.613   5.192
  251    HB3  SER  41           2HB      SER  41   4.738  -8.186   3.536
  252    HG   SER  41           HG       SER  41   6.652  -8.781   5.004
  253    H    PHE  42           H        PHE  42   7.080  -5.284   5.353
  254    HA   PHE  42           HA       PHE  42   8.678  -3.835   3.648
  255    HB2  PHE  42           1HB      PHE  42   8.592  -4.791   6.352
  256    HB3  PHE  42           2HB      PHE  42  10.140  -5.336   5.738
  257    HD1  PHE  42           2HD      PHE  42   8.037  -2.270   5.983
  258    HD2  PHE  42           1HD      PHE  42  11.954  -3.887   5.761
  259    HE1  PHE  42           2HE      PHE  42   9.001   0.011   6.393
  260    HE2  PHE  42           1HE      PHE  42  12.919  -1.606   6.171
  261    HZ   PHE  42           HZ       PHE  42  11.431   0.316   6.482
  262    HA   PRO  43           HA       PRO  43  10.792  -3.474   3.713
  263    HB2  PRO  43           1HB      PRO  43  12.451  -2.825   1.641
  264    HB3  PRO  43           2HB      PRO  43  13.021  -3.532   3.140
  265    HG2  PRO  43           1HG      PRO  43  12.696  -4.809   0.494
  266    HG3  PRO  43           2HG      PRO  43  13.640  -5.353   1.866
  267    HD2  PRO  43           1HD      PRO  43  11.100  -6.379   1.016
  268    HD3  PRO  43           2HD      PRO  43  11.990  -6.842   2.453
  269    H    VAL  44           H        VAL  44   8.774  -4.736   1.626
  270    HA   VAL  44           HA       VAL  44   8.384  -2.555  -0.145
  271    HB   VAL  44           HB       VAL  44   6.278  -4.564   0.574
  272   HG11  VAL  44          1HG1      VAL  44   5.603  -3.012  -1.092
  273   HG12  VAL  44          2HG1      VAL  44   7.152  -3.150  -1.957
  274   HG13  VAL  44          3HG1      VAL  44   6.010  -4.514  -1.955
  275   HG21  VAL  44          3HG2      VAL  44   8.995  -5.181  -0.310
  276   HG22  VAL  44          1HG2      VAL  44   7.706  -6.263   0.269
  277   HG23  VAL  44          2HG2      VAL  44   7.757  -5.777  -1.442
  278    H    SER  45           H        SER  45   7.076  -3.550   3.046
  279    HA   SER  45           HA       SER  45   4.936  -1.885   3.172
  280    HB2  SER  45           1HB      SER  45   4.933  -3.114   5.083
  281    HB3  SER  45           2HB      SER  45   6.674  -3.306   5.067
  282    HG   SER  45           HG       SER  45   5.967  -2.096   6.927
  283    H    GLN  46           H        GLN  46   8.306  -1.081   2.971
  284    HA   GLN  46           HA       GLN  46   7.959   1.469   4.247
  285    HB2  GLN  46           1HB      GLN  46  10.106  -0.185   4.065
  286    HB3  GLN  46           2HB      GLN  46  10.436   0.838   2.681
  287    HG2  GLN  46           1HG      GLN  46   9.928   2.829   4.351
  288    HG3  GLN  46           2HG      GLN  46  10.202   1.631   5.600
  289   HE21  GLN  46          1HE2      GLN  46  11.608   2.866   2.576
  290   HE22  GLN  46          2HE2      GLN  46  13.272   2.768   3.047
  291    H    SER  47           H        SER  47   7.813   0.017   1.052
  292    HA   SER  47           HA       SER  47   8.330   2.414  -0.350
  293    HB2  SER  47           1HB      SER  47   6.819  -0.004  -1.409
  294    HB3  SER  47           2HB      SER  47   7.758   1.156  -2.327
  295    HG   SER  47           HG       SER  47   9.293  -0.027  -0.343
  296    H    CYS  48           H        CYS  48   5.445   0.678   0.886
  297    HA   CYS  48           HA       CYS  48   3.476   1.972  -0.499
  298    HB2  CYS  48           1HB      CYS  48   2.691   0.240   0.763
  299    HB3  CYS  48           2HB      CYS  48   3.657   0.657   2.164
  300    H    ALA  49           H        ALA  49   4.546   2.792   2.890
  301    HA   ALA  49           HA       ALA  49   3.315   5.263   2.977
  302    HB1  ALA  49           3HB      ALA  49   3.988   4.773   5.078
  303    HB2  ALA  49           1HB      ALA  49   5.311   3.732   4.500
  304    HB3  ALA  49           2HB      ALA  49   5.548   5.493   4.613
  305    H    GLY  50           H        GLY  50   6.101   4.198   1.183
  306    HA2  GLY  50           1HA      GLY  50   7.394   6.759   1.016
  307    HA3  GLY  50           2HA      GLY  50   7.751   5.312   0.094
  308    H    MET  51           H        MET  51   5.450   4.683  -1.259
  309    HA   MET  51           HA       MET  51   5.317   6.886  -3.088
  310    HB2  MET  51           1HB      MET  51   5.583   4.420  -3.747
  311    HB3  MET  51           2HB      MET  51   3.950   4.139  -3.176
  312    HG2  MET  51           1HG      MET  51   3.230   4.708  -5.258
  313    HG3  MET  51           2HG      MET  51   3.666   6.362  -4.877
  314    HE1  MET  51           3HE      MET  51   3.355   4.646  -7.323
  315    HE2  MET  51           1HE      MET  51   4.510   5.442  -8.417
  316    HE3  MET  51           2HE      MET  51   4.776   3.755  -7.918
  317    H    ALA  52           H        ALA  52   3.937   6.786  -0.286
  318    HA   ALA  52           HA       ALA  52   1.146   6.929  -1.063
  319    HB1  ALA  52           3HB      ALA  52   0.699   6.713   1.191
  320    HB2  ALA  52           1HB      ALA  52   2.304   5.944   1.137
  321    HB3  ALA  52           2HB      ALA  52   2.143   7.632   1.678
  322    H    ASP  53           H        ASP  53   3.374   8.857  -1.999
  323    HA   ASP  53           HA       ASP  53   3.683  10.987  -2.296
  324    HB2  ASP  53           1HB      ASP  53   1.801  12.222  -2.944
  325    HB3  ASP  53           2HB      ASP  53   1.187  10.583  -3.038
  326    H    SER  54           H        SER  54   2.960  13.385  -1.230
  327    HA   SER  54           HA       SER  54   3.137  12.957   1.651
  328    HB2  SER  54           1HB      SER  54   4.860  14.444  -0.175
  329    HB3  SER  54           2HB      SER  54   4.197  15.522   1.038
  330    HG   SER  54           HG       SER  54   4.875  13.553   2.537
  331    H    ASN  55           H        ASN  55   2.766  15.955  -0.345
  332    HA   ASN  55           HA       ASN  55   0.447  16.584   1.242
  333    HB2  ASN  55           1HB      ASN  55   2.539  18.125   0.295
  334    HB3  ASN  55           2HB      ASN  55   1.333  18.444  -0.935
  335   HD21  ASN  55          1HD2      ASN  55  -0.345  19.738  -0.528
  336   HD22  ASN  55          2HD2      ASN  55  -0.681  20.514   0.984
  337    H    ASP  56           H        ASP  56   1.172  14.928  -1.608
  338    HA   ASP  56           HA       ASP  56  -0.748  16.027  -3.338
  339    HB2  ASP  56           1HB      ASP  56   0.130  13.139  -3.502
  340    HB3  ASP  56           2HB      ASP  56  -0.151  14.274  -4.807
  341    H    CYS  57           H        CYS  57  -0.840  13.973  -0.538
  342    HA   CYS  57           HA       CYS  57  -3.204  12.544  -1.338
  343    HB2  CYS  57           1HB      CYS  57  -1.149  12.100   0.496
  344    HB3  CYS  57           2HB      CYS  57  -2.551  12.434   1.494
  345    HA   PRO  58           HA       PRO  58  -5.939  15.479   0.361
  346    HB2  PRO  58           1HB      PRO  58  -8.124  13.941   0.933
  347    HB3  PRO  58           2HB      PRO  58  -7.753  14.516  -0.680
  348    HG2  PRO  58           1HG      PRO  58  -7.431  11.798   0.439
  349    HG3  PRO  58           2HG      PRO  58  -7.475  12.296  -1.241
  350    HD2  PRO  58           1HD      PRO  58  -5.148  11.582   0.277
  351    HD3  PRO  58           2HD      PRO  58  -5.182  12.190  -1.366
  352    H    ASN  59           H        ASN  59  -4.043  15.263   2.123
  353    HA   ASN  59           HA       ASN  59  -5.380  14.460   4.567
  354    HB2  ASN  59           1HB      ASN  59  -2.471  15.024   3.838
  355    HB3  ASN  59           2HB      ASN  59  -2.971  14.906   5.513
  356   HD21  ASN  59          1HD2      ASN  59  -1.134  13.212   4.204
  357   HD22  ASN  59          2HD2      ASN  59  -1.757  11.596   4.191
  358    H    ALA  60           H        ALA  60  -4.299  16.048   6.506
  359    HA   ALA  60           HA       ALA  60  -5.523  18.553   6.070
  360    HB1  ALA  60           3HB      ALA  60  -4.172  18.955   8.336
  361    HB2  ALA  60           1HB      ALA  60  -5.602  17.896   8.284
  362    HB3  ALA  60           2HB      ALA  60  -3.969  17.189   8.247
  Start of MODEL   11
    1    H1   ASP   1           H        ASP   1   9.757  -5.373  -7.405
    2    HA   ASP   1           HA       ASP   1   8.027  -6.758  -7.397
    3    HB2  ASP   1           1HB      ASP   1  10.414  -7.913  -6.429
    4    HB3  ASP   1           2HB      ASP   1   9.180  -8.544  -5.356
    5    H    ILE   2           H        ILE   2   6.192  -5.800  -6.366
    6    HA   ILE   2           HA       ILE   2   6.061  -5.996  -3.457
    7    HB   ILE   2           HB       ILE   2   4.659  -4.227  -3.475
    8   HG12  ILE   2          1HG1      ILE   2   3.649  -5.225  -6.141
    9   HG13  ILE   2          2HG1      ILE   2   2.795  -5.141  -4.613
   10   HG21  ILE   2          1HG2      ILE   2   5.470  -2.545  -4.917
   11   HG22  ILE   2          2HG2      ILE   2   6.822  -3.679  -4.689
   12   HG23  ILE   2          3HG2      ILE   2   5.873  -3.717  -6.194
   13   HD11  ILE   2          3HD1      ILE   2   3.726  -2.770  -6.294
   14   HD12  ILE   2          1HD1      ILE   2   2.047  -3.302  -6.038
   15   HD13  ILE   2          2HD1      ILE   2   2.982  -2.626  -4.683
   16    H    GLU   3           H        GLU   3   4.582  -7.164  -6.492
   17    HA   GLU   3           HA       GLU   3   2.306  -8.257  -5.460
   18    HB2  GLU   3           1HB      GLU   3   2.442  -9.838  -7.423
   19    HB3  GLU   3           2HB      GLU   3   2.661  -8.152  -7.848
   20    HG2  GLU   3           1HG      GLU   3   5.095  -8.425  -7.955
   21    HG3  GLU   3           2HG      GLU   3   4.990 -10.052  -7.313
   22    H    ASP   4           H        ASP   4   5.673  -9.319  -5.188
   23    HA   ASP   4           HA       ASP   4   5.048 -11.964  -4.457
   24    HB2  ASP   4           1HB      ASP   4   7.399 -10.324  -4.864
   25    HB3  ASP   4           2HB      ASP   4   7.556 -11.119  -3.310
   26    H    PHE   5           H        PHE   5   4.699  -8.912  -2.934
   27    HA   PHE   5           HA       PHE   5   4.729 -10.180  -0.285
   28    HB2  PHE   5           1HB      PHE   5   5.645  -7.498  -1.393
   29    HB3  PHE   5           2HB      PHE   5   5.029  -7.524   0.248
   30    HD1  PHE   5           2HD      PHE   5   7.725  -8.660  -1.960
   31    HD2  PHE   5           1HD      PHE   5   6.272  -8.590   2.027
   32    HE1  PHE   5           2HE      PHE   5   9.974  -9.400  -1.127
   33    HE2  PHE   5           1HE      PHE   5   8.521  -9.330   2.860
   34    HZ   PHE   5           HZ       PHE   5  10.345  -9.726   1.273
   35    H    TYR   6           H        TYR   6   2.607  -9.666  -2.538
   36    HA   TYR   6           HA       TYR   6   0.842  -7.752  -1.347
   37    HB2  TYR   6           1HB      TYR   6   1.044  -8.345  -3.819
   38    HB3  TYR   6           2HB      TYR   6   0.542  -9.984  -3.453
   39    HD1  TYR   6           1HD      TYR   6  -1.245  -7.712  -1.395
   40    HD2  TYR   6           2HD      TYR   6  -1.122  -9.294  -5.368
   41    HE1  TYR   6           1HE      TYR   6  -3.674  -7.047  -1.743
   42    HE2  TYR   6           2HE      TYR   6  -3.551  -8.623  -5.702
   43    HH   TYR   6           HH       TYR   6  -5.194  -7.356  -4.893
   44    H    THR   7           H        THR   7  -0.341  -8.129   0.456
   45    HA   THR   7           HA       THR   7  -1.005 -10.916   1.082
   46    HB   THR   7           HB       THR   7  -1.309 -10.025   3.372
   47    HG1  THR   7           1HG      THR   7  -2.153  -7.928   2.421
   48   HG21  THR   7          3HG2      THR   7   0.929  -9.630   3.849
   49   HG22  THR   7          1HG2      THR   7   1.149 -10.150   2.161
   50   HG23  THR   7          2HG2      THR   7   1.087  -8.416   2.557
   51    H    SER   8           H        SER   8  -2.673 -11.165  -0.501
   52    HA   SER   8           HA       SER   8  -4.814  -9.374  -0.597
   53    HB2  SER   8           1HB      SER   8  -3.969 -11.351  -2.216
   54    HB3  SER   8           2HB      SER   8  -5.181 -12.267  -1.344
   55    HG   SER   8           HG       SER   8  -6.107  -9.755  -2.142
   56    H    GLU   9           H        GLU   9  -3.828 -11.504   1.837
   57    HA   GLU   9           HA       GLU   9  -6.341 -12.533   2.582
   58    HB2  GLU   9           1HB      GLU   9  -3.660 -12.961   3.303
   59    HB3  GLU   9           2HB      GLU   9  -4.377 -12.300   4.759
   60    HG2  GLU   9           1HG      GLU   9  -6.084 -14.326   3.419
   61    HG3  GLU   9           2HG      GLU   9  -4.539 -14.959   3.952
   62    H    THR  10           H        THR  10  -4.228  -9.879   3.890
   63    HA   THR  10           HA       THR  10  -6.464  -8.944   5.509
   64    HB   THR  10           HB       THR  10  -4.386  -9.011   6.696
   65    HG1  THR  10           1HG      THR  10  -5.467  -6.920   6.825
   66   HG21  THR  10          3HG2      THR  10  -2.439  -7.538   5.599
   67   HG22  THR  10          1HG2      THR  10  -2.610  -9.255   5.163
   68   HG23  THR  10          2HG2      THR  10  -3.246  -7.994   4.080
   69    H    CYS  11           H        CYS  11  -4.763  -8.226   2.502
   70    HA   CYS  11           HA       CYS  11  -5.516  -5.547   2.305
   71    HB2  CYS  11           1HB      CYS  11  -3.782  -6.796   0.946
   72    HB3  CYS  11           2HB      CYS  11  -5.102  -7.459   0.004
   73    HA   PRO  12           HA       PRO  12  -9.766  -6.124   1.463
   74    HB2  PRO  12           1HB      PRO  12 -10.415  -3.582   0.698
   75    HB3  PRO  12           2HB      PRO  12 -10.296  -4.077   2.375
   76    HG2  PRO  12           1HG      PRO  12  -8.406  -2.455   0.784
   77    HG3  PRO  12           2HG      PRO  12  -8.529  -2.603   2.526
   78    HD2  PRO  12           1HD      PRO  12  -6.572  -3.840   0.833
   79    HD3  PRO  12           2HD      PRO  12  -6.767  -4.080   2.558
   80    H    TYR  13           H        TYR  13  -7.424  -5.705  -0.797
   81    HA   TYR  13           HA       TYR  13  -9.415  -6.036  -2.941
   82    HB2  TYR  13           1HB      TYR  13  -6.525  -4.963  -2.970
   83    HB3  TYR  13           2HB      TYR  13  -7.607  -4.971  -4.348
   84    HD1  TYR  13           2HD      TYR  13  -9.732  -3.534  -4.229
   85    HD2  TYR  13           1HD      TYR  13  -6.490  -3.140  -1.465
   86    HE1  TYR  13           2HE      TYR  13 -10.548  -1.212  -3.592
   87    HE2  TYR  13           1HE      TYR  13  -7.317  -0.819  -0.838
   88    HH   TYR  13           HH       TYR  13  -9.012   0.991  -2.474
   89    H    LYS  14           H        LYS  14  -8.565  -7.330  -4.847
   90    HA   LYS  14           HA       LYS  14  -6.394  -9.118  -4.270
   91    HB2  LYS  14           1HB      LYS  14  -7.579 -11.139  -4.130
   92    HB3  LYS  14           2HB      LYS  14  -8.403 -10.058  -3.025
   93    HG2  LYS  14           1HG      LYS  14  -9.287 -10.592  -5.901
   94    HG3  LYS  14           2HG      LYS  14  -9.977 -11.371  -4.491
   95    HD2  LYS  14           1HD      LYS  14 -11.430  -9.635  -4.344
   96    HD3  LYS  14           2HD      LYS  14 -10.081  -8.632  -3.848
   97    HE2  LYS  14           1HE      LYS  14 -11.139  -7.547  -5.747
   98    HE3  LYS  14           2HE      LYS  14  -9.589  -8.159  -6.287
   99    HZ1  LYS  14           3HZ      LYS  14 -11.319 -10.210  -6.693
  100    HZ2  LYS  14           1HZ      LYS  14 -12.175  -8.892  -7.139
  101    HZ3  LYS  14           2HZ      LYS  14 -10.732  -9.204  -7.838
  102    H    ASN  15           H        ASN  15  -7.284  -6.986  -6.213
  103    HA   ASN  15           HA       ASN  15  -7.311  -8.688  -8.582
  104    HB2  ASN  15           1HB      ASN  15  -8.692  -6.120  -7.891
  105    HB3  ASN  15           2HB      ASN  15  -8.023  -6.180  -9.510
  106   HD21  ASN  15          1HD2      ASN  15 -10.632  -5.948  -9.367
  107   HD22  ASN  15          2HD2      ASN  15 -11.472  -7.411  -9.758
  108    H    ASP  16           H        ASP  16  -4.832  -8.601  -7.834
  109    HA   ASP  16           HA       ASP  16  -2.866  -8.060  -8.692
  110    HB2  ASP  16           1HB      ASP  16  -4.376  -6.636 -10.446
  111    HB3  ASP  16           2HB      ASP  16  -3.658  -5.295  -9.576
  112    H    SER  17           H        SER  17  -1.180  -7.181  -7.408
  113    HA   SER  17           HA       SER  17  -1.898  -5.838  -5.090
  114    HB2  SER  17           1HB      SER  17   0.582  -5.630  -4.743
  115    HB3  SER  17           2HB      SER  17   0.071  -7.257  -5.148
  116    HG   SER  17           HG       SER  17   1.012  -7.127  -7.128
  117    H    GLN  18           H        GLN  18  -0.963  -4.754  -8.323
  118    HA   GLN  18           HA       GLN  18  -0.075  -2.213  -7.625
  119    HB2  GLN  18           1HB      GLN  18  -1.301  -3.313 -10.188
  120    HB3  GLN  18           2HB      GLN  18  -0.653  -1.689 -10.067
  121    HG2  GLN  18           1HG      GLN  18   1.513  -2.867  -9.137
  122    HG3  GLN  18           2HG      GLN  18   0.830  -4.327  -9.824
  123   HE21  GLN  18          1HE2      GLN  18   2.748  -4.287 -11.149
  124   HE22  GLN  18          2HE2      GLN  18   2.786  -3.361 -12.612
  125    H    LEU  19           H        LEU  19  -3.218  -3.659  -7.552
  126    HA   LEU  19           HA       LEU  19  -4.692  -1.263  -8.048
  127    HB2  LEU  19           1HB      LEU  19  -5.619  -3.424  -8.577
  128    HB3  LEU  19           2HB      LEU  19  -5.454  -3.956  -6.916
  129    HG   LEU  19           HG       LEU  19  -7.094  -2.190  -6.235
  130   HD11  LEU  19          1HD1      LEU  19  -8.542  -1.255  -8.074
  131   HD12  LEU  19          2HD1      LEU  19  -6.898  -0.580  -7.971
  132   HD13  LEU  19          3HD1      LEU  19  -7.290  -1.780  -9.226
  133   HD21  LEU  19          3HD2      LEU  19  -7.982  -4.291  -8.226
  134   HD22  LEU  19          1HD2      LEU  19  -7.858  -4.447  -6.457
  135   HD23  LEU  19          2HD2      LEU  19  -9.086  -3.375  -7.173
  136    H    ALA  20           H        ALA  20  -4.200  -3.304  -5.075
  137    HA   ALA  20           HA       ALA  20  -5.232  -1.372  -3.341
  138    HB1  ALA  20           3HB      ALA  20  -3.152  -3.460  -2.626
  139    HB2  ALA  20           1HB      ALA  20  -4.480  -2.827  -1.624
  140    HB3  ALA  20           2HB      ALA  20  -4.836  -3.896  -3.002
  141    H    TRP  21           H        TRP  21  -2.036  -1.850  -4.824
  142    HA   TRP  21           HA       TRP  21  -0.674  -0.113  -3.025
  143    HB2  TRP  21           1HB      TRP  21   0.682  -1.694  -4.039
  144    HB3  TRP  21           2HB      TRP  21  -0.029  -1.458  -5.623
  145    HD1  TRP  21           HD       TRP  21   0.808   0.817  -6.988
  146    HE1  TRP  21           1HE      TRP  21   3.036   2.230  -6.930
  147    HE3  TRP  21           3HE      TRP  21   2.428  -0.944  -2.501
  148    HZ2  TRP  21           2HZ      TRP  21   5.178   2.447  -5.057
  149    HZ3  TRP  21           3HZ      TRP  21   4.598  -0.081  -1.630
  150    HH2  TRP  21           HH       TRP  21   5.958   1.557  -2.830
  151    H    ASP  22           H        ASP  22  -2.356   0.135  -6.195
  152    HA   ASP  22           HA       ASP  22  -1.510   2.716  -6.764
  153    HB2  ASP  22           1HB      ASP  22  -3.713   0.884  -7.651
  154    HB3  ASP  22           2HB      ASP  22  -3.954   2.587  -7.990
  155    H    THR  23           H        THR  23  -3.542   1.468  -4.300
  156    HA   THR  23           HA       THR  23  -5.306   3.773  -4.177
  157    HB   THR  23           HB       THR  23  -5.147   1.010  -3.087
  158    HG1  THR  23           1HG      THR  23  -6.762   1.837  -4.592
  159   HG21  THR  23          3HG2      THR  23  -5.084   1.962  -0.887
  160   HG22  THR  23          1HG2      THR  23  -6.035   3.381  -1.388
  161   HG23  THR  23          2HG2      THR  23  -6.822   1.792  -1.229
  162    H    CYS  24           H        CYS  24  -3.297   2.160  -1.632
  163    HA   CYS  24           HA       CYS  24  -3.095   4.563  -0.192
  164    HB2  CYS  24           1HB      CYS  24  -2.762   2.943   1.300
  165    HB3  CYS  24           2HB      CYS  24  -2.224   1.796   0.089
  166    H    SER  25           H        SER  25  -0.621   2.587  -2.005
  167    HA   SER  25           HA       SER  25   1.193   4.771  -1.956
  168    HB2  SER  25           1HB      SER  25   2.175   2.935  -3.816
  169    HB3  SER  25           2HB      SER  25   2.567   2.979  -2.109
  170    HG   SER  25           HG       SER  25   1.214   1.308  -1.690
  171    H    GLY  26           H        GLY  26  -0.983   5.893  -3.074
  172    HA2  GLY  26           1HA      GLY  26  -0.289   6.061  -5.939
  173    HA3  GLY  26           2HA      GLY  26  -1.955   5.899  -5.420
  174    H    GLY  27           H        GLY  27  -2.886   7.878  -5.835
  175    HA2  GLY  27           1HA      GLY  27  -1.415  10.285  -4.979
  176    HA3  GLY  27           2HA      GLY  27  -2.693  10.216  -6.176
  177    H    THR  28           H        THR  28  -4.622   8.600  -4.832
  178    HA   THR  28           HA       THR  28  -5.167  10.136  -2.386
  179    HB   THR  28           HB       THR  28  -7.517  10.390  -3.186
  180    HG1  THR  28           1HG      THR  28  -7.289   8.394  -4.559
  181   HG21  THR  28          3HG2      THR  28  -6.944  11.630  -5.474
  182   HG22  THR  28          1HG2      THR  28  -6.360  12.314  -3.938
  183   HG23  THR  28          2HG2      THR  28  -5.259  11.364  -4.965
  184    H    GLY  29           H        GLY  29  -7.745   8.879  -1.986
  185    HA2  GLY  29           1HA      GLY  29  -8.670   6.805  -1.527
  186    HA3  GLY  29           2HA      GLY  29  -7.133   6.025  -1.845
  187    H    ASN  30           H        ASN  30  -6.041   5.266  -0.088
  188    HA   ASN  30           HA       ASN  30  -6.362   6.768   2.379
  189    HB2  ASN  30           1HB      ASN  30  -6.165   4.261   3.401
  190    HB3  ASN  30           2HB      ASN  30  -7.715   4.990   3.029
  191   HD21  ASN  30          1HD2      ASN  30  -8.869   4.374   1.227
  192   HD22  ASN  30          2HD2      ASN  30  -8.529   2.940   0.317
  193    H    CYS  31           H        CYS  31  -4.161   7.436   1.217
  194    HA   CYS  31           HA       CYS  31  -2.099   5.465   1.295
  195    HB2  CYS  31           1HB      CYS  31  -0.693   7.085   0.386
  196    HB3  CYS  31           2HB      CYS  31  -2.261   7.395  -0.333
  197    H    GLY  32           H        GLY  32  -0.518   5.204   2.919
  198    HA2  GLY  32           1HA      GLY  32   0.142   7.031   4.897
  199    HA3  GLY  32           2HA      GLY  32  -1.184   6.078   5.535
  200    H    THR  33           H        THR  33   0.817   5.596   7.058
  201    HA   THR  33           HA       THR  33   2.613   3.607   5.951
  202    HB   THR  33           HB       THR  33   2.295   4.728   8.786
  203    HG1  THR  33           1HG      THR  33   3.876   5.385   6.402
  204   HG21  THR  33          3HG2      THR  33   4.585   3.315   7.321
  205   HG22  THR  33          1HG2      THR  33   4.764   4.155   8.880
  206   HG23  THR  33          2HG2      THR  33   3.724   2.716   8.759
  207    H    VAL  34           H        VAL  34  -0.572   3.590   6.978
  208    HA   VAL  34           HA       VAL  34  -0.495   1.216   8.552
  209    HB   VAL  34           HB       VAL  34  -2.700   2.738   7.157
  210   HG11  VAL  34          1HG1      VAL  34  -2.873   0.329   8.994
  211   HG12  VAL  34          2HG1      VAL  34  -4.248   1.390   8.605
  212   HG13  VAL  34          3HG1      VAL  34  -3.449   0.460   7.315
  213   HG21  VAL  34          3HG2      VAL  34  -2.921   2.703  10.007
  214   HG22  VAL  34          1HG2      VAL  34  -1.257   3.169   9.582
  215   HG23  VAL  34          2HG2      VAL  34  -2.633   4.089   8.928
  216    H    CYS  35           H        CYS  35  -1.165   2.044   5.103
  217    HA   CYS  35           HA       CYS  35  -1.911  -0.530   4.345
  218    HB2  CYS  35           1HB      CYS  35  -2.333   0.504   2.443
  219    HB3  CYS  35           2HB      CYS  35  -1.664   1.971   3.129
  220    H    CYS  36           H        CYS  36   1.090   0.803   5.402
  221    HA   CYS  36           HA       CYS  36   2.944  -0.470   3.834
  222    HB2  CYS  36           1HB      CYS  36   4.471   0.201   5.353
  223    HB3  CYS  36           2HB      CYS  36   3.131   1.207   5.867
  224    H    GLY  37           H        GLY  37   1.340  -1.588   6.905
  225    HA2  GLY  37           1HA      GLY  37   2.141  -4.348   6.206
  226    HA3  GLY  37           2HA      GLY  37   1.919  -3.742   7.835
  227    H    GLN  38           H        GLN  38  -0.142  -3.155   4.918
  228    HA   GLN  38           HA       GLN  38  -2.265  -4.547   6.358
  229    HB2  GLN  38           1HB      GLN  38  -2.238  -1.861   5.827
  230    HB3  GLN  38           2HB      GLN  38  -3.029  -2.447   4.378
  231    HG2  GLN  38           1HG      GLN  38  -4.762  -1.993   6.012
  232    HG3  GLN  38           2HG      GLN  38  -4.652  -3.734   5.838
  233   HE21  GLN  38          1HE2      GLN  38  -5.705  -3.768   7.910
  234   HE22  GLN  38          2HE2      GLN  38  -4.785  -3.632   9.371
  235    H    CYS  39           H        CYS  39  -1.047  -3.501   3.105
  236    HA   CYS  39           HA       CYS  39  -2.401  -5.853   2.005
  237    HB2  CYS  39           1HB      CYS  39  -1.662  -3.215   0.739
  238    HB3  CYS  39           2HB      CYS  39  -2.095  -4.627  -0.204
  239    H    PHE  40           H        PHE  40   0.614  -4.188   2.691
  240    HA   PHE  40           HA       PHE  40   2.043  -6.379   1.383
  241    HB2  PHE  40           1HB      PHE  40   3.176  -3.563   1.495
  242    HB3  PHE  40           2HB      PHE  40   3.494  -4.812   0.307
  243    HD1  PHE  40           2HD      PHE  40   1.218  -2.125   1.297
  244    HD2  PHE  40           1HD      PHE  40   2.017  -5.126  -1.595
  245    HE1  PHE  40           2HE      PHE  40  -0.420  -1.050  -0.272
  246    HE2  PHE  40           1HE      PHE  40   0.379  -4.051  -3.164
  247    HZ   PHE  40           HZ       PHE  40  -0.820  -2.025  -2.483
  248    H    SER  41           H        SER  41   4.606  -5.905   2.095
  249    HA   SER  41           HA       SER  41   4.660  -5.089   4.846
  250    HB2  SER  41           1HB      SER  41   5.986  -7.406   5.228
  251    HB3  SER  41           2HB      SER  41   4.264  -7.252   5.515
  252    HG   SER  41           HG       SER  41   4.355  -7.808   2.956
  253    H    PHE  42           H        PHE  42   6.953  -4.937   5.661
  254    HA   PHE  42           HA       PHE  42   8.610  -3.736   3.830
  255    HB2  PHE  42           1HB      PHE  42   8.502  -4.447   6.604
  256    HB3  PHE  42           2HB      PHE  42  10.008  -5.136   6.033
  257    HD1  PHE  42           1HD      PHE  42   8.097  -1.948   6.128
  258    HD2  PHE  42           2HD      PHE  42  11.905  -3.793   5.810
  259    HE1  PHE  42           1HE      PHE  42   9.201   0.297   6.330
  260    HE2  PHE  42           2HE      PHE  42  13.010  -1.548   6.012
  261    HZ   PHE  42           HZ       PHE  42  11.645   0.470   6.269
  262    HA   PRO  43           HA       PRO  43  10.737  -3.482   3.841
  263    HB2  PRO  43           1HB      PRO  43  12.398  -3.102   1.705
  264    HB3  PRO  43           2HB      PRO  43  12.952  -3.705   3.254
  265    HG2  PRO  43           1HG      PRO  43  12.525  -5.188   0.732
  266    HG3  PRO  43           2HG      PRO  43  13.460  -5.659   2.138
  267    HD2  PRO  43           1HD      PRO  43  10.859  -6.622   1.405
  268    HD3  PRO  43           2HD      PRO  43  11.744  -7.004   2.868
  269    H    VAL  44           H        VAL  44   8.635  -4.817   1.881
  270    HA   VAL  44           HA       VAL  44   8.330  -2.777  -0.064
  271    HB   VAL  44           HB       VAL  44   6.136  -4.610   0.840
  272   HG11  VAL  44          1HG1      VAL  44   7.037  -3.408  -1.784
  273   HG12  VAL  44          2HG1      VAL  44   5.893  -4.770  -1.711
  274   HG13  VAL  44          3HG1      VAL  44   5.479  -3.217  -0.945
  275   HG21  VAL  44          3HG2      VAL  44   7.506  -6.080  -1.064
  276   HG22  VAL  44          1HG2      VAL  44   8.810  -5.428  -0.042
  277   HG23  VAL  44          2HG2      VAL  44   7.500  -6.386   0.690
  278    H    SER  45           H        SER  45   6.999  -3.438   3.205
  279    HA   SER  45           HA       SER  45   4.947  -1.670   3.212
  280    HB2  SER  45           1HB      SER  45   4.970  -2.812   5.195
  281    HB3  SER  45           2HB      SER  45   6.719  -2.912   5.238
  282    HG   SER  45           HG       SER  45   6.734  -0.621   5.898
  283    H    GLN  46           H        GLN  46   8.414  -1.064   3.137
  284    HA   GLN  46           HA       GLN  46   8.252   1.561   4.170
  285    HB2  GLN  46           1HB      GLN  46  10.296  -0.106   3.980
  286    HB3  GLN  46           2HB      GLN  46  10.492   0.589   2.383
  287    HG2  GLN  46           1HG      GLN  46  10.199   2.889   3.816
  288    HG3  GLN  46           2HG      GLN  46  10.868   1.867   5.072
  289   HE21  GLN  46          1HE2      GLN  46  11.578   3.945   2.624
  290   HE22  GLN  46          2HE2      GLN  46  13.222   3.518   2.283
  291    H    SER  47           H        SER  47   7.906   0.027   0.989
  292    HA   SER  47           HA       SER  47   8.243   2.445  -0.442
  293    HB2  SER  47           1HB      SER  47   6.747   0.071  -1.557
  294    HB3  SER  47           2HB      SER  47   7.856   1.156  -2.372
  295    HG   SER  47           HG       SER  47   9.475   0.145  -0.692
  296    H    CYS  48           H        CYS  48   5.509   0.533   0.888
  297    HA   CYS  48           HA       CYS  48   3.425   1.745  -0.407
  298    HB2  CYS  48           1HB      CYS  48   2.755  -0.048   0.824
  299    HB3  CYS  48           2HB      CYS  48   3.773   0.351   2.193
  300    H    ALA  49           H        ALA  49   5.242   2.723   2.569
  301    HA   ALA  49           HA       ALA  49   3.655   5.070   2.943
  302    HB1  ALA  49           3HB      ALA  49   4.585   4.081   4.892
  303    HB2  ALA  49           1HB      ALA  49   6.201   3.955   4.158
  304    HB3  ALA  49           2HB      ALA  49   5.554   5.549   4.616
  305    H    GLY  50           H        GLY  50   6.419   4.128   1.004
  306    HA2  GLY  50           1HA      GLY  50   7.540   6.752   0.730
  307    HA3  GLY  50           2HA      GLY  50   7.918   5.320  -0.207
  308    H    MET  51           H        MET  51   5.606   4.556  -1.439
  309    HA   MET  51           HA       MET  51   5.222   6.755  -3.240
  310    HB2  MET  51           1HB      MET  51   5.608   4.216  -3.808
  311    HB3  MET  51           2HB      MET  51   3.928   3.986  -3.366
  312    HG2  MET  51           1HG      MET  51   4.061   4.324  -5.788
  313    HG3  MET  51           2HG      MET  51   3.257   5.708  -5.074
  314    HE1  MET  51           3HE      MET  51   4.790   6.766  -8.061
  315    HE2  MET  51           1HE      MET  51   6.211   5.695  -8.015
  316    HE3  MET  51           2HE      MET  51   4.591   5.038  -7.681
  317    H    ALA  52           H        ALA  52   4.030   6.693  -0.412
  318    HA   ALA  52           HA       ALA  52   1.193   6.496  -0.963
  319    HB1  ALA  52           3HB      ALA  52   2.882   6.164   1.286
  320    HB2  ALA  52           1HB      ALA  52   1.885   7.598   1.627
  321    HB3  ALA  52           2HB      ALA  52   1.107   6.046   1.237
  322    H    ASP  53           H        ASP  53   2.450   8.394  -2.623
  323    HA   ASP  53           HA       ASP  53   2.345  10.461  -3.269
  324    HB2  ASP  53           1HB      ASP  53  -0.133   9.985  -2.694
  325    HB3  ASP  53           2HB      ASP  53   0.131  10.892  -1.218
  326    H    SER  54           H        SER  54   2.401  12.922  -2.422
  327    HA   SER  54           HA       SER  54   4.018  12.866  -0.008
  328    HB2  SER  54           1HB      SER  54   4.115  14.371  -2.554
  329    HB3  SER  54           2HB      SER  54   4.340  15.389  -1.146
  330    HG   SER  54           HG       SER  54   6.104  13.645  -2.298
  331    H    ASN  55           H        ASN  55   2.436  15.732  -1.485
  332    HA   ASN  55           HA       ASN  55   0.921  15.980   0.993
  333    HB2  ASN  55           1HB      ASN  55   2.737  17.772  -0.133
  334    HB3  ASN  55           2HB      ASN  55   1.214  18.392  -0.739
  335   HD21  ASN  55          1HD2      ASN  55   1.003  20.175   0.459
  336   HD22  ASN  55          2HD2      ASN  55   0.848  20.223   2.183
  337    H    ASP  56           H        ASP  56   0.777  15.291  -2.346
  338    HA   ASP  56           HA       ASP  56  -1.564  16.711  -2.998
  339    HB2  ASP  56           1HB      ASP  56  -0.406  14.187  -4.271
  340    HB3  ASP  56           2HB      ASP  56  -1.582  15.253  -5.012
  341    H    CYS  57           H        CYS  57  -0.975  14.176  -0.864
  342    HA   CYS  57           HA       CYS  57  -3.217  12.529  -1.540
  343    HB2  CYS  57           1HB      CYS  57  -0.883  12.236  -0.010
  344    HB3  CYS  57           2HB      CYS  57  -2.198  12.154   1.145
  345    HA   PRO  58           HA       PRO  58  -6.086  14.753   0.868
  346    HB2  PRO  58           1HB      PRO  58  -7.935  12.826   1.446
  347    HB3  PRO  58           2HB      PRO  58  -7.868  13.659  -0.094
  348    HG2  PRO  58           1HG      PRO  58  -7.019  10.905   0.562
  349    HG3  PRO  58           2HG      PRO  58  -7.357  11.604  -1.009
  350    HD2  PRO  58           1HD      PRO  58  -4.771  11.077   0.114
  351    HD3  PRO  58           2HD      PRO  58  -5.109  11.882  -1.405
  352    H    ASN  59           H        ASN  59  -3.970  14.632   2.358
  353    HA   ASN  59           HA       ASN  59  -4.703  13.201   4.746
  354    HB2  ASN  59           1HB      ASN  59  -2.233  14.628   3.732
  355    HB3  ASN  59           2HB      ASN  59  -2.409  14.432   5.464
  356   HD21  ASN  59          1HD2      ASN  59  -3.323  12.125   6.027
  357   HD22  ASN  59          2HD2      ASN  59  -2.445  10.800   5.339
  358    H    ALA  60           H        ALA  60  -4.441  14.486   6.910
  359    HA   ALA  60           HA       ALA  60  -5.284  16.069   8.221
  360    HB1  ALA  60           3HB      ALA  60  -4.302  18.264   6.461
  361    HB2  ALA  60           1HB      ALA  60  -3.988  17.952   8.185
  362    HB3  ALA  60           2HB      ALA  60  -3.098  17.044   6.940
  Start of MODEL   12
    1    H1   ASP   1           H        ASP   1   9.871  -5.059  -7.081
    2    HA   ASP   1           HA       ASP   1   8.131  -6.313  -7.394
    3    HB2  ASP   1           1HB      ASP   1   9.285  -8.467  -5.593
    4    HB3  ASP   1           2HB      ASP   1   8.303  -8.672  -7.030
    5    H    ILE   2           H        ILE   2   6.189  -5.783  -6.382
    6    HA   ILE   2           HA       ILE   2   6.119  -5.933  -3.460
    7    HB   ILE   2           HB       ILE   2   4.700  -4.179  -3.452
    8   HG12  ILE   2          1HG1      ILE   2   3.695  -5.016  -6.187
    9   HG13  ILE   2          2HG1      ILE   2   2.886  -5.267  -4.653
   10   HG21  ILE   2          1HG2      ILE   2   5.814  -3.602  -6.194
   11   HG22  ILE   2          2HG2      ILE   2   5.505  -2.482  -4.845
   12   HG23  ILE   2          3HG2      ILE   2   6.850  -3.644  -4.747
   13   HD11  ILE   2          3HD1      ILE   2   2.110  -3.241  -6.044
   14   HD12  ILE   2          1HD1      ILE   2   2.500  -2.921  -4.338
   15   HD13  ILE   2          2HD1      ILE   2   3.662  -2.484  -5.613
   16    H    GLU   3           H        GLU   3   4.607  -7.093  -6.485
   17    HA   GLU   3           HA       GLU   3   2.364  -8.225  -5.421
   18    HB2  GLU   3           1HB      GLU   3   2.503  -9.797  -7.404
   19    HB3  GLU   3           2HB      GLU   3   2.649  -8.099  -7.810
   20    HG2  GLU   3           1HG      GLU   3   5.106  -8.292  -7.939
   21    HG3  GLU   3           2HG      GLU   3   5.039  -9.953  -7.386
   22    H    ASP   4           H        ASP   4   5.747  -9.232  -5.201
   23    HA   ASP   4           HA       ASP   4   5.182 -11.900  -4.508
   24    HB2  ASP   4           1HB      ASP   4   7.638 -10.172  -3.942
   25    HB3  ASP   4           2HB      ASP   4   7.581 -11.913  -3.754
   26    H    PHE   5           H        PHE   5   4.781  -8.881  -2.934
   27    HA   PHE   5           HA       PHE   5   4.847 -10.193  -0.308
   28    HB2  PHE   5           1HB      PHE   5   5.758  -7.500  -1.380
   29    HB3  PHE   5           2HB      PHE   5   5.109  -7.525   0.248
   30    HD1  PHE   5           1HD      PHE   5   6.263  -8.790   2.024
   31    HD2  PHE   5           2HD      PHE   5   7.906  -8.456  -1.874
   32    HE1  PHE   5           1HE      PHE   5   8.496  -9.524   2.902
   33    HE2  PHE   5           2HE      PHE   5  10.139  -9.190  -0.996
   34    HZ   PHE   5           HZ       PHE   5  10.408  -9.715   1.382
   35    H    TYR   6           H        TYR   6   2.712  -9.649  -2.546
   36    HA   TYR   6           HA       TYR   6   0.933  -7.779  -1.308
   37    HB2  TYR   6           1HB      TYR   6   1.108  -8.296  -3.787
   38    HB3  TYR   6           2HB      TYR   6   0.675  -9.964  -3.469
   39    HD1  TYR   6           1HD      TYR   6  -1.133  -7.649  -1.402
   40    HD2  TYR   6           2HD      TYR   6  -1.082  -9.463  -5.277
   41    HE1  TYR   6           1HE      TYR   6  -3.590  -7.073  -1.713
   42    HE2  TYR   6           2HE      TYR   6  -3.539  -8.881  -5.574
   43    HH   TYR   6           HH       TYR   6  -5.423  -7.614  -2.927
   44    H    THR   7           H        THR   7  -0.431  -8.168   0.360
   45    HA   THR   7           HA       THR   7  -1.017 -10.986   0.967
   46    HB   THR   7           HB       THR   7  -1.303 -10.171   3.284
   47    HG1  THR   7           1HG      THR   7  -2.157  -8.046   2.426
   48   HG21  THR   7          3HG2      THR   7   0.934  -9.682   3.785
   49   HG22  THR   7          1HG2      THR   7   1.140 -10.328   2.139
   50   HG23  THR   7          2HG2      THR   7   1.101  -8.568   2.406
   51    H    SER   8           H        SER   8  -2.716 -11.250  -0.541
   52    HA   SER   8           HA       SER   8  -4.838  -9.418  -0.614
   53    HB2  SER   8           1HB      SER   8  -4.007 -11.408  -2.254
   54    HB3  SER   8           2HB      SER   8  -5.273 -12.279  -1.412
   55    HG   SER   8           HG       SER   8  -6.823 -10.980  -2.265
   56    H    GLU   9           H        GLU   9  -3.844 -11.534   1.803
   57    HA   GLU   9           HA       GLU   9  -6.358 -12.588   2.539
   58    HB2  GLU   9           1HB      GLU   9  -3.686 -13.062   3.223
   59    HB3  GLU   9           2HB      GLU   9  -4.354 -12.381   4.693
   60    HG2  GLU   9           1HG      GLU   9  -6.372 -14.121   3.979
   61    HG3  GLU   9           2HG      GLU   9  -4.976 -14.973   3.350
   62    H    THR  10           H        THR  10  -4.231  -9.945   3.842
   63    HA   THR  10           HA       THR  10  -6.455  -9.025   5.492
   64    HB   THR  10           HB       THR  10  -4.364  -9.142   6.666
   65    HG1  THR  10           1HG      THR  10  -4.489  -6.461   5.493
   66   HG21  THR  10          3HG2      THR  10  -2.412  -7.660   5.635
   67   HG22  THR  10          1HG2      THR  10  -2.616  -9.337   5.076
   68   HG23  THR  10          2HG2      THR  10  -3.237  -7.990   4.092
   69    H    CYS  11           H        CYS  11  -4.754  -8.285   2.493
   70    HA   CYS  11           HA       CYS  11  -5.472  -5.595   2.332
   71    HB2  CYS  11           1HB      CYS  11  -3.754  -6.792   0.950
   72    HB3  CYS  11           2HB      CYS  11  -5.061  -7.518   0.036
   73    HA   PRO  12           HA       PRO  12  -9.734  -6.098   1.509
   74    HB2  PRO  12           1HB      PRO  12 -10.350  -3.538   0.778
   75    HB3  PRO  12           2HB      PRO  12 -10.229  -4.055   2.448
   76    HG2  PRO  12           1HG      PRO  12  -8.324  -2.442   0.864
   77    HG3  PRO  12           2HG      PRO  12  -8.439  -2.609   2.605
   78    HD2  PRO  12           1HD      PRO  12  -6.511  -3.855   0.885
   79    HD3  PRO  12           2HD      PRO  12  -6.699  -4.111   2.608
   80    H    TYR  13           H        TYR  13  -7.403  -5.757  -0.750
   81    HA   TYR  13           HA       TYR  13  -9.407  -5.956  -2.897
   82    HB2  TYR  13           1HB      TYR  13  -6.481  -4.990  -2.794
   83    HB3  TYR  13           2HB      TYR  13  -7.405  -5.099  -4.279
   84    HD1  TYR  13           2HD      TYR  13  -9.415  -3.600  -4.600
   85    HD2  TYR  13           1HD      TYR  13  -6.692  -3.111  -1.337
   86    HE1  TYR  13           2HE      TYR  13 -10.271  -1.235  -4.231
   87    HE2  TYR  13           1HE      TYR  13  -7.557  -0.747  -0.979
   88    HH   TYR  13           HH       TYR  13  -8.817   1.014  -2.873
   89    H    LYS  14           H        LYS  14  -8.643  -7.293  -4.809
   90    HA   LYS  14           HA       LYS  14  -6.596  -9.224  -4.247
   91    HB2  LYS  14           1HB      LYS  14  -7.929 -11.172  -4.151
   92    HB3  LYS  14           2HB      LYS  14  -8.614 -10.061  -2.982
   93    HG2  LYS  14           1HG      LYS  14  -9.657 -10.423  -5.831
   94    HG3  LYS  14           2HG      LYS  14 -10.347 -11.200  -4.420
   95    HD2  LYS  14           1HD      LYS  14 -11.653  -9.362  -4.157
   96    HD3  LYS  14           2HD      LYS  14 -10.211  -8.492  -3.671
   97    HE2  LYS  14           1HE      LYS  14 -11.117  -7.197  -5.461
   98    HE3  LYS  14           2HE      LYS  14  -9.777  -8.066  -6.183
   99    HZ1  LYS  14           3HZ      LYS  14 -11.421  -8.525  -7.641
  100    HZ2  LYS  14           1HZ      LYS  14 -11.644  -9.797  -6.641
  101    HZ3  LYS  14           2HZ      LYS  14 -12.620  -8.492  -6.533
  102    H    ASN  15           H        ASN  15  -7.181  -7.058  -6.174
  103    HA   ASN  15           HA       ASN  15  -7.273  -8.750  -8.544
  104    HB2  ASN  15           1HB      ASN  15  -8.750  -6.214  -7.897
  105    HB3  ASN  15           2HB      ASN  15  -8.091  -6.311  -9.518
  106   HD21  ASN  15          1HD2      ASN  15 -10.744  -6.162  -9.230
  107   HD22  ASN  15          2HD2      ASN  15 -11.529  -7.659  -9.609
  108    H    ASP  16           H        ASP  16  -4.817  -8.627  -7.929
  109    HA   ASP  16           HA       ASP  16  -2.881  -7.979  -8.767
  110    HB2  ASP  16           1HB      ASP  16  -4.480  -6.487 -10.404
  111    HB3  ASP  16           2HB      ASP  16  -3.726  -5.192  -9.496
  112    H    SER  17           H        SER  17  -1.213  -7.152  -7.436
  113    HA   SER  17           HA       SER  17  -1.950  -5.896  -5.068
  114    HB2  SER  17           1HB      SER  17   0.554  -5.686  -4.731
  115    HB3  SER  17           2HB      SER  17  -0.001  -7.307  -5.096
  116    HG   SER  17           HG       SER  17   0.522  -6.078  -7.459
  117    H    GLN  18           H        GLN  18  -1.155  -4.703  -8.264
  118    HA   GLN  18           HA       GLN  18  -0.181  -2.196  -7.483
  119    HB2  GLN  18           1HB      GLN  18  -1.311  -3.339 -10.052
  120    HB3  GLN  18           2HB      GLN  18  -0.943  -1.629  -9.940
  121    HG2  GLN  18           1HG      GLN  18   1.397  -2.086  -9.413
  122    HG3  GLN  18           2HG      GLN  18   1.079  -3.799  -9.223
  123   HE21  GLN  18          1HE2      GLN  18   1.143  -1.115 -11.498
  124   HE22  GLN  18          2HE2      GLN  18   1.389  -2.036 -12.945
  125    H    LEU  19           H        LEU  19  -3.374  -3.624  -7.629
  126    HA   LEU  19           HA       LEU  19  -4.821  -1.214  -7.981
  127    HB2  LEU  19           1HB      LEU  19  -5.807  -3.298  -8.574
  128    HB3  LEU  19           2HB      LEU  19  -5.547  -3.961  -6.973
  129    HG   LEU  19           HG       LEU  19  -7.152  -2.240  -6.074
  130   HD11  LEU  19          1HD1      LEU  19  -8.557  -0.984  -7.510
  131   HD12  LEU  19          2HD1      LEU  19  -6.888  -0.698  -8.059
  132   HD13  LEU  19          3HD1      LEU  19  -7.943  -1.813  -8.961
  133   HD21  LEU  19          3HD2      LEU  19  -9.195  -3.405  -7.141
  134   HD22  LEU  19          1HD2      LEU  19  -7.991  -4.386  -8.011
  135   HD23  LEU  19          2HD2      LEU  19  -8.024  -4.391  -6.232
  136    H    ALA  20           H        ALA  20  -4.085  -3.271  -5.076
  137    HA   ALA  20           HA       ALA  20  -5.189  -1.382  -3.284
  138    HB1  ALA  20           3HB      ALA  20  -3.128  -3.514  -2.641
  139    HB2  ALA  20           1HB      ALA  20  -4.423  -2.875  -1.600
  140    HB3  ALA  20           2HB      ALA  20  -4.828  -3.912  -2.989
  141    H    TRP  21           H        TRP  21  -2.010  -1.876  -4.803
  142    HA   TRP  21           HA       TRP  21  -0.612  -0.186  -2.990
  143    HB2  TRP  21           1HB      TRP  21   0.720  -1.758  -4.044
  144    HB3  TRP  21           2HB      TRP  21  -0.011  -1.496  -5.615
  145    HD1  TRP  21           HD       TRP  21   0.875   0.715  -7.008
  146    HE1  TRP  21           1HE      TRP  21   3.098   2.135  -6.947
  147    HE3  TRP  21           3HE      TRP  21   2.427  -0.941  -2.458
  148    HZ2  TRP  21           2HZ      TRP  21   5.209   2.400  -5.045
  149    HZ3  TRP  21           3HZ      TRP  21   4.581  -0.051  -1.572
  150    HH2  TRP  21           HH       TRP  21   5.956   1.563  -2.787
  151    H    ASP  22           H        ASP  22  -2.119   0.133  -6.267
  152    HA   ASP  22           HA       ASP  22  -1.330   2.778  -6.617
  153    HB2  ASP  22           1HB      ASP  22  -2.067   1.381  -8.491
  154    HB3  ASP  22           2HB      ASP  22  -3.645   1.155  -7.764
  155    H    THR  23           H        THR  23  -3.523   1.322  -4.438
  156    HA   THR  23           HA       THR  23  -5.490   3.439  -4.440
  157    HB   THR  23           HB       THR  23  -5.094   0.729  -3.293
  158    HG1  THR  23           1HG      THR  23  -7.158   0.743  -4.148
  159   HG21  THR  23          3HG2      THR  23  -6.540   1.057  -1.362
  160   HG22  THR  23          1HG2      THR  23  -5.193   2.208  -1.186
  161   HG23  THR  23          2HG2      THR  23  -6.779   2.774  -1.764
  162    H    CYS  24           H        CYS  24  -2.951   2.227  -2.152
  163    HA   CYS  24           HA       CYS  24  -3.261   4.686  -0.659
  164    HB2  CYS  24           1HB      CYS  24  -2.958   3.191   0.965
  165    HB3  CYS  24           2HB      CYS  24  -2.267   1.999  -0.118
  166    H    SER  25           H        SER  25  -0.582   2.733  -2.180
  167    HA   SER  25           HA       SER  25   1.160   4.956  -2.115
  168    HB2  SER  25           1HB      SER  25   2.264   3.135  -3.915
  169    HB3  SER  25           2HB      SER  25   2.565   3.182  -2.189
  170    HG   SER  25           HG       SER  25   1.035   1.577  -1.830
  171    H    GLY  26           H        GLY  26  -0.930   6.086  -3.321
  172    HA2  GLY  26           1HA      GLY  26  -0.131   6.237  -6.156
  173    HA3  GLY  26           2HA      GLY  26  -1.816   6.040  -5.717
  174    H    GLY  27           H        GLY  27  -2.976   7.909  -5.669
  175    HA2  GLY  27           1HA      GLY  27  -1.504  10.417  -5.185
  176    HA3  GLY  27           2HA      GLY  27  -3.003  10.246  -6.076
  177    H    THR  28           H        THR  28  -4.705   8.812  -4.511
  178    HA   THR  28           HA       THR  28  -4.635  10.048  -1.854
  179    HB   THR  28           HB       THR  28  -6.957  10.822  -2.153
  180    HG1  THR  28           1HG      THR  28  -7.498   9.029  -3.642
  181   HG21  THR  28          3HG2      THR  28  -5.104  11.545  -4.474
  182   HG22  THR  28          1HG2      THR  28  -6.702  12.298  -4.262
  183   HG23  THR  28          2HG2      THR  28  -5.447  12.510  -3.018
  184    H    GLY  29           H        GLY  29  -7.419   9.082  -1.383
  185    HA2  GLY  29           1HA      GLY  29  -8.545   7.078  -1.099
  186    HA3  GLY  29           2HA      GLY  29  -7.132   6.184  -1.624
  187    H    ASN  30           H        ASN  30  -6.682   4.817   0.080
  188    HA   ASN  30           HA       ASN  30  -6.728   5.978   2.730
  189    HB2  ASN  30           1HB      ASN  30  -6.292   3.473   3.362
  190    HB3  ASN  30           2HB      ASN  30  -7.870   3.885   2.721
  191   HD21  ASN  30          1HD2      ASN  30  -5.008   2.086   2.323
  192   HD22  ASN  30          2HD2      ASN  30  -5.356   1.325   0.807
  193    H    CYS  31           H        CYS  31  -4.629   6.867   0.986
  194    HA   CYS  31           HA       CYS  31  -2.325   5.266   1.226
  195    HB2  CYS  31           1HB      CYS  31  -1.147   7.065   0.257
  196    HB3  CYS  31           2HB      CYS  31  -2.717   7.005  -0.518
  197    H    GLY  32           H        GLY  32  -0.861   5.126   2.922
  198    HA2  GLY  32           1HA      GLY  32  -0.296   7.173   4.742
  199    HA3  GLY  32           2HA      GLY  32  -1.530   6.154   5.455
  200    H    THR  33           H        THR  33   0.422   5.860   7.019
  201    HA   THR  33           HA       THR  33   2.444   4.037   6.019
  202    HB   THR  33           HB       THR  33   1.914   5.221   8.796
  203    HG1  THR  33           1HG      THR  33   3.759   6.594   7.900
  204   HG21  THR  33          3HG2      THR  33   4.400   4.824   9.047
  205   HG22  THR  33          1HG2      THR  33   3.478   3.308   8.919
  206   HG23  THR  33          2HG2      THR  33   4.376   3.925   7.511
  207    H    VAL  34           H        VAL  34  -0.758   3.745   6.994
  208    HA   VAL  34           HA       VAL  34  -0.392   1.316   8.502
  209    HB   VAL  34           HB       VAL  34  -2.807   2.813   7.477
  210   HG11  VAL  34          1HG1      VAL  34  -2.575   0.083   8.502
  211   HG12  VAL  34          2HG1      VAL  34  -3.685   1.086   9.466
  212   HG13  VAL  34          3HG1      VAL  34  -3.948   0.899   7.716
  213   HG21  VAL  34          3HG2      VAL  34  -2.037   4.102   9.219
  214   HG22  VAL  34          1HG2      VAL  34  -3.067   2.956  10.110
  215   HG23  VAL  34          2HG2      VAL  34  -1.303   2.720  10.066
  216    H    CYS  35           H        CYS  35  -1.152   2.372   5.176
  217    HA   CYS  35           HA       CYS  35  -2.095  -0.077   4.248
  218    HB2  CYS  35           1HB      CYS  35  -2.439   1.129   2.434
  219    HB3  CYS  35           2HB      CYS  35  -1.621   2.476   3.200
  220    H    CYS  36           H        CYS  36   1.028   0.991   5.317
  221    HA   CYS  36           HA       CYS  36   2.745  -0.371   3.672
  222    HB2  CYS  36           1HB      CYS  36   2.993   0.070   6.655
  223    HB3  CYS  36           2HB      CYS  36   4.301  -0.382   5.580
  224    H    GLY  37           H        GLY  37   1.940  -1.522   7.021
  225    HA2  GLY  37           1HA      GLY  37   2.278  -4.275   6.150
  226    HA3  GLY  37           2HA      GLY  37   2.077  -3.684   7.787
  227    H    GLN  38           H        GLN  38   0.075  -3.207   4.791
  228    HA   GLN  38           HA       GLN  38  -2.119  -4.408   6.295
  229    HB2  GLN  38           1HB      GLN  38  -1.982  -1.768   5.500
  230    HB3  GLN  38           2HB      GLN  38  -2.831  -2.482   4.143
  231    HG2  GLN  38           1HG      GLN  38  -4.578  -3.365   5.584
  232    HG3  GLN  38           2HG      GLN  38  -3.663  -2.994   7.032
  233   HE21  GLN  38          1HE2      GLN  38  -5.758  -1.950   7.530
  234   HE22  GLN  38          2HE2      GLN  38  -5.994  -0.294   7.079
  235    H    CYS  39           H        CYS  39  -0.988  -3.552   2.943
  236    HA   CYS  39           HA       CYS  39  -2.253  -6.039   2.053
  237    HB2  CYS  39           1HB      CYS  39  -1.608  -3.528   0.495
  238    HB3  CYS  39           2HB      CYS  39  -2.211  -5.012  -0.214
  239    H    PHE  40           H        PHE  40   0.695  -4.306   2.666
  240    HA   PHE  40           HA       PHE  40   2.177  -6.435   1.314
  241    HB2  PHE  40           1HB      PHE  40   3.229  -3.589   1.474
  242    HB3  PHE  40           2HB      PHE  40   3.586  -4.808   0.267
  243    HD1  PHE  40           2HD      PHE  40   2.090  -5.164  -1.625
  244    HD2  PHE  40           1HD      PHE  40   1.259  -2.183   1.278
  245    HE1  PHE  40           2HE      PHE  40   0.421  -4.116  -3.179
  246    HE2  PHE  40           1HE      PHE  40  -0.410  -1.134  -0.276
  247    HZ   PHE  40           HZ       PHE  40  -0.809  -2.113  -2.486
  248    H    SER  41           H        SER  41   4.659  -6.184   2.059
  249    HA   SER  41           HA       SER  41   4.716  -5.343   4.827
  250    HB2  SER  41           1HB      SER  41   5.075  -8.152   3.812
  251    HB3  SER  41           2HB      SER  41   6.120  -7.626   5.117
  252    HG   SER  41           HG       SER  41   3.395  -8.230   5.149
  253    H    PHE  42           H        PHE  42   7.018  -5.191   5.658
  254    HA   PHE  42           HA       PHE  42   8.631  -3.839   3.888
  255    HB2  PHE  42           1HB      PHE  42   8.548  -4.695   6.625
  256    HB3  PHE  42           2HB      PHE  42  10.079  -5.294   6.018
  257    HD1  PHE  42           2HD      PHE  42   8.044  -2.184   6.224
  258    HD2  PHE  42           1HD      PHE  42  11.924  -3.876   5.921
  259    HE1  PHE  42           2HE      PHE  42   9.059   0.089   6.542
  260    HE2  PHE  42           1HE      PHE  42  12.939  -1.603   6.240
  261    HZ   PHE  42           HZ       PHE  42  11.495   0.352   6.547
  262    HA   PRO  43           HA       PRO  43  10.752  -3.522   3.919
  263    HB2  PRO  43           1HB      PRO  43  12.404  -2.987   1.809
  264    HB3  PRO  43           2HB      PRO  43  12.973  -3.650   3.328
  265    HG2  PRO  43           1HG      PRO  43  12.595  -5.018   0.735
  266    HG3  PRO  43           2HG      PRO  43  13.541  -5.530   2.118
  267    HD2  PRO  43           1HD      PRO  43  10.971  -6.532   1.330
  268    HD3  PRO  43           2HD      PRO  43  11.864  -6.960   2.776
  269    H    VAL  44           H        VAL  44   8.700  -4.823   1.879
  270    HA   VAL  44           HA       VAL  44   8.336  -2.693   0.043
  271    HB   VAL  44           HB       VAL  44   6.191  -4.631   0.832
  272   HG11  VAL  44          1HG1      VAL  44   5.980  -4.681  -1.723
  273   HG12  VAL  44          2HG1      VAL  44   5.527  -3.170  -0.898
  274   HG13  VAL  44          3HG1      VAL  44   7.098  -3.296  -1.726
  275   HG21  VAL  44          3HG2      VAL  44   7.609  -6.359   0.628
  276   HG22  VAL  44          1HG2      VAL  44   7.619  -5.982  -1.112
  277   HG23  VAL  44          2HG2      VAL  44   8.897  -5.337  -0.054
  278    H    SER  45           H        SER  45   7.047  -3.551   3.278
  279    HA   SER  45           HA       SER  45   4.926  -1.861   3.367
  280    HB2  SER  45           1HB      SER  45   4.944  -3.020   5.323
  281    HB3  SER  45           2HB      SER  45   6.686  -3.211   5.298
  282    HG   SER  45           HG       SER  45   5.963  -1.923   7.114
  283    H    GLN  46           H        GLN  46   8.298  -1.095   3.082
  284    HA   GLN  46           HA       GLN  46   7.994   1.505   4.261
  285    HB2  GLN  46           1HB      GLN  46  10.115  -0.113   4.219
  286    HB3  GLN  46           2HB      GLN  46  10.424   0.666   2.680
  287    HG2  GLN  46           1HG      GLN  46   9.804   2.833   4.326
  288    HG3  GLN  46           2HG      GLN  46  10.651   1.762   5.424
  289   HE21  GLN  46          1HE2      GLN  46  11.423   4.337   4.267
  290   HE22  GLN  46          2HE2      GLN  46  12.935   4.103   3.455
  291    H    SER  47           H        SER  47   7.781  -0.070   1.129
  292    HA   SER  47           HA       SER  47   8.290   2.269  -0.374
  293    HB2  SER  47           1HB      SER  47   6.652   0.061  -1.557
  294    HB3  SER  47           2HB      SER  47   8.031   0.908  -2.228
  295    HG   SER  47           HG       SER  47   9.045  -0.927  -1.723
  296    H    CYS  48           H        CYS  48   5.410   0.582   0.950
  297    HA   CYS  48           HA       CYS  48   3.436   1.855  -0.450
  298    HB2  CYS  48           1HB      CYS  48   2.608   0.181   0.840
  299    HB3  CYS  48           2HB      CYS  48   3.643   0.550   2.205
  300    H    ALA  49           H        ALA  49   4.596   2.744   2.893
  301    HA   ALA  49           HA       ALA  49   3.361   5.229   2.936
  302    HB1  ALA  49           3HB      ALA  49   4.015   4.719   5.046
  303    HB2  ALA  49           1HB      ALA  49   5.381   3.727   4.483
  304    HB3  ALA  49           2HB      ALA  49   5.550   5.496   4.591
  305    H    GLY  50           H        GLY  50   6.110   4.088   1.146
  306    HA2  GLY  50           1HA      GLY  50   7.457   6.620   0.939
  307    HA3  GLY  50           2HA      GLY  50   7.781   5.152   0.038
  308    H    MET  51           H        MET  51   5.529   4.533  -1.343
  309    HA   MET  51           HA       MET  51   5.382   6.750  -3.157
  310    HB2  MET  51           1HB      MET  51   5.670   4.192  -3.707
  311    HB3  MET  51           2HB      MET  51   3.953   4.055  -3.382
  312    HG2  MET  51           1HG      MET  51   4.191   4.390  -5.769
  313    HG3  MET  51           2HG      MET  51   3.543   5.880  -5.112
  314    HE1  MET  51           3HE      MET  51   5.110   8.202  -4.838
  315    HE2  MET  51           1HE      MET  51   5.751   8.405  -6.486
  316    HE3  MET  51           2HE      MET  51   4.121   7.733  -6.241
  317    H    ALA  52           H        ALA  52   4.012   6.774  -0.421
  318    HA   ALA  52           HA       ALA  52   1.208   6.686  -1.124
  319    HB1  ALA  52           3HB      ALA  52   0.911   6.462   1.105
  320    HB2  ALA  52           1HB      ALA  52   2.674   6.234   1.188
  321    HB3  ALA  52           2HB      ALA  52   1.970   7.844   1.472
  322    H    ASP  53           H        ASP  53   2.505   8.456  -2.818
  323    HA   ASP  53           HA       ASP  53   2.506  10.500  -3.545
  324    HB2  ASP  53           1HB      ASP  53  -0.013  10.107  -2.782
  325    HB3  ASP  53           2HB      ASP  53   0.368  11.292  -1.548
  326    H    SER  54           H        SER  54   2.610  13.005  -2.764
  327    HA   SER  54           HA       SER  54   4.351  12.970  -0.450
  328    HB2  SER  54           1HB      SER  54   4.173  14.539  -2.952
  329    HB3  SER  54           2HB      SER  54   4.475  15.532  -1.541
  330    HG   SER  54           HG       SER  54   6.246  14.038  -2.894
  331    H    ASN  55           H        ASN  55   2.484  15.768  -1.732
  332    HA   ASN  55           HA       ASN  55   1.209  15.912   0.886
  333    HB2  ASN  55           1HB      ASN  55   2.838  17.804  -0.324
  334    HB3  ASN  55           2HB      ASN  55   1.256  18.355  -0.840
  335   HD21  ASN  55          1HD2      ASN  55   3.083  19.653   0.939
  336   HD22  ASN  55          2HD2      ASN  55   2.307  19.849   2.475
  337    H    ASP  56           H        ASP  56   0.780  15.233  -2.418
  338    HA   ASP  56           HA       ASP  56  -1.657  16.568  -2.857
  339    HB2  ASP  56           1HB      ASP  56  -0.095  14.365  -4.211
  340    HB3  ASP  56           2HB      ASP  56  -1.766  14.600  -4.684
  341    H    CYS  57           H        CYS  57  -0.763  14.008  -0.828
  342    HA   CYS  57           HA       CYS  57  -3.091  12.378  -1.263
  343    HB2  CYS  57           1HB      CYS  57  -0.544  12.088   0.034
  344    HB3  CYS  57           2HB      CYS  57  -1.817  11.699   1.174
  345    HA   PRO  58           HA       PRO  58  -5.500  14.486   1.693
  346    HB2  PRO  58           1HB      PRO  58  -7.283  12.550   2.428
  347    HB3  PRO  58           2HB      PRO  58  -7.435  13.483   0.952
  348    HG2  PRO  58           1HG      PRO  58  -6.559  10.680   1.291
  349    HG3  PRO  58           2HG      PRO  58  -7.120  11.487  -0.160
  350    HD2  PRO  58           1HD      PRO  58  -4.404  10.851   0.510
  351    HD3  PRO  58           2HD      PRO  58  -4.955  11.760  -0.883
  352    H    ASN  59           H        ASN  59  -3.176  14.225   2.820
  353    HA   ASN  59           HA       ASN  59  -3.475  12.595   5.148
  354    HB2  ASN  59           1HB      ASN  59  -1.307  14.389   4.005
  355    HB3  ASN  59           2HB      ASN  59  -1.201  13.901   5.685
  356   HD21  ASN  59          1HD2      ASN  59  -1.398  11.577   6.157
  357   HD22  ASN  59          2HD2      ASN  59  -0.690  10.432   5.067
  358    H    ALA  60           H        ALA  60  -2.849  13.752   7.366
  359    HA   ALA  60           HA       ALA  60  -3.571  15.116   8.962
  360    HB1  ALA  60           3HB      ALA  60  -2.900  17.209   6.852
  361    HB2  ALA  60           1HB      ALA  60  -3.043  17.504   8.602
  362    HB3  ALA  60           2HB      ALA  60  -1.747  16.455   7.979
  Start of MODEL   13
    1    H1   ASP   1           H        ASP   1  10.454  -7.011  -6.328
    2    HA   ASP   1           HA       ASP   1   8.193  -5.866  -7.675
    3    HB2  ASP   1           1HB      ASP   1   8.776  -8.679  -6.638
    4    HB3  ASP   1           2HB      ASP   1   7.311  -8.250  -7.498
    5    H    ILE   2           H        ILE   2   5.976  -6.016  -6.712
    6    HA   ILE   2           HA       ILE   2   6.088  -6.006  -3.778
    7    HB   ILE   2           HB       ILE   2   4.595  -4.297  -3.719
    8   HG12  ILE   2          1HG1      ILE   2   3.611  -5.092  -6.475
    9   HG13  ILE   2          2HG1      ILE   2   2.807  -5.407  -4.950
   10   HG21  ILE   2          1HG2      ILE   2   5.294  -2.573  -5.219
   11   HG22  ILE   2          2HG2      ILE   2   6.702  -3.611  -4.887
   12   HG23  ILE   2          3HG2      ILE   2   5.829  -3.762  -6.431
   13   HD11  ILE   2          3HD1      ILE   2   3.315  -2.632  -4.898
   14   HD12  ILE   2          1HD1      ILE   2   2.805  -2.972  -6.569
   15   HD13  ILE   2          2HD1      ILE   2   1.749  -3.419  -5.207
   16    H    GLU   3           H        GLU   3   4.502  -7.269  -6.709
   17    HA   GLU   3           HA       GLU   3   2.294  -8.387  -5.568
   18    HB2  GLU   3           1HB      GLU   3   2.726  -8.291  -8.005
   19    HB3  GLU   3           2HB      GLU   3   4.013  -9.469  -7.844
   20    HG2  GLU   3           1HG      GLU   3   1.389 -10.300  -6.683
   21    HG3  GLU   3           2HG      GLU   3   1.400 -10.107  -8.424
   22    H    ASP   4           H        ASP   4   5.691  -9.343  -5.351
   23    HA   ASP   4           HA       ASP   4   5.171 -11.988  -4.546
   24    HB2  ASP   4           1HB      ASP   4   7.602 -10.190  -4.107
   25    HB3  ASP   4           2HB      ASP   4   7.582 -11.913  -3.789
   26    H    PHE   5           H        PHE   5   4.755  -8.911  -3.086
   27    HA   PHE   5           HA       PHE   5   4.895 -10.107  -0.407
   28    HB2  PHE   5           1HB      PHE   5   5.672  -7.438  -1.626
   29    HB3  PHE   5           2HB      PHE   5   5.030  -7.396   0.004
   30    HD1  PHE   5           1HD      PHE   5   7.817  -8.515  -2.091
   31    HD2  PHE   5           2HD      PHE   5   6.283  -8.317   1.861
   32    HE1  PHE   5           1HE      PHE   5  10.082  -9.099  -1.182
   33    HE2  PHE   5           2HE      PHE   5   8.548  -8.902   2.770
   34    HZ   PHE   5           HZ       PHE   5  10.421  -9.286   1.237
   35    H    TYR   6           H        TYR   6   2.690  -9.804  -2.605
   36    HA   TYR   6           HA       TYR   6   0.847  -7.948  -1.441
   37    HB2  TYR   6           1HB      TYR   6   1.059  -8.689  -3.898
   38    HB3  TYR   6           2HB      TYR   6   0.559 -10.299  -3.416
   39    HD1  TYR   6           2HD      TYR   6  -1.090  -7.632  -1.623
   40    HD2  TYR   6           1HD      TYR   6  -1.229  -9.985  -5.193
   41    HE1  TYR   6           2HE      TYR   6  -3.524  -6.981  -1.966
   42    HE2  TYR   6           1HE      TYR   6  -3.662  -9.327  -5.524
   43    HH   TYR   6           HH       TYR   6  -5.039  -6.929  -4.460
   44    H    THR   7           H        THR   7  -0.454  -8.297   0.284
   45    HA   THR   7           HA       THR   7  -0.924 -11.103   1.046
   46    HB   THR   7           HB       THR   7  -0.896 -10.340   3.315
   47    HG1  THR   7           1HG      THR   7  -1.055  -7.944   3.632
   48   HG21  THR   7          3HG2      THR   7   0.945  -8.229   2.140
   49   HG22  THR   7          1HG2      THR   7   1.177  -9.223   3.599
   50   HG23  THR   7          2HG2      THR   7   1.372  -9.951   1.986
   51    H    SER   8           H        SER   8  -2.705 -11.497  -0.302
   52    HA   SER   8           HA       SER   8  -4.870  -9.677  -0.292
   53    HB2  SER   8           1HB      SER   8  -4.367 -11.136  -2.231
   54    HB3  SER   8           2HB      SER   8  -4.673 -12.563  -1.262
   55    HG   SER   8           HG       SER   8  -6.799 -10.770  -1.162
   56    H    GLU   9           H        GLU   9  -3.688 -11.630   2.105
   57    HA   GLU   9           HA       GLU   9  -6.103 -12.873   2.922
   58    HB2  GLU   9           1HB      GLU   9  -3.368 -13.151   3.519
   59    HB3  GLU   9           2HB      GLU   9  -4.064 -12.558   5.014
   60    HG2  GLU   9           1HG      GLU   9  -5.834 -14.368   4.849
   61    HG3  GLU   9           2HG      GLU   9  -5.012 -14.995   3.434
   62    H    THR  10           H        THR  10  -4.234  -9.922   3.793
   63    HA   THR  10           HA       THR  10  -6.439  -9.158   5.586
   64    HB   THR  10           HB       THR  10  -4.347  -9.251   6.788
   65    HG1  THR  10           1HG      THR  10  -3.988  -6.816   6.950
   66   HG21  THR  10          3HG2      THR  10  -2.520  -7.532   5.750
   67   HG22  THR  10          1HG2      THR  10  -2.506  -9.266   5.348
   68   HG23  THR  10          2HG2      THR  10  -3.249  -8.099   4.228
   69    H    CYS  11           H        CYS  11  -4.752  -8.441   2.594
   70    HA   CYS  11           HA       CYS  11  -5.464  -5.750   2.401
   71    HB2  CYS  11           1HB      CYS  11  -3.749  -6.920   1.026
   72    HB3  CYS  11           2HB      CYS  11  -5.035  -7.732   0.156
   73    HA   PRO  12           HA       PRO  12  -9.731  -6.262   1.611
   74    HB2  PRO  12           1HB      PRO  12 -10.350  -3.710   0.855
   75    HB3  PRO  12           2HB      PRO  12 -10.220  -4.209   2.530
   76    HG2  PRO  12           1HG      PRO  12  -8.324  -2.614   0.918
   77    HG3  PRO  12           2HG      PRO  12  -8.429  -2.761   2.661
   78    HD2  PRO  12           1HD      PRO  12  -6.511  -4.027   0.944
   79    HD3  PRO  12           2HD      PRO  12  -6.689  -4.265   2.671
   80    H    TYR  13           H        TYR  13  -7.413  -5.945  -0.665
   81    HA   TYR  13           HA       TYR  13  -9.433  -6.265  -2.782
   82    HB2  TYR  13           1HB      TYR  13  -6.610  -5.025  -2.747
   83    HB3  TYR  13           2HB      TYR  13  -7.549  -5.235  -4.212
   84    HD1  TYR  13           2HD      TYR  13  -9.692  -3.934  -4.510
   85    HD2  TYR  13           1HD      TYR  13  -6.978  -3.164  -1.293
   86    HE1  TYR  13           2HE      TYR  13 -10.763  -1.658  -4.141
   87    HE2  TYR  13           1HE      TYR  13  -8.058  -0.890  -0.936
   88    HH   TYR  13           HH       TYR  13 -11.020  -0.058  -2.365
   89    H    LYS  14           H        LYS  14  -8.964  -7.812  -4.438
   90    HA   LYS  14           HA       LYS  14  -6.626  -9.490  -3.942
   91    HB2  LYS  14           1HB      LYS  14  -8.220 -11.485  -4.383
   92    HB3  LYS  14           2HB      LYS  14  -8.145 -10.787  -2.778
   93    HG2  LYS  14           1HG      LYS  14 -10.487 -11.063  -3.320
   94    HG3  LYS  14           2HG      LYS  14 -10.149  -9.344  -3.370
   95    HD2  LYS  14           1HD      LYS  14  -9.720 -10.742  -5.963
   96    HD3  LYS  14           2HD      LYS  14 -11.379 -10.775  -5.399
   97    HE2  LYS  14           1HE      LYS  14 -10.841  -8.155  -4.916
   98    HE3  LYS  14           2HE      LYS  14  -9.695  -8.422  -6.215
   99    HZ1  LYS  14           3HZ      LYS  14 -11.604  -7.872  -7.311
  100    HZ2  LYS  14           1HZ      LYS  14 -11.699  -9.502  -7.357
  101    HZ3  LYS  14           2HZ      LYS  14 -12.596  -8.662  -6.282
  102    H    ASN  15           H        ASN  15  -7.261  -7.353  -5.889
  103    HA   ASN  15           HA       ASN  15  -7.237  -9.044  -8.265
  104    HB2  ASN  15           1HB      ASN  15  -8.618  -6.399  -7.719
  105    HB3  ASN  15           2HB      ASN  15  -8.074  -6.733  -9.351
  106   HD21  ASN  15          1HD2      ASN  15 -10.628  -6.404  -9.176
  107   HD22  ASN  15          2HD2      ASN  15 -11.540  -7.875  -9.232
  108    H    ASP  16           H        ASP  16  -4.809  -8.986  -7.759
  109    HA   ASP  16           HA       ASP  16  -2.843  -8.318  -8.451
  110    HB2  ASP  16           1HB      ASP  16  -4.512  -6.676 -10.036
  111    HB3  ASP  16           2HB      ASP  16  -3.403  -5.550  -9.280
  112    H    SER  17           H        SER  17  -1.297  -7.587  -6.962
  113    HA   SER  17           HA       SER  17  -2.108  -6.199  -4.713
  114    HB2  SER  17           1HB      SER  17   0.023  -7.735  -5.300
  115    HB3  SER  17           2HB      SER  17   0.787  -6.176  -5.536
  116    HG   SER  17           HG       SER  17   1.089  -6.356  -3.401
  117    H    GLN  18           H        GLN  18  -1.151  -5.129  -7.897
  118    HA   GLN  18           HA       GLN  18  -0.139  -2.622  -7.133
  119    HB2  GLN  18           1HB      GLN  18   0.039  -4.000  -9.399
  120    HB3  GLN  18           2HB      GLN  18  -1.414  -3.118  -9.827
  121    HG2  GLN  18           1HG      GLN  18  -0.294  -0.968  -9.498
  122    HG3  GLN  18           2HG      GLN  18   1.119  -1.749  -8.815
  123   HE21  GLN  18          1HE2      GLN  18   1.751  -0.170 -10.719
  124   HE22  GLN  18          2HE2      GLN  18   2.079  -0.947 -12.232
  125    H    LEU  19           H        LEU  19  -3.358  -3.981  -7.519
  126    HA   LEU  19           HA       LEU  19  -4.723  -1.569  -8.030
  127    HB2  LEU  19           1HB      LEU  19  -5.763  -3.605  -8.592
  128    HB3  LEU  19           2HB      LEU  19  -5.529  -4.274  -6.989
  129    HG   LEU  19           HG       LEU  19  -7.142  -2.586  -6.093
  130   HD11  LEU  19          1HD1      LEU  19  -7.420  -0.780  -7.400
  131   HD12  LEU  19          2HD1      LEU  19  -7.037  -1.666  -8.895
  132   HD13  LEU  19          3HD1      LEU  19  -8.668  -1.774  -8.189
  133   HD21  LEU  19          3HD2      LEU  19  -9.177  -3.672  -7.139
  134   HD22  LEU  19          1HD2      LEU  19  -8.051  -4.552  -8.200
  135   HD23  LEU  19          2HD2      LEU  19  -7.970  -4.774  -6.436
  136    H    ALA  20           H        ALA  20  -4.215  -3.487  -4.985
  137    HA   ALA  20           HA       ALA  20  -5.421  -1.569  -3.334
  138    HB1  ALA  20           3HB      ALA  20  -4.908  -3.052  -1.665
  139    HB2  ALA  20           1HB      ALA  20  -4.616  -4.134  -3.048
  140    HB3  ALA  20           2HB      ALA  20  -3.249  -3.312  -2.257
  141    H    TRP  21           H        TRP  21  -2.219  -1.850  -4.812
  142    HA   TRP  21           HA       TRP  21  -0.969  -0.014  -3.014
  143    HB2  TRP  21           1HB      TRP  21   0.503  -1.519  -3.965
  144    HB3  TRP  21           2HB      TRP  21  -0.215  -1.398  -5.559
  145    HD1  TRP  21           HD       TRP  21   0.406   0.959  -6.960
  146    HE1  TRP  21           1HE      TRP  21   2.555   2.490  -6.979
  147    HE3  TRP  21           3HE      TRP  21   2.276  -0.711  -2.536
  148    HZ2  TRP  21           2HZ      TRP  21   4.748   2.822  -5.182
  149    HZ3  TRP  21           3HZ      TRP  21   4.426   0.269  -1.740
  150    HH2  TRP  21           HH       TRP  21   5.653   1.977  -2.986
  151    H    ASP  22           H        ASP  22  -2.529   0.056  -6.268
  152    HA   ASP  22           HA       ASP  22  -1.865   2.682  -6.840
  153    HB2  ASP  22           1HB      ASP  22  -3.638   0.589  -7.881
  154    HB3  ASP  22           2HB      ASP  22  -4.397   2.163  -8.014
  155    H    THR  23           H        THR  23  -4.009   1.272  -4.517
  156    HA   THR  23           HA       THR  23  -5.897   3.466  -4.484
  157    HB   THR  23           HB       THR  23  -5.628   0.725  -3.415
  158    HG1  THR  23           1HG      THR  23  -7.330   1.380  -4.828
  159   HG21  THR  23          3HG2      THR  23  -7.067   1.139  -1.429
  160   HG22  THR  23          1HG2      THR  23  -5.500   1.959  -1.226
  161   HG23  THR  23          2HG2      THR  23  -6.941   2.895  -1.694
  162    H    CYS  24           H        CYS  24  -3.292   2.164  -2.330
  163    HA   CYS  24           HA       CYS  24  -3.537   4.529  -0.699
  164    HB2  CYS  24           1HB      CYS  24  -3.065   2.921   0.777
  165    HB3  CYS  24           2HB      CYS  24  -2.359   1.864  -0.430
  166    H    SER  25           H        SER  25  -0.692   2.789  -2.165
  167    HA   SER  25           HA       SER  25   0.703   5.253  -2.363
  168    HB2  SER  25           1HB      SER  25   2.163   3.383  -3.826
  169    HB3  SER  25           2HB      SER  25   2.366   3.736  -2.121
  170    HG   SER  25           HG       SER  25   0.577   1.731  -3.210
  171    H    GLY  26           H        GLY  26  -1.515   5.782  -3.787
  172    HA2  GLY  26           1HA      GLY  26  -0.676   5.489  -6.610
  173    HA3  GLY  26           2HA      GLY  26  -2.346   5.381  -6.091
  174    H    GLY  27           H        GLY  27  -0.832   7.595  -4.035
  175    HA2  GLY  27           1HA      GLY  27  -0.332   9.877  -4.355
  176    HA3  GLY  27           2HA      GLY  27  -1.270   9.882  -5.834
  177    H    THR  28           H        THR  28  -3.545   8.317  -4.692
  178    HA   THR  28           HA       THR  28  -4.543  10.177  -2.658
  179    HB   THR  28           HB       THR  28  -6.683  10.326  -4.012
  180    HG1  THR  28           1HG      THR  28  -6.434   9.494  -6.224
  181   HG21  THR  28          3HG2      THR  28  -4.061  11.241  -5.279
  182   HG22  THR  28          1HG2      THR  28  -5.635  11.602  -6.030
  183   HG23  THR  28          2HG2      THR  28  -5.258  12.227  -4.406
  184    H    GLY  29           H        GLY  29  -7.172   9.130  -2.564
  185    HA2  GLY  29           1HA      GLY  29  -8.364   7.263  -1.988
  186    HA3  GLY  29           2HA      GLY  29  -6.950   6.259  -2.235
  187    H    ASN  30           H        ASN  30  -6.656   5.163  -0.323
  188    HA   ASN  30           HA       ASN  30  -6.872   6.732   2.109
  189    HB2  ASN  30           1HB      ASN  30  -6.972   4.523   3.263
  190    HB3  ASN  30           2HB      ASN  30  -8.195   4.623   2.012
  191   HD21  ASN  30          1HD2      ASN  30  -8.269   2.359   1.956
  192   HD22  ASN  30          2HD2      ASN  30  -7.079   1.412   1.126
  193    H    CYS  31           H        CYS  31  -4.576   7.158   0.431
  194    HA   CYS  31           HA       CYS  31  -2.430   5.497   0.923
  195    HB2  CYS  31           1HB      CYS  31  -1.155   7.064  -0.115
  196    HB3  CYS  31           2HB      CYS  31  -2.744   7.544  -0.675
  197    H    GLY  32           H        GLY  32  -1.076   5.218   2.699
  198    HA2  GLY  32           1HA      GLY  32  -0.641   7.190   4.676
  199    HA3  GLY  32           2HA      GLY  32  -1.860   6.062   5.235
  200    H    THR  33           H        THR  33   0.150   5.854   6.836
  201    HA   THR  33           HA       THR  33   2.206   4.094   5.792
  202    HB   THR  33           HB       THR  33   1.669   5.247   8.581
  203    HG1  THR  33           1HG      THR  33   3.489   6.648   7.701
  204   HG21  THR  33          3HG2      THR  33   4.157   4.867   8.836
  205   HG22  THR  33          1HG2      THR  33   3.245   3.344   8.701
  206   HG23  THR  33          2HG2      THR  33   4.142   3.972   7.297
  207    H    VAL  34           H        VAL  34  -0.979   3.723   6.813
  208    HA   VAL  34           HA       VAL  34  -0.559   1.296   8.297
  209    HB   VAL  34           HB       VAL  34  -3.037   2.641   7.201
  210   HG11  VAL  34          1HG1      VAL  34  -4.341   1.152   8.569
  211   HG12  VAL  34          2HG1      VAL  34  -3.276   0.167   7.537
  212   HG13  VAL  34          3HG1      VAL  34  -2.874   0.412   9.254
  213   HG21  VAL  34          3HG2      VAL  34  -3.287   3.722   9.217
  214   HG22  VAL  34          1HG2      VAL  34  -2.349   2.505  10.115
  215   HG23  VAL  34          2HG2      VAL  34  -1.511   3.695   9.091
  216    H    CYS  35           H        CYS  35  -1.306   2.323   4.958
  217    HA   CYS  35           HA       CYS  35  -2.158  -0.155   4.021
  218    HB2  CYS  35           1HB      CYS  35  -2.512   1.037   2.200
  219    HB3  CYS  35           2HB      CYS  35  -1.745   2.410   2.974
  220    H    CYS  36           H        CYS  36   0.909   0.997   5.149
  221    HA   CYS  36           HA       CYS  36   2.696  -0.308   3.528
  222    HB2  CYS  36           1HB      CYS  36   2.880   0.134   6.516
  223    HB3  CYS  36           2HB      CYS  36   4.219  -0.274   5.462
  224    H    GLY  37           H        GLY  37   1.868  -1.487   6.862
  225    HA2  GLY  37           1HA      GLY  37   2.299  -4.228   5.993
  226    HA3  GLY  37           2HA      GLY  37   2.059  -3.645   7.628
  227    H    GLN  38           H        GLN  38   0.096  -3.257   4.591
  228    HA   GLN  38           HA       GLN  38  -2.092  -4.495   6.075
  229    HB2  GLN  38           1HB      GLN  38  -2.061  -1.878   5.349
  230    HB3  GLN  38           2HB      GLN  38  -2.718  -2.558   3.874
  231    HG2  GLN  38           1HG      GLN  38  -4.402  -3.830   5.374
  232    HG3  GLN  38           2HG      GLN  38  -3.852  -2.813   6.691
  233   HE21  GLN  38          1HE2      GLN  38  -6.421  -3.084   5.148
  234   HE22  GLN  38          2HE2      GLN  38  -6.852  -1.477   4.666
  235    H    CYS  39           H        CYS  39  -1.002  -3.621   2.711
  236    HA   CYS  39           HA       CYS  39  -2.102  -6.200   1.863
  237    HB2  CYS  39           1HB      CYS  39  -1.629  -3.717   0.200
  238    HB3  CYS  39           2HB      CYS  39  -2.276  -5.239  -0.382
  239    H    PHE  40           H        PHE  40   0.717  -4.325   2.504
  240    HA   PHE  40           HA       PHE  40   2.324  -6.286   1.046
  241    HB2  PHE  40           1HB      PHE  40   3.190  -3.388   1.354
  242    HB3  PHE  40           2HB      PHE  40   3.635  -4.522   0.094
  243    HD1  PHE  40           2HD      PHE  40   2.110  -4.948  -1.790
  244    HD2  PHE  40           1HD      PHE  40   1.198  -2.049   1.171
  245    HE1  PHE  40           2HE      PHE  40   0.383  -3.941  -3.308
  246    HE2  PHE  40           1HE      PHE  40  -0.530  -1.042  -0.346
  247    HZ   PHE  40           HZ       PHE  40  -0.917  -2.001  -2.568
  248    H    SER  41           H        SER  41   4.769  -5.989   1.814
  249    HA   SER  41           HA       SER  41   4.808  -5.233   4.606
  250    HB2  SER  41           1HB      SER  41   5.203  -8.000   3.512
  251    HB3  SER  41           2HB      SER  41   6.292  -7.496   4.789
  252    HG   SER  41           HG       SER  41   4.621  -8.275   5.964
  253    H    PHE  42           H        PHE  42   7.092  -5.002   5.435
  254    HA   PHE  42           HA       PHE  42   8.665  -3.569   3.699
  255    HB2  PHE  42           1HB      PHE  42   8.613  -4.499   6.414
  256    HB3  PHE  42           2HB      PHE  42  10.164  -5.025   5.791
  257    HD1  PHE  42           2HD      PHE  42   8.019  -2.012   6.153
  258    HD2  PHE  42           1HD      PHE  42  11.952  -3.525   5.658
  259    HE1  PHE  42           2HE      PHE  42   8.951   0.287   6.531
  260    HE2  PHE  42           1HE      PHE  42  12.884  -1.226   6.036
  261    HZ   PHE  42           HZ       PHE  42  11.373   0.653   6.468
  262    HA   PRO  43           HA       PRO  43  10.767  -3.180   3.721
  263    HB2  PRO  43           1HB      PRO  43  12.386  -2.546   1.613
  264    HB3  PRO  43           2HB      PRO  43  12.988  -3.219   3.115
  265    HG2  PRO  43           1HG      PRO  43  12.642  -4.547   0.497
  266    HG3  PRO  43           2HG      PRO  43  13.614  -5.053   1.865
  267    HD2  PRO  43           1HD      PRO  43  11.076  -6.130   1.071
  268    HD3  PRO  43           2HD      PRO  43  11.993  -6.554   2.503
  269    H    VAL  44           H        VAL  44   8.754  -4.515   1.661
  270    HA   VAL  44           HA       VAL  44   8.301  -2.369  -0.133
  271    HB   VAL  44           HB       VAL  44   6.233  -4.394   0.649
  272   HG11  VAL  44          1HG1      VAL  44   5.998  -4.399  -1.912
  273   HG12  VAL  44          2HG1      VAL  44   5.474  -2.940  -1.038
  274   HG13  VAL  44          3HG1      VAL  44   7.040  -2.956  -1.884
  275   HG21  VAL  44          3HG2      VAL  44   7.683  -6.078   0.361
  276   HG22  VAL  44          1HG2      VAL  44   7.704  -5.626  -1.361
  277   HG23  VAL  44          2HG2      VAL  44   8.949  -4.990  -0.258
  278    H    SER  45           H        SER  45   7.069  -3.315   3.099
  279    HA   SER  45           HA       SER  45   4.895  -1.699   3.234
  280    HB2  SER  45           1HB      SER  45   4.978  -2.887   5.172
  281    HB3  SER  45           2HB      SER  45   6.726  -3.005   5.131
  282    HG   SER  45           HG       SER  45   6.120  -1.772   6.957
  283    H    GLN  46           H        GLN  46   8.229  -0.810   2.907
  284    HA   GLN  46           HA       GLN  46   7.860   1.759   4.134
  285    HB2  GLN  46           1HB      GLN  46  10.019   0.683   4.432
  286    HB3  GLN  46           2HB      GLN  46  10.211   0.452   2.705
  287    HG2  GLN  46           1HG      GLN  46  11.515   2.370   3.064
  288    HG3  GLN  46           2HG      GLN  46   9.992   3.077   2.564
  289   HE21  GLN  46          1HE2      GLN  46  11.098   4.894   3.729
  290   HE22  GLN  46          2HE2      GLN  46  10.766   5.098   5.417
  291    H    SER  47           H        SER  47   7.802   0.232   0.937
  292    HA   SER  47           HA       SER  47   8.141   2.609  -0.515
  293    HB2  SER  47           1HB      SER  47   8.369   0.106  -1.260
  294    HB3  SER  47           2HB      SER  47   6.638   0.173  -1.525
  295    HG   SER  47           HG       SER  47   7.998   2.357  -2.629
  296    H    CYS  48           H        CYS  48   5.342   0.820   0.839
  297    HA   CYS  48           HA       CYS  48   3.304   2.042  -0.520
  298    HB2  CYS  48           1HB      CYS  48   2.583   0.306   0.768
  299    HB3  CYS  48           2HB      CYS  48   3.586   0.740   2.137
  300    H    ALA  49           H        ALA  49   4.447   2.919   2.830
  301    HA   ALA  49           HA       ALA  49   3.148   5.368   2.907
  302    HB1  ALA  49           3HB      ALA  49   5.362   5.656   4.548
  303    HB2  ALA  49           1HB      ALA  49   3.826   4.885   5.011
  304    HB3  ALA  49           2HB      ALA  49   5.185   3.888   4.438
  305    H    GLY  50           H        GLY  50   5.913   4.331   1.085
  306    HA2  GLY  50           1HA      GLY  50   7.185   6.906   0.909
  307    HA3  GLY  50           2HA      GLY  50   7.555   5.459  -0.007
  308    H    MET  51           H        MET  51   5.324   4.782  -1.393
  309    HA   MET  51           HA       MET  51   5.112   7.001  -3.193
  310    HB2  MET  51           1HB      MET  51   5.497   4.594  -3.925
  311    HB3  MET  51           2HB      MET  51   3.911   4.178  -3.305
  312    HG2  MET  51           1HG      MET  51   2.985   4.811  -5.278
  313    HG3  MET  51           2HG      MET  51   3.528   6.454  -5.000
  314    HE1  MET  51           3HE      MET  51   4.439   7.550  -6.516
  315    HE2  MET  51           1HE      MET  51   5.750   7.149  -7.650
  316    HE3  MET  51           2HE      MET  51   4.074   6.683  -8.027
  317    H    ALA  52           H        ALA  52   3.702   6.766  -0.399
  318    HA   ALA  52           HA       ALA  52   0.921   6.856  -1.234
  319    HB1  ALA  52           3HB      ALA  52   1.153   5.664   0.760
  320    HB2  ALA  52           1HB      ALA  52   2.426   6.743   1.379
  321    HB3  ALA  52           2HB      ALA  52   0.731   7.288   1.354
  322    H    ASP  53           H        ASP  53   2.989   8.883  -2.128
  323    HA   ASP  53           HA       ASP  53   3.118  11.022  -2.450
  324    HB2  ASP  53           1HB      ASP  53   0.279  10.610  -1.755
  325    HB3  ASP  53           2HB      ASP  53   0.816  12.233  -1.373
  326    H    SER  54           H        SER  54   3.563  13.118  -1.292
  327    HA   SER  54           HA       SER  54   4.024  12.597   1.514
  328    HB2  SER  54           1HB      SER  54   5.362  14.127  -0.594
  329    HB3  SER  54           2HB      SER  54   5.117  15.114   0.833
  330    HG   SER  54           HG       SER  54   6.401  12.517   0.753
  331    H    ASN  55           H        ASN  55   3.388  15.711  -0.230
  332    HA   ASN  55           HA       ASN  55   1.393  16.253   1.816
  333    HB2  ASN  55           1HB      ASN  55   3.561  17.779   1.020
  334    HB3  ASN  55           2HB      ASN  55   2.304  18.457   0.005
  335   HD21  ASN  55          1HD2      ASN  55   1.995  20.367   0.957
  336   HD22  ASN  55          2HD2      ASN  55   1.440  20.612   2.580
  337    H    ASP  56           H        ASP  56   1.794  15.255  -1.405
  338    HA   ASP  56           HA       ASP  56  -0.177  16.834  -2.641
  339    HB2  ASP  56           1HB      ASP  56   1.773  15.045  -3.476
  340    HB3  ASP  56           2HB      ASP  56   0.316  14.102  -3.720
  341    H    CYS  57           H        CYS  57  -0.135  14.051  -0.516
  342    HA   CYS  57           HA       CYS  57  -2.641  12.989  -1.403
  343    HB2  CYS  57           1HB      CYS  57  -0.479  12.124   0.237
  344    HB3  CYS  57           2HB      CYS  57  -1.936  12.071   1.210
  345    HA   PRO  58           HA       PRO  58  -5.167  15.176   1.407
  346    HB2  PRO  58           1HB      PRO  58  -6.777  13.327   2.615
  347    HB3  PRO  58           2HB      PRO  58  -7.041  13.907   0.983
  348    HG2  PRO  58           1HG      PRO  58  -5.947  11.309   1.873
  349    HG3  PRO  58           2HG      PRO  58  -6.607  11.744   0.309
  350    HD2  PRO  58           1HD      PRO  58  -3.834  11.454   0.980
  351    HD3  PRO  58           2HD      PRO  58  -4.490  12.001  -0.550
  352    H    ASN  59           H        ASN  59  -2.791  15.305   2.459
  353    HA   ASN  59           HA       ASN  59  -3.332  14.652   5.250
  354    HB2  ASN  59           1HB      ASN  59  -0.783  14.548   3.602
  355    HB3  ASN  59           2HB      ASN  59  -0.662  14.851   5.324
  356   HD21  ASN  59          1HD2      ASN  59  -2.436  12.735   3.069
  357   HD22  ASN  59          2HD2      ASN  59  -2.256  11.262   3.963
  358    H    ALA  60           H        ALA  60  -1.469  16.178   6.567
  359    HA   ALA  60           HA       ALA  60  -2.449  18.770   6.379
  360    HB1  ALA  60           3HB      ALA  60  -1.555  18.289   8.449
  361    HB2  ALA  60           1HB      ALA  60  -0.193  17.367   7.769
  362    HB3  ALA  60           2HB      ALA  60  -0.171  19.147   7.732
  Start of MODEL   14
    1    H1   ASP   1           H        ASP   1   8.984  -4.549  -6.188
    2    HA   ASP   1           HA       ASP   1   8.028  -6.772  -7.393
    3    HB2  ASP   1           1HB      ASP   1  10.574  -7.403  -6.540
    4    HB3  ASP   1           2HB      ASP   1   9.644  -7.863  -5.128
    5    H    ILE   2           H        ILE   2   6.084  -5.947  -6.439
    6    HA   ILE   2           HA       ILE   2   6.027  -5.936  -3.504
    7    HB   ILE   2           HB       ILE   2   4.622  -4.168  -3.530
    8   HG12  ILE   2          1HG1      ILE   2   3.653  -4.993  -6.283
    9   HG13  ILE   2          2HG1      ILE   2   2.823  -5.269  -4.764
   10   HG21  ILE   2          1HG2      ILE   2   5.539  -2.503  -4.834
   11   HG22  ILE   2          2HG2      ILE   2   6.814  -3.744  -4.888
   12   HG23  ILE   2          3HG2      ILE   2   5.698  -3.553  -6.262
   13   HD11  ILE   2          3HD1      ILE   2   2.054  -3.227  -6.126
   14   HD12  ILE   2          1HD1      ILE   2   2.439  -2.923  -4.415
   15   HD13  ILE   2          2HD1      ILE   2   3.605  -2.473  -5.682
   16    H    GLU   3           H        GLU   3   4.512  -7.110  -6.524
   17    HA   GLU   3           HA       GLU   3   2.253  -8.204  -5.456
   18    HB2  GLU   3           1HB      GLU   3   2.352  -9.777  -7.424
   19    HB3  GLU   3           2HB      GLU   3   2.576  -8.093  -7.851
   20    HG2  GLU   3           1HG      GLU   3   4.910  -8.353  -8.212
   21    HG3  GLU   3           2HG      GLU   3   4.998  -9.814  -7.249
   22    H    ASP   4           H        ASP   4   5.625  -9.271  -5.247
   23    HA   ASP   4           HA       ASP   4   5.011 -11.914  -4.508
   24    HB2  ASP   4           1HB      ASP   4   7.494 -10.188  -4.088
   25    HB3  ASP   4           2HB      ASP   4   7.434 -11.895  -3.695
   26    H    PHE   5           H        PHE   5   4.807  -8.831  -2.961
   27    HA   PHE   5           HA       PHE   5   4.849 -10.112  -0.318
   28    HB2  PHE   5           1HB      PHE   5   5.737  -7.436  -1.456
   29    HB3  PHE   5           2HB      PHE   5   5.141  -7.444   0.192
   30    HD1  PHE   5           1HD      PHE   5   6.382  -8.573   1.960
   31    HD2  PHE   5           2HD      PHE   5   7.836  -8.518  -2.026
   32    HE1  PHE   5           1HE      PHE   5   8.642  -9.300   2.775
   33    HE2  PHE   5           2HE      PHE   5  10.096  -9.245  -1.212
   34    HZ   PHE   5           HZ       PHE   5  10.472  -9.627   1.179
   35    H    TYR   6           H        TYR   6   2.664  -9.640  -2.504
   36    HA   TYR   6           HA       TYR   6   0.920  -7.719  -1.292
   37    HB2  TYR   6           1HB      TYR   6   1.111  -8.429  -3.770
   38    HB3  TYR   6           2HB      TYR   6   0.485 -10.002  -3.318
   39    HD1  TYR   6           2HD      TYR   6  -0.798  -6.906  -1.775
   40    HD2  TYR   6           1HD      TYR   6  -1.426  -9.860  -4.806
   41    HE1  TYR   6           2HE      TYR   6  -3.173  -6.063  -2.116
   42    HE2  TYR   6           1HE      TYR   6  -3.798  -9.007  -5.136
   43    HH   TYR   6           HH       TYR   6  -5.490  -7.670  -3.377
   44    H    THR   7           H        THR   7  -0.518  -8.036   0.336
   45    HA   THR   7           HA       THR   7  -1.041 -10.832   1.101
   46    HB   THR   7           HB       THR   7  -1.295  -9.931   3.380
   47    HG1  THR   7           1HG      THR   7  -2.233  -7.871   2.475
   48   HG21  THR   7          3HG2      THR   7   1.037  -8.267   2.461
   49   HG22  THR   7          1HG2      THR   7   0.935  -9.413   3.819
   50   HG23  THR   7          2HG2      THR   7   1.138 -10.018   2.157
   51    H    SER   8           H        SER   8  -2.727 -11.109  -0.456
   52    HA   SER   8           HA       SER   8  -4.880  -9.313  -0.517
   53    HB2  SER   8           1HB      SER   8  -4.250 -10.864  -2.383
   54    HB3  SER   8           2HB      SER   8  -4.753 -12.229  -1.407
   55    HG   SER   8           HG       SER   8  -6.356 -11.312  -3.010
   56    H    GLU   9           H        GLU   9  -3.845 -11.388   1.904
   57    HA   GLU   9           HA       GLU   9  -6.335 -12.508   2.634
   58    HB2  GLU   9           1HB      GLU   9  -3.638 -12.885   3.340
   59    HB3  GLU   9           2HB      GLU   9  -4.373 -12.273   4.808
   60    HG2  GLU   9           1HG      GLU   9  -6.052 -14.297   3.450
   61    HG3  GLU   9           2HG      GLU   9  -4.478 -14.920   3.905
   62    H    THR  10           H        THR  10  -4.295  -9.766   3.853
   63    HA   THR  10           HA       THR  10  -6.549  -8.904   5.510
   64    HB   THR  10           HB       THR  10  -4.512  -8.976   6.754
   65    HG1  THR  10           1HG      THR  10  -4.849  -6.850   7.259
   66   HG21  THR  10          3HG2      THR  10  -2.539  -7.483   5.674
   67   HG22  THR  10          1HG2      THR  10  -2.671  -9.223   5.322
   68   HG23  THR  10          2HG2      THR  10  -3.293  -8.029   4.157
   69    H    CYS  11           H        CYS  11  -4.840  -8.180   2.525
   70    HA   CYS  11           HA       CYS  11  -5.528  -5.484   2.346
   71    HB2  CYS  11           1HB      CYS  11  -3.834  -6.723   0.964
   72    HB3  CYS  11           2HB      CYS  11  -5.159  -7.425   0.058
   73    HA   PRO  12           HA       PRO  12  -9.801  -5.943   1.553
   74    HB2  PRO  12           1HB      PRO  12 -10.391  -3.379   0.815
   75    HB3  PRO  12           2HB      PRO  12 -10.267  -3.891   2.487
   76    HG2  PRO  12           1HG      PRO  12  -8.352  -2.306   0.886
   77    HG3  PRO  12           2HG      PRO  12  -8.459  -2.465   2.628
   78    HD2  PRO  12           1HD      PRO  12  -6.555  -3.740   0.903
   79    HD3  PRO  12           2HD      PRO  12  -6.737  -3.988   2.628
   80    H    TYR  13           H        TYR  13  -7.474  -5.480  -0.745
   81    HA   TYR  13           HA       TYR  13  -9.499  -5.814  -2.856
   82    HB2  TYR  13           1HB      TYR  13  -6.705  -4.529  -2.715
   83    HB3  TYR  13           2HB      TYR  13  -7.497  -4.840  -4.247
   84    HD1  TYR  13           1HD      TYR  13  -9.855  -3.765  -4.586
   85    HD2  TYR  13           2HD      TYR  13  -7.068  -2.502  -1.596
   86    HE1  TYR  13           1HE      TYR  13 -11.038  -1.521  -4.421
   87    HE2  TYR  13           2HE      TYR  13  -8.261  -0.262  -1.441
   88    HH   TYR  13           HH       TYR  13  -9.658   1.123  -2.730
   89    H    LYS  14           H        LYS  14  -9.096  -7.379  -4.488
   90    HA   LYS  14           HA       LYS  14  -6.748  -9.064  -4.058
   91    HB2  LYS  14           1HB      LYS  14  -8.390 -11.043  -4.483
   92    HB3  LYS  14           2HB      LYS  14  -8.218 -10.380  -2.871
   93    HG2  LYS  14           1HG      LYS  14 -10.586 -10.587  -3.266
   94    HG3  LYS  14           2HG      LYS  14 -10.221  -8.876  -3.356
   95    HD2  LYS  14           1HD      LYS  14  -9.968 -10.302  -5.954
   96    HD3  LYS  14           2HD      LYS  14 -11.591 -10.310  -5.294
   97    HE2  LYS  14           1HE      LYS  14 -10.996  -7.694  -4.867
   98    HE3  LYS  14           2HE      LYS  14  -9.929  -7.984  -6.227
   99    HZ1  LYS  14           3HZ      LYS  14 -11.667  -7.926  -7.550
  100    HZ2  LYS  14           1HZ      LYS  14 -12.410  -9.142  -6.751
  101    HZ3  LYS  14           2HZ      LYS  14 -12.652  -7.594  -6.290
  102    H    ASN  15           H        ASN  15  -7.242  -6.955  -5.979
  103    HA   ASN  15           HA       ASN  15  -7.419  -8.626  -8.361
  104    HB2  ASN  15           1HB      ASN  15  -8.712  -6.000  -7.696
  105    HB3  ASN  15           2HB      ASN  15  -8.038  -6.111  -9.310
  106   HD21  ASN  15          1HD2      ASN  15 -10.585  -5.769  -9.326
  107   HD22  ASN  15          2HD2      ASN  15 -11.500  -7.203  -9.651
  108    H    ASP  16           H        ASP  16  -4.953  -8.618  -7.555
  109    HA   ASP  16           HA       ASP  16  -2.955  -8.138  -8.382
  110    HB2  ASP  16           1HB      ASP  16  -4.363  -6.674 -10.165
  111    HB3  ASP  16           2HB      ASP  16  -3.679  -5.343  -9.253
  112    H    SER  17           H        SER  17  -1.153  -7.042  -7.319
  113    HA   SER  17           HA       SER  17  -1.879  -5.814  -4.891
  114    HB2  SER  17           1HB      SER  17   0.576  -5.663  -4.522
  115    HB3  SER  17           2HB      SER  17   0.090  -7.265  -5.040
  116    HG   SER  17           HG       SER  17   0.895  -6.875  -7.120
  117    H    GLN  18           H        GLN  18  -0.831  -4.719  -8.110
  118    HA   GLN  18           HA       GLN  18  -0.009  -2.172  -7.367
  119    HB2  GLN  18           1HB      GLN  18  -1.185  -3.143 -10.009
  120    HB3  GLN  18           2HB      GLN  18  -0.327  -1.631  -9.791
  121    HG2  GLN  18           1HG      GLN  18   1.694  -2.917  -9.009
  122    HG3  GLN  18           2HG      GLN  18   0.832  -4.415  -9.300
  123   HE21  GLN  18          1HE2      GLN  18   3.076  -2.449 -10.523
  124   HE22  GLN  18          2HE2      GLN  18   2.912  -2.718 -12.226
  125    H    LEU  19           H        LEU  19  -3.133  -3.645  -7.414
  126    HA   LEU  19           HA       LEU  19  -4.628  -1.296  -8.014
  127    HB2  LEU  19           1HB      LEU  19  -5.534  -3.460  -8.489
  128    HB3  LEU  19           2HB      LEU  19  -5.346  -3.973  -6.824
  129    HG   LEU  19           HG       LEU  19  -6.991  -2.081  -6.231
  130   HD11  LEU  19          1HD1      LEU  19  -7.031  -0.774  -8.195
  131   HD12  LEU  19          2HD1      LEU  19  -7.332  -2.190  -9.231
  132   HD13  LEU  19          3HD1      LEU  19  -8.605  -1.603  -8.134
  133   HD21  LEU  19          3HD2      LEU  19  -8.687  -3.889  -7.698
  134   HD22  LEU  19          1HD2      LEU  19  -7.337  -4.779  -6.954
  135   HD23  LEU  19          2HD2      LEU  19  -8.400  -3.769  -5.945
  136    H    ALA  20           H        ALA  20  -4.084  -3.186  -4.953
  137    HA   ALA  20           HA       ALA  20  -5.201  -1.164  -3.337
  138    HB1  ALA  20           3HB      ALA  20  -5.144  -2.910  -1.927
  139    HB2  ALA  20           1HB      ALA  20  -4.144  -3.824  -3.082
  140    HB3  ALA  20           2HB      ALA  20  -3.369  -2.788  -1.859
  141    H    TRP  21           H        TRP  21  -2.031  -1.701  -4.793
  142    HA   TRP  21           HA       TRP  21  -0.658   0.046  -2.985
  143    HB2  TRP  21           1HB      TRP  21   0.716  -1.582  -3.867
  144    HB3  TRP  21           2HB      TRP  21   0.026  -1.464  -5.474
  145    HD1  TRP  21           HD       TRP  21   0.899   0.688  -7.003
  146    HE1  TRP  21           1HE      TRP  21   3.136   2.088  -7.025
  147    HE3  TRP  21           3HE      TRP  21   2.444  -0.719  -2.367
  148    HZ2  TRP  21           2HZ      TRP  21   5.253   2.441  -5.144
  149    HZ3  TRP  21           3HZ      TRP  21   4.607   0.199  -1.535
  150    HH2  TRP  21           HH       TRP  21   5.996   1.728  -2.843
  151    H    ASP  22           H        ASP  22  -2.146   0.175  -6.270
  152    HA   ASP  22           HA       ASP  22  -1.253   2.719  -6.889
  153    HB2  ASP  22           1HB      ASP  22  -2.152   1.371  -8.651
  154    HB3  ASP  22           2HB      ASP  22  -3.622   1.031  -7.760
  155    H    THR  23           H        THR  23  -3.482   1.582  -4.522
  156    HA   THR  23           HA       THR  23  -5.015   4.081  -4.515
  157    HB   THR  23           HB       THR  23  -5.450   1.239  -3.704
  158    HG1  THR  23           1HG      THR  23  -6.704   2.186  -5.370
  159   HG21  THR  23          3HG2      THR  23  -6.838   3.514  -2.204
  160   HG22  THR  23          1HG2      THR  23  -7.060   1.764  -1.962
  161   HG23  THR  23          2HG2      THR  23  -5.534   2.543  -1.479
  162    H    CYS  24           H        CYS  24  -3.329   1.907  -2.143
  163    HA   CYS  24           HA       CYS  24  -3.274   3.900  -0.175
  164    HB2  CYS  24           1HB      CYS  24  -2.466   2.292   1.136
  165    HB3  CYS  24           2HB      CYS  24  -2.846   1.227  -0.202
  166    H    SER  25           H        SER  25  -0.746   2.562  -2.429
  167    HA   SER  25           HA       SER  25   0.928   4.818  -1.766
  168    HB2  SER  25           1HB      SER  25   2.155   3.193  -3.765
  169    HB3  SER  25           2HB      SER  25   2.576   3.308  -2.068
  170    HG   SER  25           HG       SER  25   0.693   1.487  -3.295
  171    H    GLY  26           H        GLY  26  -1.185   5.910  -2.966
  172    HA2  GLY  26           1HA      GLY  26  -0.271   6.420  -5.726
  173    HA3  GLY  26           2HA      GLY  26  -1.958   6.098  -5.378
  174    H    GLY  27           H        GLY  27  -2.537   8.233  -6.174
  175    HA2  GLY  27           1HA      GLY  27  -1.523  10.514  -4.646
  176    HA3  GLY  27           2HA      GLY  27  -2.473  10.555  -6.118
  177    H    THR  28           H        THR  28  -4.299   8.346  -4.886
  178    HA   THR  28           HA       THR  28  -5.656   9.988  -2.871
  179    HB   THR  28           HB       THR  28  -7.787   9.687  -4.087
  180    HG1  THR  28           1HG      THR  28  -7.680   7.889  -5.380
  181   HG21  THR  28          3HG2      THR  28  -7.190  10.759  -6.351
  182   HG22  THR  28          1HG2      THR  28  -6.625  11.657  -4.922
  183   HG23  THR  28          2HG2      THR  28  -5.484  10.656  -5.853
  184    H    GLY  29           H        GLY  29  -7.970   8.114  -2.955
  185    HA2  GLY  29           1HA      GLY  29  -8.587   6.091  -2.151
  186    HA3  GLY  29           2HA      GLY  29  -6.955   5.499  -2.388
  187    H    ASN  30           H        ASN  30  -6.170   4.710  -0.484
  188    HA   ASN  30           HA       ASN  30  -6.536   6.431   1.837
  189    HB2  ASN  30           1HB      ASN  30  -6.349   4.007   3.044
  190    HB3  ASN  30           2HB      ASN  30  -7.892   4.683   2.560
  191   HD21  ASN  30          1HD2      ASN  30  -9.155   3.421   1.444
  192   HD22  ASN  30          2HD2      ASN  30  -8.693   2.105   0.417
  193    H    CYS  31           H        CYS  31  -4.325   7.221   1.184
  194    HA   CYS  31           HA       CYS  31  -2.207   5.277   1.206
  195    HB2  CYS  31           1HB      CYS  31  -0.755   7.084   0.636
  196    HB3  CYS  31           2HB      CYS  31  -2.190   7.167  -0.367
  197    H    GLY  32           H        GLY  32  -0.461   5.302   2.810
  198    HA2  GLY  32           1HA      GLY  32  -0.125   6.933   4.952
  199    HA3  GLY  32           2HA      GLY  32  -1.416   5.866   5.468
  200    H    THR  33           H        THR  33   0.668   5.546   7.026
  201    HA   THR  33           HA       THR  33   2.542   3.635   5.909
  202    HB   THR  33           HB       THR  33   2.191   4.838   8.707
  203    HG1  THR  33           1HG      THR  33   4.031   6.124   7.797
  204   HG21  THR  33          3HG2      THR  33   3.599   2.828   8.846
  205   HG22  THR  33          1HG2      THR  33   4.475   3.297   7.369
  206   HG23  THR  33          2HG2      THR  33   4.666   4.252   8.859
  207    H    VAL  34           H        VAL  34  -0.625   3.486   7.001
  208    HA   VAL  34           HA       VAL  34  -0.405   1.116   8.572
  209    HB   VAL  34           HB       VAL  34  -2.750   2.458   7.212
  210   HG11  VAL  34          1HG1      VAL  34  -4.210   1.047   8.344
  211   HG12  VAL  34          2HG1      VAL  34  -2.902  -0.065   7.871
  212   HG13  VAL  34          3HG1      VAL  34  -2.983   0.558   9.537
  213   HG21  VAL  34          3HG2      VAL  34  -1.516   2.720   9.956
  214   HG22  VAL  34          1HG2      VAL  34  -1.935   3.995   8.787
  215   HG23  VAL  34          2HG2      VAL  34  -3.223   3.128   9.658
  216    H    CYS  35           H        CYS  35  -1.099   1.934   5.136
  217    HA   CYS  35           HA       CYS  35  -1.834  -0.640   4.367
  218    HB2  CYS  35           1HB      CYS  35  -2.271   0.430   2.489
  219    HB3  CYS  35           2HB      CYS  35  -1.535   1.875   3.153
  220    H    CYS  36           H        CYS  36   1.158   0.702   5.443
  221    HA   CYS  36           HA       CYS  36   3.032  -0.552   3.893
  222    HB2  CYS  36           1HB      CYS  36   4.549   0.045   5.472
  223    HB3  CYS  36           2HB      CYS  36   3.225   1.108   5.908
  224    H    GLY  37           H        GLY  37   1.378  -1.724   6.916
  225    HA2  GLY  37           1HA      GLY  37   2.189  -4.472   6.178
  226    HA3  GLY  37           2HA      GLY  37   1.966  -3.895   7.818
  227    H    GLN  38           H        GLN  38  -0.093  -3.239   4.915
  228    HA   GLN  38           HA       GLN  38  -2.217  -4.666   6.318
  229    HB2  GLN  38           1HB      GLN  38  -2.217  -1.984   5.935
  230    HB3  GLN  38           2HB      GLN  38  -2.916  -2.466   4.401
  231    HG2  GLN  38           1HG      GLN  38  -4.794  -2.192   5.840
  232    HG3  GLN  38           2HG      GLN  38  -4.560  -3.927   5.763
  233   HE21  GLN  38          1HE2      GLN  38  -5.943  -2.686   7.803
  234   HE22  GLN  38          2HE2      GLN  38  -5.093  -2.858   9.303
  235    H    CYS  39           H        CYS  39  -0.988  -3.535   3.099
  236    HA   CYS  39           HA       CYS  39  -2.347  -5.853   1.932
  237    HB2  CYS  39           1HB      CYS  39  -1.636  -3.167   0.759
  238    HB3  CYS  39           2HB      CYS  39  -2.029  -4.550  -0.243
  239    H    PHE  40           H        PHE  40   0.664  -4.204   2.664
  240    HA   PHE  40           HA       PHE  40   2.097  -6.349   1.286
  241    HB2  PHE  40           1HB      PHE  40   3.210  -3.527   1.480
  242    HB3  PHE  40           2HB      PHE  40   3.550  -4.743   0.265
  243    HD1  PHE  40           2HD      PHE  40   1.245  -2.100   1.298
  244    HD2  PHE  40           1HD      PHE  40   2.084  -5.033  -1.652
  245    HE1  PHE  40           2HE      PHE  40  -0.394  -1.005  -0.256
  246    HE2  PHE  40           1HE      PHE  40   0.445  -3.938  -3.206
  247    HZ   PHE  40           HZ       PHE  40  -0.774  -1.937  -2.489
  248    H    SER  41           H        SER  41   4.667  -5.854   2.004
  249    HA   SER  41           HA       SER  41   4.721  -5.133   4.779
  250    HB2  SER  41           1HB      SER  41   6.080  -7.475   5.036
  251    HB3  SER  41           2HB      SER  41   4.380  -7.302   5.424
  252    HG   SER  41           HG       SER  41   5.193  -9.097   3.855
  253    H    PHE  42           H        PHE  42   7.015  -4.990   5.592
  254    HA   PHE  42           HA       PHE  42   8.660  -3.732   3.786
  255    HB2  PHE  42           1HB      PHE  42   8.555  -4.489   6.544
  256    HB3  PHE  42           2HB      PHE  42  10.059  -5.175   5.965
  257    HD1  PHE  42           1HD      PHE  42   8.160  -1.967   5.971
  258    HD2  PHE  42           2HD      PHE  42  11.962  -3.850   5.903
  259    HE1  PHE  42           1HE      PHE  42   9.272   0.270   6.211
  260    HE2  PHE  42           2HE      PHE  42  13.075  -1.613   6.142
  261    HZ   PHE  42           HZ       PHE  42  11.716   0.420   6.293
  262    HA   PRO  43           HA       PRO  43  10.792  -3.468   3.819
  263    HB2  PRO  43           1HB      PRO  43  12.464  -3.029   1.702
  264    HB3  PRO  43           2HB      PRO  43  13.012  -3.668   3.239
  265    HG2  PRO  43           1HG      PRO  43  12.605  -5.090   0.679
  266    HG3  PRO  43           2HG      PRO  43  13.533  -5.592   2.078
  267    HD2  PRO  43           1HD      PRO  43  10.941  -6.546   1.306
  268    HD3  PRO  43           2HD      PRO  43  11.819  -6.961   2.765
  269    H    VAL  44           H        VAL  44   8.702  -4.759   1.823
  270    HA   VAL  44           HA       VAL  44   8.400  -2.674  -0.077
  271    HB   VAL  44           HB       VAL  44   6.209  -4.536   0.773
  272   HG11  VAL  44          1HG1      VAL  44   5.987  -4.634  -1.787
  273   HG12  VAL  44          2HG1      VAL  44   5.548  -3.110  -0.980
  274   HG13  VAL  44          3HG1      VAL  44   7.115  -3.258  -1.813
  275   HG21  VAL  44          3HG2      VAL  44   7.593  -6.296   0.596
  276   HG22  VAL  44          1HG2      VAL  44   7.578  -5.964  -1.153
  277   HG23  VAL  44          2HG2      VAL  44   8.889  -5.320  -0.136
  278    H    SER  45           H        SER  45   7.074  -3.411   3.175
  279    HA   SER  45           HA       SER  45   5.005  -1.666   3.226
  280    HB2  SER  45           1HB      SER  45   5.001  -2.728   5.232
  281    HB3  SER  45           2HB      SER  45   6.730  -3.008   5.180
  282    HG   SER  45           HG       SER  45   6.132  -1.628   6.964
  283    H    GLN  46           H        GLN  46   8.422  -0.995   2.987
  284    HA   GLN  46           HA       GLN  46   8.219   1.626   4.086
  285    HB2  GLN  46           1HB      GLN  46  10.295  -0.025   3.929
  286    HB3  GLN  46           2HB      GLN  46  10.518   0.706   2.352
  287    HG2  GLN  46           1HG      GLN  46  10.004   2.852   4.184
  288    HG3  GLN  46           2HG      GLN  46  11.164   1.796   4.965
  289   HE21  GLN  46          1HE2      GLN  46  12.335   3.932   4.601
  290   HE22  GLN  46          2HE2      GLN  46  13.308   4.062   3.174
  291    H    SER  47           H        SER  47   7.937   0.056   0.922
  292    HA   SER  47           HA       SER  47   8.289   2.450  -0.541
  293    HB2  SER  47           1HB      SER  47   8.460  -0.143  -1.224
  294    HB3  SER  47           2HB      SER  47   6.780   0.097  -1.663
  295    HG   SER  47           HG       SER  47   8.438   0.518  -3.383
  296    H    CYS  48           H        CYS  48   5.553   0.613   0.861
  297    HA   CYS  48           HA       CYS  48   3.470   1.776  -0.491
  298    HB2  CYS  48           1HB      CYS  48   2.828   0.014   0.816
  299    HB3  CYS  48           2HB      CYS  48   3.803   0.511   2.185
  300    H    ALA  49           H        ALA  49   4.839   2.730   2.754
  301    HA   ALA  49           HA       ALA  49   3.420   5.159   2.841
  302    HB1  ALA  49           3HB      ALA  49   5.446   5.555   4.576
  303    HB2  ALA  49           1HB      ALA  49   4.064   4.494   4.942
  304    HB3  ALA  49           2HB      ALA  49   5.597   3.793   4.369
  305    H    GLY  50           H        GLY  50   6.084   4.116   0.947
  306    HA2  GLY  50           1HA      GLY  50   7.421   6.676   0.811
  307    HA3  GLY  50           2HA      GLY  50   7.777   5.226  -0.107
  308    H    MET  51           H        MET  51   5.499   4.574  -1.460
  309    HA   MET  51           HA       MET  51   5.317   6.788  -3.275
  310    HB2  MET  51           1HB      MET  51   5.617   4.244  -3.841
  311    HB3  MET  51           2HB      MET  51   3.914   4.075  -3.465
  312    HG2  MET  51           1HG      MET  51   4.048   4.415  -5.851
  313    HG3  MET  51           2HG      MET  51   3.436   5.913  -5.179
  314    HE1  MET  51           3HE      MET  51   5.102   8.454  -5.860
  315    HE2  MET  51           1HE      MET  51   5.173   7.836  -7.528
  316    HE3  MET  51           2HE      MET  51   3.777   7.449  -6.494
  317    H    ALA  52           H        ALA  52   3.965   6.740  -0.503
  318    HA   ALA  52           HA       ALA  52   1.159   6.728  -1.239
  319    HB1  ALA  52           3HB      ALA  52   0.992   6.070   0.901
  320    HB2  ALA  52           1HB      ALA  52   2.734   6.339   1.144
  321    HB3  ALA  52           2HB      ALA  52   1.582   7.668   1.418
  322    H    ASP  53           H        ASP  53   2.699   8.614  -2.704
  323    HA   ASP  53           HA       ASP  53   2.806  10.714  -3.238
  324    HB2  ASP  53           1HB      ASP  53   0.256  10.349  -3.022
  325    HB3  ASP  53           2HB      ASP  53   0.360  11.163  -1.474
  326    H    SER  54           H        SER  54   2.722  13.157  -2.207
  327    HA   SER  54           HA       SER  54   4.148  12.906   0.310
  328    HB2  SER  54           1HB      SER  54   4.381  14.640  -2.071
  329    HB3  SER  54           2HB      SER  54   4.451  15.541  -0.570
  330    HG   SER  54           HG       SER  54   6.477  14.341  -1.650
  331    H    ASN  55           H        ASN  55   2.513  15.819  -1.038
  332    HA   ASN  55           HA       ASN  55   0.878  15.819   1.375
  333    HB2  ASN  55           1HB      ASN  55   2.663  17.763   0.509
  334    HB3  ASN  55           2HB      ASN  55   1.164  18.360  -0.176
  335   HD21  ASN  55          1HD2      ASN  55   2.974  17.697   2.692
  336   HD22  ASN  55          2HD2      ASN  55   1.922  18.444   3.848
  337    H    ASP  56           H        ASP  56   0.918  15.350  -1.996
  338    HA   ASP  56           HA       ASP  56  -1.437  16.728  -2.683
  339    HB2  ASP  56           1HB      ASP  56   0.449  14.798  -3.942
  340    HB3  ASP  56           2HB      ASP  56  -1.193  14.680  -4.542
  341    H    CYS  57           H        CYS  57  -0.815  14.015  -0.740
  342    HA   CYS  57           HA       CYS  57  -2.931  12.330  -1.600
  343    HB2  CYS  57           1HB      CYS  57  -0.750  12.182   0.211
  344    HB3  CYS  57           2HB      CYS  57  -2.205  11.867   1.136
  345    HA   PRO  58           HA       PRO  58  -6.158  14.109   0.725
  346    HB2  PRO  58           1HB      PRO  58  -7.586  11.977   1.666
  347    HB3  PRO  58           2HB      PRO  58  -7.701  12.555   0.015
  348    HG2  PRO  58           1HG      PRO  58  -6.319  10.154   1.047
  349    HG3  PRO  58           2HG      PRO  58  -6.806  10.519  -0.596
  350    HD2  PRO  58           1HD      PRO  58  -4.154  10.683   0.485
  351    HD3  PRO  58           2HD      PRO  58  -4.662  11.158  -1.124
  352    H    ASN  59           H        ASN  59  -4.003  14.583   2.123
  353    HA   ASN  59           HA       ASN  59  -4.286  13.396   4.695
  354    HB2  ASN  59           1HB      ASN  59  -2.482  15.530   3.484
  355    HB3  ASN  59           2HB      ASN  59  -2.486  15.269   5.216
  356   HD21  ASN  59          1HD2      ASN  59  -0.885  14.063   5.853
  357   HD22  ASN  59          2HD2      ASN  59  -0.222  12.677   5.054
  358    H    ALA  60           H        ALA  60  -4.474  14.899   6.700
  359    HA   ALA  60           HA       ALA  60  -5.907  16.181   7.846
  360    HB1  ALA  60           3HB      ALA  60  -5.479  18.592   6.259
  361    HB2  ALA  60           1HB      ALA  60  -4.899  18.193   7.894
  362    HB3  ALA  60           2HB      ALA  60  -3.968  17.674   6.468
  Start of MODEL   15
    1    H1   ASP   1           H        ASP   1  10.229  -5.392  -6.017
    2    HA   ASP   1           HA       ASP   1   8.001  -6.529  -7.488
    3    HB2  ASP   1           1HB      ASP   1   8.677  -8.633  -6.157
    4    HB3  ASP   1           2HB      ASP   1   9.804  -8.080  -7.379
    5    H    ILE   2           H        ILE   2   6.027  -6.039  -6.505
    6    HA   ILE   2           HA       ILE   2   5.994  -5.975  -3.569
    7    HB   ILE   2           HB       ILE   2   4.480  -4.280  -3.605
    8   HG12  ILE   2          1HG1      ILE   2   3.673  -5.070  -6.420
    9   HG13  ILE   2          2HG1      ILE   2   2.788  -5.430  -4.951
   10   HG21  ILE   2          1HG2      ILE   2   6.584  -3.472  -4.548
   11   HG22  ILE   2          2HG2      ILE   2   6.001  -3.839  -6.190
   12   HG23  ILE   2          3HG2      ILE   2   5.194  -2.584  -5.219
   13   HD11  ILE   2          3HD1      ILE   2   1.703  -3.460  -5.247
   14   HD12  ILE   2          1HD1      ILE   2   3.226  -2.649  -4.810
   15   HD13  ILE   2          2HD1      ILE   2   2.841  -2.958  -6.520
   16    H    GLU   3           H        GLU   3   4.514  -7.234  -6.568
   17    HA   GLU   3           HA       GLU   3   2.284  -8.376  -5.498
   18    HB2  GLU   3           1HB      GLU   3   2.824  -8.245  -7.928
   19    HB3  GLU   3           2HB      GLU   3   4.061  -9.469  -7.725
   20    HG2  GLU   3           1HG      GLU   3   2.535 -11.189  -7.573
   21    HG3  GLU   3           2HG      GLU   3   1.389 -10.235  -6.651
   22    H    ASP   4           H        ASP   4   5.683  -9.338  -5.231
   23    HA   ASP   4           HA       ASP   4   5.138 -11.982  -4.439
   24    HB2  ASP   4           1HB      ASP   4   7.577 -10.206  -3.957
   25    HB3  ASP   4           2HB      ASP   4   7.540 -11.933  -3.666
   26    H    PHE   5           H        PHE   5   4.797  -8.882  -2.968
   27    HA   PHE   5           HA       PHE   5   4.856 -10.101  -0.296
   28    HB2  PHE   5           1HB      PHE   5   5.706  -7.437  -1.484
   29    HB3  PHE   5           2HB      PHE   5   5.070  -7.408   0.148
   30    HD1  PHE   5           1HD      PHE   5   6.276  -8.510   1.974
   31    HD2  PHE   5           2HD      PHE   5   7.854  -8.435  -1.965
   32    HE1  PHE   5           1HE      PHE   5   8.530  -9.164   2.864
   33    HE2  PHE   5           2HE      PHE   5  10.108  -9.088  -1.074
   34    HZ   PHE   5           HZ       PHE   5  10.419  -9.445   1.329
   35    H    TYR   6           H        TYR   6   2.674  -9.791  -2.480
   36    HA   TYR   6           HA       TYR   6   0.873  -7.858  -1.373
   37    HB2  TYR   6           1HB      TYR   6   1.119  -8.725  -3.813
   38    HB3  TYR   6           2HB      TYR   6   0.468 -10.257  -3.264
   39    HD1  TYR   6           2HD      TYR   6  -0.879  -7.210  -1.767
   40    HD2  TYR   6           1HD      TYR   6  -1.338 -10.027  -4.954
   41    HE1  TYR   6           2HE      TYR   6  -3.238  -6.361  -2.188
   42    HE2  TYR   6           1HE      TYR   6  -3.696  -9.169  -5.364
   43    HH   TYR   6           HH       TYR   6  -4.802  -6.284  -4.129
   44    H    THR   7           H        THR   7  -0.437  -8.135   0.359
   45    HA   THR   7           HA       THR   7  -0.938 -10.904   1.219
   46    HB   THR   7           HB       THR   7  -1.159  -9.926   3.461
   47    HG1  THR   7           1HG      THR   7  -2.200  -7.939   2.533
   48   HG21  THR   7          3HG2      THR   7   1.087  -8.211   2.423
   49   HG22  THR   7          1HG2      THR   7   1.057  -9.297   3.833
   50   HG23  THR   7          2HG2      THR   7   1.250  -9.969   2.196
   51    H    SER   8           H        SER   8  -2.649 -11.306  -0.265
   52    HA   SER   8           HA       SER   8  -4.836  -9.543  -0.375
   53    HB2  SER   8           1HB      SER   8  -4.770 -10.828  -2.287
   54    HB3  SER   8           2HB      SER   8  -4.128 -12.232  -1.458
   55    HG   SER   8           HG       SER   8  -6.408 -12.387  -2.262
   56    H    GLU   9           H        GLU   9  -3.721 -11.447   2.125
   57    HA   GLU   9           HA       GLU   9  -6.166 -12.625   2.928
   58    HB2  GLU   9           1HB      GLU   9  -3.460 -12.910   3.606
   59    HB3  GLU   9           2HB      GLU   9  -4.169 -12.222   5.054
   60    HG2  GLU   9           1HG      GLU   9  -6.062 -14.137   4.318
   61    HG3  GLU   9           2HG      GLU   9  -4.555 -14.907   3.861
   62    H    THR  10           H        THR  10  -4.216  -9.747   3.953
   63    HA   THR  10           HA       THR  10  -6.486  -8.882   5.596
   64    HB   THR  10           HB       THR  10  -4.470  -8.850   6.865
   65    HG1  THR  10           1HG      THR  10  -4.135  -6.522   6.998
   66   HG21  THR  10          3HG2      THR  10  -2.609  -9.162   5.475
   67   HG22  THR  10          1HG2      THR  10  -3.227  -8.047   4.233
   68   HG23  THR  10          2HG2      THR  10  -2.495  -7.403   5.723
   69    H    CYS  11           H        CYS  11  -4.782  -8.254   2.591
   70    HA   CYS  11           HA       CYS  11  -5.510  -5.580   2.296
   71    HB2  CYS  11           1HB      CYS  11  -3.795  -6.832   0.967
   72    HB3  CYS  11           2HB      CYS  11  -5.100  -7.622   0.104
   73    HA   PRO  12           HA       PRO  12  -9.773  -6.121   1.511
   74    HB2  PRO  12           1HB      PRO  12 -10.386  -3.613   0.615
   75    HB3  PRO  12           2HB      PRO  12 -10.260  -4.019   2.315
   76    HG2  PRO  12           1HG      PRO  12  -8.358  -2.518   0.621
   77    HG3  PRO  12           2HG      PRO  12  -8.466  -2.570   2.370
   78    HD2  PRO  12           1HD      PRO  12  -6.548  -3.931   0.728
   79    HD3  PRO  12           2HD      PRO  12  -6.729  -4.073   2.465
   80    H    TYR  13           H        TYR  13  -7.448  -5.868  -0.790
   81    HA   TYR  13           HA       TYR  13  -9.459  -6.437  -2.859
   82    HB2  TYR  13           1HB      TYR  13  -6.741  -5.002  -3.079
   83    HB3  TYR  13           2HB      TYR  13  -7.885  -5.204  -4.391
   84    HD1  TYR  13           1HD      TYR  13 -10.041  -3.932  -4.378
   85    HD2  TYR  13           2HD      TYR  13  -6.983  -3.233  -1.468
   86    HE1  TYR  13           1HE      TYR  13 -11.110  -1.704  -3.778
   87    HE2  TYR  13           2HE      TYR  13  -8.063  -1.008  -0.878
   88    HH   TYR  13           HH       TYR  13 -10.959   0.106  -2.612
   89    H    LYS  14           H        LYS  14  -9.037  -8.188  -4.197
   90    HA   LYS  14           HA       LYS  14  -6.433  -9.481  -3.839
   91    HB2  LYS  14           1HB      LYS  14  -7.788 -11.684  -3.933
   92    HB3  LYS  14           2HB      LYS  14  -7.680 -10.815  -2.416
   93    HG2  LYS  14           1HG      LYS  14 -10.002 -11.428  -2.715
   94    HG3  LYS  14           2HG      LYS  14  -9.894  -9.696  -2.959
   95    HD2  LYS  14           1HD      LYS  14  -9.488 -11.295  -5.437
   96    HD3  LYS  14           2HD      LYS  14 -11.078 -11.477  -4.724
   97    HE2  LYS  14           1HE      LYS  14 -10.860  -8.774  -4.539
   98    HE3  LYS  14           2HE      LYS  14  -9.792  -9.028  -5.905
   99    HZ1  LYS  14           3HZ      LYS  14 -12.459 -10.231  -5.816
  100    HZ2  LYS  14           1HZ      LYS  14 -12.220  -8.720  -6.387
  101    HZ3  LYS  14           2HZ      LYS  14 -11.502  -9.991  -7.118
  102    H    ASN  15           H        ASN  15  -7.496  -7.645  -5.902
  103    HA   ASN  15           HA       ASN  15  -7.990  -9.458  -8.092
  104    HB2  ASN  15           1HB      ASN  15  -8.941  -6.907  -7.490
  105    HB3  ASN  15           2HB      ASN  15  -7.690  -6.544  -8.662
  106   HD21  ASN  15          1HD2      ASN  15 -10.638  -8.342  -8.043
  107   HD22  ASN  15          2HD2      ASN  15 -11.126  -8.581  -9.688
  108    H    ASP  16           H        ASP  16  -5.674  -6.957  -6.881
  109    HA   ASP  16           HA       ASP  16  -3.552  -8.226  -8.243
  110    HB2  ASP  16           1HB      ASP  16  -4.887  -6.396  -9.807
  111    HB3  ASP  16           2HB      ASP  16  -3.723  -5.344  -9.025
  112    H    SER  17           H        SER  17  -1.468  -7.373  -7.433
  113    HA   SER  17           HA       SER  17  -1.697  -6.254  -4.877
  114    HB2  SER  17           1HB      SER  17   0.864  -6.164  -5.059
  115    HB3  SER  17           2HB      SER  17   0.125  -7.743  -5.242
  116    HG   SER  17           HG       SER  17   1.691  -6.374  -7.013
  117    H    GLN  18           H        GLN  18  -0.906  -4.990  -8.136
  118    HA   GLN  18           HA       GLN  18   0.012  -2.504  -7.191
  119    HB2  GLN  18           1HB      GLN  18  -0.846  -3.574  -9.895
  120    HB3  GLN  18           2HB      GLN  18  -0.478  -1.873  -9.695
  121    HG2  GLN  18           1HG      GLN  18   1.773  -2.251  -9.530
  122    HG3  GLN  18           2HG      GLN  18   1.562  -3.626  -8.465
  123   HE21  GLN  18          1HE2      GLN  18   1.313  -2.550 -11.823
  124   HE22  GLN  18          2HE2      GLN  18   1.666  -4.068 -12.579
  125    H    LEU  19           H        LEU  19  -3.141  -3.937  -7.716
  126    HA   LEU  19           HA       LEU  19  -4.594  -1.591  -8.222
  127    HB2  LEU  19           1HB      LEU  19  -5.634  -3.586  -8.775
  128    HB3  LEU  19           2HB      LEU  19  -5.238  -4.348  -7.248
  129    HG   LEU  19           HG       LEU  19  -7.671  -3.748  -7.639
  130   HD11  LEU  19          1HD1      LEU  19  -8.073  -3.486  -5.377
  131   HD12  LEU  19          2HD1      LEU  19  -6.426  -4.162  -5.389
  132   HD13  LEU  19          3HD1      LEU  19  -6.671  -2.416  -5.139
  133   HD21  LEU  19          3HD2      LEU  19  -7.972  -1.677  -8.459
  134   HD22  LEU  19          1HD2      LEU  19  -7.926  -1.197  -6.745
  135   HD23  LEU  19          2HD2      LEU  19  -6.462  -1.056  -7.749
  136    H    ALA  20           H        ALA  20  -4.193  -3.485  -5.141
  137    HA   ALA  20           HA       ALA  20  -5.417  -1.566  -3.537
  138    HB1  ALA  20           3HB      ALA  20  -5.246  -3.526  -2.391
  139    HB2  ALA  20           1HB      ALA  20  -3.737  -3.993  -3.211
  140    HB3  ALA  20           2HB      ALA  20  -3.692  -2.849  -1.848
  141    H    TRP  21           H        TRP  21  -2.083  -1.915  -4.776
  142    HA   TRP  21           HA       TRP  21  -0.943  -0.001  -3.037
  143    HB2  TRP  21           1HB      TRP  21   0.592  -1.448  -3.953
  144    HB3  TRP  21           2HB      TRP  21  -0.127  -1.394  -5.551
  145    HD1  TRP  21           HD       TRP  21   0.315   1.092  -6.908
  146    HE1  TRP  21           1HE      TRP  21   2.454   2.634  -7.006
  147    HE3  TRP  21           3HE      TRP  21   2.482  -0.751  -2.693
  148    HZ2  TRP  21           2HZ      TRP  21   4.760   2.904  -5.347
  149    HZ3  TRP  21           3HZ      TRP  21   4.677   0.207  -2.002
  150    HH2  TRP  21           HH       TRP  21   5.813   1.972  -3.254
  151    H    ASP  22           H        ASP  22  -2.501   0.054  -6.285
  152    HA   ASP  22           HA       ASP  22  -1.850   2.675  -6.883
  153    HB2  ASP  22           1HB      ASP  22  -2.735   1.052  -8.533
  154    HB3  ASP  22           2HB      ASP  22  -4.268   0.989  -7.685
  155    H    THR  23           H        THR  23  -3.908   1.312  -4.478
  156    HA   THR  23           HA       THR  23  -5.786   3.529  -4.437
  157    HB   THR  23           HB       THR  23  -5.583   0.764  -3.412
  158    HG1  THR  23           1HG      THR  23  -7.987   1.335  -3.470
  159   HG21  THR  23          3HG2      THR  23  -7.301   1.489  -1.532
  160   HG22  THR  23          1HG2      THR  23  -5.560   1.552  -1.168
  161   HG23  THR  23          2HG2      THR  23  -6.435   3.044  -1.590
  162    H    CYS  24           H        CYS  24  -3.313   2.079  -2.211
  163    HA   CYS  24           HA       CYS  24  -3.471   4.408  -0.552
  164    HB2  CYS  24           1HB      CYS  24  -2.941   2.799   0.887
  165    HB3  CYS  24           2HB      CYS  24  -2.366   1.726  -0.373
  166    H    SER  25           H        SER  25  -0.694   2.719  -2.205
  167    HA   SER  25           HA       SER  25   0.726   5.185  -2.292
  168    HB2  SER  25           1HB      SER  25   2.150   3.375  -3.860
  169    HB3  SER  25           2HB      SER  25   2.387   3.653  -2.146
  170    HG   SER  25           HG       SER  25   0.569   1.703  -3.287
  171    H    GLY  26           H        GLY  26  -1.545   5.741  -3.652
  172    HA2  GLY  26           1HA      GLY  26  -0.729   5.619  -6.495
  173    HA3  GLY  26           2HA      GLY  26  -2.390   5.421  -5.972
  174    H    GLY  27           H        GLY  27  -0.908   7.578  -3.819
  175    HA2  GLY  27           1HA      GLY  27  -0.543   9.879  -3.941
  176    HA3  GLY  27           2HA      GLY  27  -1.374   9.947  -5.483
  177    H    THR  28           H        THR  28  -3.683   8.276  -4.634
  178    HA   THR  28           HA       THR  28  -4.906  10.091  -2.664
  179    HB   THR  28           HB       THR  28  -6.931  10.099  -4.081
  180    HG1  THR  28           1HG      THR  28  -6.653   7.967  -4.992
  181   HG21  THR  28          3HG2      THR  28  -4.320  10.691  -5.547
  182   HG22  THR  28          1HG2      THR  28  -5.902  10.947  -6.322
  183   HG23  THR  28          2HG2      THR  28  -5.475  11.854  -4.852
  184    H    GLY  29           H        GLY  29  -7.471   8.609  -2.952
  185    HA2  GLY  29           1HA      GLY  29  -8.500   6.793  -2.103
  186    HA3  GLY  29           2HA      GLY  29  -7.027   5.875  -2.343
  187    H    ASN  30           H        ASN  30  -6.333   4.951  -0.470
  188    HA   ASN  30           HA       ASN  30  -6.629   6.575   1.935
  189    HB2  ASN  30           1HB      ASN  30  -6.392   4.095   2.987
  190    HB3  ASN  30           2HB      ASN  30  -7.948   4.735   2.493
  191   HD21  ASN  30          1HD2      ASN  30  -5.700   2.273   2.138
  192   HD22  ASN  30          2HD2      ASN  30  -6.343   1.464   0.748
  193    H    CYS  31           H        CYS  31  -4.388   7.235   0.682
  194    HA   CYS  31           HA       CYS  31  -2.259   5.408   0.889
  195    HB2  CYS  31           1HB      CYS  31  -0.935   7.056   0.015
  196    HB3  CYS  31           2HB      CYS  31  -2.515   7.518  -0.586
  197    H    GLY  32           H        GLY  32  -0.460   5.480   2.442
  198    HA2  GLY  32           1HA      GLY  32   0.059   7.041   4.520
  199    HA3  GLY  32           2HA      GLY  32  -1.368   6.215   5.113
  200    H    THR  33           H        THR  33   0.775   5.738   6.623
  201    HA   THR  33           HA       THR  33   2.393   3.587   5.666
  202    HB   THR  33           HB       THR  33   1.912   4.685   8.486
  203    HG1  THR  33           1HG      THR  33   2.901   6.385   7.456
  204   HG21  THR  33          3HG2      THR  33   4.095   2.987   7.195
  205   HG22  THR  33          1HG2      THR  33   4.419   3.988   8.631
  206   HG23  THR  33          2HG2      THR  33   3.220   2.675   8.713
  207    H    VAL  34           H        VAL  34  -0.857   3.705   6.411
  208    HA   VAL  34           HA       VAL  34  -1.078   1.361   7.985
  209    HB   VAL  34           HB       VAL  34  -3.065   2.771   6.191
  210   HG11  VAL  34          1HG1      VAL  34  -4.782   1.538   7.170
  211   HG12  VAL  34          2HG1      VAL  34  -3.502   0.320   6.956
  212   HG13  VAL  34          3HG1      VAL  34  -3.780   1.046   8.557
  213   HG21  VAL  34          3HG2      VAL  34  -3.853   3.546   8.584
  214   HG22  VAL  34          1HG2      VAL  34  -2.158   3.218   9.018
  215   HG23  VAL  34          2HG2      VAL  34  -2.537   4.399   7.741
  216    H    CYS  35           H        CYS  35  -1.532   2.064   4.451
  217    HA   CYS  35           HA       CYS  35  -2.057  -0.575   3.753
  218    HB2  CYS  35           1HB      CYS  35  -2.424   0.342   1.778
  219    HB3  CYS  35           2HB      CYS  35  -1.943   1.883   2.460
  220    H    CYS  36           H        CYS  36   0.814   1.026   4.846
  221    HA   CYS  36           HA       CYS  36   2.799  -0.230   3.426
  222    HB2  CYS  36           1HB      CYS  36   4.169   0.800   4.844
  223    HB3  CYS  36           2HB      CYS  36   2.714   1.548   5.473
  224    H    GLY  37           H        GLY  37   1.118  -1.230   6.491
  225    HA2  GLY  37           1HA      GLY  37   2.127  -3.974   6.035
  226    HA3  GLY  37           2HA      GLY  37   1.826  -3.267   7.610
  227    H    GLN  38           H        GLN  38  -0.179  -3.042   4.602
  228    HA   GLN  38           HA       GLN  38  -2.256  -4.447   6.094
  229    HB2  GLN  38           1HB      GLN  38  -2.517  -1.877   5.622
  230    HB3  GLN  38           2HB      GLN  38  -2.860  -2.365   3.974
  231    HG2  GLN  38           1HG      GLN  38  -4.828  -3.539   4.585
  232    HG3  GLN  38           2HG      GLN  38  -4.325  -3.720   6.254
  233   HE21  GLN  38          1HE2      GLN  38  -5.541  -2.609   7.564
  234   HE22  GLN  38          2HE2      GLN  38  -6.177  -1.016   7.320
  235    H    CYS  39           H        CYS  39  -1.116  -3.506   2.773
  236    HA   CYS  39           HA       CYS  39  -2.223  -6.051   1.839
  237    HB2  CYS  39           1HB      CYS  39  -1.632  -3.529   0.275
  238    HB3  CYS  39           2HB      CYS  39  -2.209  -5.034  -0.412
  239    H    PHE  40           H        PHE  40   0.612  -4.162   2.535
  240    HA   PHE  40           HA       PHE  40   2.243  -6.217   1.244
  241    HB2  PHE  40           1HB      PHE  40   3.117  -3.307   1.391
  242    HB3  PHE  40           2HB      PHE  40   3.601  -4.523   0.226
  243    HD1  PHE  40           1HD      PHE  40   1.987  -5.185  -1.587
  244    HD2  PHE  40           2HD      PHE  40   1.290  -1.864   0.961
  245    HE1  PHE  40           1HE      PHE  40   0.317  -4.279  -3.226
  246    HE2  PHE  40           2HE      PHE  40  -0.381  -0.957  -0.678
  247    HZ   PHE  40           HZ       PHE  40  -0.848  -2.175  -2.752
  248    H    SER  41           H        SER  41   4.702  -5.762   2.040
  249    HA   SER  41           HA       SER  41   4.691  -4.827   4.759
  250    HB2  SER  41           1HB      SER  41   6.034  -7.109   5.253
  251    HB3  SER  41           2HB      SER  41   4.302  -6.975   5.484
  252    HG   SER  41           HG       SER  41   3.965  -7.916   3.395
  253    H    PHE  42           H        PHE  42   6.956  -4.593   5.612
  254    HA   PHE  42           HA       PHE  42   8.639  -3.434   3.787
  255    HB2  PHE  42           1HB      PHE  42   8.481  -4.055   6.573
  256    HB3  PHE  42           2HB      PHE  42   9.995  -4.773   6.061
  257    HD1  PHE  42           1HD      PHE  42   8.112  -1.562   5.810
  258    HD2  PHE  42           2HD      PHE  42  11.901  -3.461   6.030
  259    HE1  PHE  42           1HE      PHE  42   9.228   0.681   5.961
  260    HE2  PHE  42           2HE      PHE  42  13.017  -1.218   6.181
  261    HZ   PHE  42           HZ       PHE  42  11.667   0.826   6.145
  262    HA   PRO  43           HA       PRO  43  10.757  -3.149   3.823
  263    HB2  PRO  43           1HB      PRO  43  12.447  -2.802   1.704
  264    HB3  PRO  43           2HB      PRO  43  12.985  -3.355   3.278
  265    HG2  PRO  43           1HG      PRO  43  12.621  -4.912   0.791
  266    HG3  PRO  43           2HG      PRO  43  13.539  -5.331   2.223
  267    HD2  PRO  43           1HD      PRO  43  10.965  -6.352   1.475
  268    HD3  PRO  43           2HD      PRO  43  11.831  -6.681   2.963
  269    H    VAL  44           H        VAL  44   8.672  -4.545   1.921
  270    HA   VAL  44           HA       VAL  44   8.377  -2.597  -0.119
  271    HB   VAL  44           HB       VAL  44   6.196  -4.400   0.883
  272   HG11  VAL  44          1HG1      VAL  44   7.032  -3.293  -1.808
  273   HG12  VAL  44          2HG1      VAL  44   5.866  -4.627  -1.640
  274   HG13  VAL  44          3HG1      VAL  44   5.507  -3.037  -0.926
  275   HG21  VAL  44          3HG2      VAL  44   7.631  -5.840  -1.062
  276   HG22  VAL  44          1HG2      VAL  44   8.851  -5.243   0.088
  277   HG23  VAL  44          2HG2      VAL  44   7.478  -6.215   0.671
  278    H    SER  45           H        SER  45   7.017  -3.113   3.167
  279    HA   SER  45           HA       SER  45   4.984  -1.324   3.084
  280    HB2  SER  45           1HB      SER  45   4.898  -2.211   5.164
  281    HB3  SER  45           2HB      SER  45   6.595  -2.645   5.120
  282    HG   SER  45           HG       SER  45   5.739   0.068   5.612
  283    H    GLN  46           H        GLN  46   8.407  -0.742   2.825
  284    HA   GLN  46           HA       GLN  46   8.308   1.911   3.833
  285    HB2  GLN  46           1HB      GLN  46  10.343   0.324   3.772
  286    HB3  GLN  46           2HB      GLN  46  10.473   0.707   2.067
  287    HG2  GLN  46           1HG      GLN  46  10.153   3.191   3.501
  288    HG3  GLN  46           2HG      GLN  46  11.388   2.258   4.323
  289   HE21  GLN  46          1HE2      GLN  46  11.109   4.617   2.266
  290   HE22  GLN  46          2HE2      GLN  46  12.403   4.337   1.149
  291    H    SER  47           H        SER  47   7.900   0.279   0.704
  292    HA   SER  47           HA       SER  47   8.209   2.656  -0.801
  293    HB2  SER  47           1HB      SER  47   6.787   0.125  -1.704
  294    HB3  SER  47           2HB      SER  47   7.612   1.305  -2.704
  295    HG   SER  47           HG       SER  47   9.298  -0.001  -2.520
  296    H    CYS  48           H        CYS  48   5.472   0.701   0.503
  297    HA   CYS  48           HA       CYS  48   3.400   1.967  -0.767
  298    HB2  CYS  48           1HB      CYS  48   2.791   0.078   0.391
  299    HB3  CYS  48           2HB      CYS  48   3.694   0.518   1.827
  300    H    ALA  49           H        ALA  49   4.780   2.667   2.537
  301    HA   ALA  49           HA       ALA  49   3.325   5.055   2.848
  302    HB1  ALA  49           3HB      ALA  49   5.364   3.484   4.267
  303    HB2  ALA  49           1HB      ALA  49   5.563   5.239   4.489
  304    HB3  ALA  49           2HB      ALA  49   4.021   4.459   4.912
  305    H    GLY  50           H        GLY  50   5.984   4.216   0.840
  306    HA2  GLY  50           1HA      GLY  50   7.241   6.827   0.881
  307    HA3  GLY  50           2HA      GLY  50   7.655   5.449  -0.120
  308    H    MET  51           H        MET  51   5.393   4.795  -1.511
  309    HA   MET  51           HA       MET  51   5.147   7.093  -3.206
  310    HB2  MET  51           1HB      MET  51   5.523   4.643  -3.961
  311    HB3  MET  51           2HB      MET  51   3.867   4.321  -3.487
  312    HG2  MET  51           1HG      MET  51   3.364   4.912  -5.645
  313    HG3  MET  51           2HG      MET  51   3.498   6.556  -5.052
  314    HE1  MET  51           3HE      MET  51   4.436   3.900  -7.077
  315    HE2  MET  51           1HE      MET  51   5.497   4.643  -8.297
  316    HE3  MET  51           2HE      MET  51   6.203   3.746  -6.931
  317    H    ALA  52           H        ALA  52   3.765   6.706  -0.410
  318    HA   ALA  52           HA       ALA  52   0.976   6.822  -1.217
  319    HB1  ALA  52           3HB      ALA  52   2.520   6.206   1.203
  320    HB2  ALA  52           1HB      ALA  52   1.150   7.295   1.524
  321    HB3  ALA  52           2HB      ALA  52   0.870   5.718   0.749
  322    H    ASP  53           H        ASP  53   2.857   8.901  -2.155
  323    HA   ASP  53           HA       ASP  53   2.959  11.054  -2.373
  324    HB2  ASP  53           1HB      ASP  53   0.198  10.575  -1.460
  325    HB3  ASP  53           2HB      ASP  53   0.752  12.179  -1.023
  326    H    SER  54           H        SER  54   3.336  13.167  -1.126
  327    HA   SER  54           HA       SER  54   4.061  12.504   1.609
  328    HB2  SER  54           1HB      SER  54   5.320  14.041  -0.535
  329    HB3  SER  54           2HB      SER  54   5.167  15.020   0.911
  330    HG   SER  54           HG       SER  54   6.205  13.252   2.111
  331    H    ASN  55           H        ASN  55   3.202  15.567  -0.164
  332    HA   ASN  55           HA       ASN  55   1.400  16.128   2.059
  333    HB2  ASN  55           1HB      ASN  55   3.563  17.642   1.237
  334    HB3  ASN  55           2HB      ASN  55   2.287  18.376   0.286
  335   HD21  ASN  55          1HD2      ASN  55   2.782  20.249   1.596
  336   HD22  ASN  55          2HD2      ASN  55   2.031  20.457   3.143
  337    H    ASP  56           H        ASP  56   1.659  15.250  -1.215
  338    HA   ASP  56           HA       ASP  56  -0.342  16.903  -2.301
  339    HB2  ASP  56           1HB      ASP  56   0.890  14.251  -3.163
  340    HB3  ASP  56           2HB      ASP  56  -0.336  15.059  -4.121
  341    H    CYS  57           H        CYS  57  -0.236  14.007  -0.326
  342    HA   CYS  57           HA       CYS  57  -2.743  12.954  -1.156
  343    HB2  CYS  57           1HB      CYS  57  -0.569  12.125   0.475
  344    HB3  CYS  57           2HB      CYS  57  -2.009  12.079   1.472
  345    HA   PRO  58           HA       PRO  58  -5.255  15.381   1.445
  346    HB2  PRO  58           1HB      PRO  58  -7.359  13.715   1.964
  347    HB3  PRO  58           2HB      PRO  58  -7.187  14.603   0.463
  348    HG2  PRO  58           1HG      PRO  58  -6.739  11.727   0.976
  349    HG3  PRO  58           2HG      PRO  58  -6.988  12.543  -0.555
  350    HD2  PRO  58           1HD      PRO  58  -4.494  11.594   0.499
  351    HD3  PRO  58           2HD      PRO  58  -4.728  12.512  -0.976
  352    H    ASN  59           H        ASN  59  -3.143  14.823   2.878
  353    HA   ASN  59           HA       ASN  59  -4.036  13.398   5.202
  354    HB2  ASN  59           1HB      ASN  59  -1.410  14.914   4.790
  355    HB3  ASN  59           2HB      ASN  59  -1.723  13.675   5.989
  356   HD21  ASN  59          1HD2      ASN  59  -0.311  14.291   3.108
  357   HD22  ASN  59          2HD2      ASN  59  -0.275  12.713   2.393
  358    H    ALA  60           H        ALA  60  -3.643  14.505   7.431
  359    HA   ALA  60           HA       ALA  60  -5.012  16.972   7.485
  360    HB1  ALA  60           3HB      ALA  60  -3.944  16.696   9.984
  361    HB2  ALA  60           1HB      ALA  60  -5.413  15.857   9.430
  362    HB3  ALA  60           2HB      ALA  60  -3.842  15.020   9.394
  Start of MODEL   16
    1    H1   ASP   1           H        ASP   1  10.556  -6.323  -6.886
    2    HA   ASP   1           HA       ASP   1   8.011  -6.704  -7.679
    3    HB2  ASP   1           1HB      ASP   1   9.695  -8.541  -5.911
    4    HB3  ASP   1           2HB      ASP   1   8.287  -9.057  -6.818
    5    H    ILE   2           H        ILE   2   6.217  -5.860  -6.567
    6    HA   ILE   2           HA       ILE   2   6.214  -6.008  -3.662
    7    HB   ILE   2           HB       ILE   2   4.769  -4.276  -3.673
    8   HG12  ILE   2          1HG1      ILE   2   3.665  -5.240  -6.327
    9   HG13  ILE   2          2HG1      ILE   2   2.929  -5.453  -4.751
   10   HG21  ILE   2          1HG2      ILE   2   5.607  -3.671  -6.475
   11   HG22  ILE   2          2HG2      ILE   2   5.621  -2.643  -5.022
   12   HG23  ILE   2          3HG2      ILE   2   6.868  -3.894  -5.238
   13   HD11  ILE   2          3HD1      ILE   2   3.640  -2.642  -5.529
   14   HD12  ILE   2          1HD1      ILE   2   2.274  -3.403  -6.380
   15   HD13  ILE   2          2HD1      ILE   2   2.242  -3.247  -4.608
   16    H    GLU   3           H        GLU   3   4.606  -7.325  -6.570
   17    HA   GLU   3           HA       GLU   3   2.423  -8.441  -5.377
   18    HB2  GLU   3           1HB      GLU   3   2.477 -10.072  -7.288
   19    HB3  GLU   3           2HB      GLU   3   2.675  -8.405  -7.790
   20    HG2  GLU   3           1HG      GLU   3   4.653  -8.921  -8.765
   21    HG3  GLU   3           2HG      GLU   3   5.301  -9.412  -7.213
   22    H    ASP   4           H        ASP   4   5.831  -9.424  -5.281
   23    HA   ASP   4           HA       ASP   4   5.314 -12.046  -4.406
   24    HB2  ASP   4           1HB      ASP   4   7.780 -10.266  -4.120
   25    HB3  ASP   4           2HB      ASP   4   7.760 -11.976  -3.741
   26    H    PHE   5           H        PHE   5   4.769  -9.037  -2.989
   27    HA   PHE   5           HA       PHE   5   5.083 -10.161  -0.298
   28    HB2  PHE   5           1HB      PHE   5   5.834  -7.504  -1.565
   29    HB3  PHE   5           2HB      PHE   5   5.270  -7.458   0.093
   30    HD1  PHE   5           2HD      PHE   5   6.564  -8.556   1.876
   31    HD2  PHE   5           1HD      PHE   5   7.985  -8.431  -2.120
   32    HE1  PHE   5           2HE      PHE   5   8.865  -9.158   2.676
   33    HE2  PHE   5           1HE      PHE   5  10.287  -9.033  -1.320
   34    HZ   PHE   5           HZ       PHE   5  10.699  -9.389   1.069
   35    H    TYR   6           H        TYR   6   2.836  -9.736  -2.499
   36    HA   TYR   6           HA       TYR   6   1.047  -7.914  -1.199
   37    HB2  TYR   6           1HB      TYR   6   1.260  -8.554  -3.711
   38    HB3  TYR   6           2HB      TYR   6   0.623 -10.133  -3.295
   39    HD1  TYR   6           1HD      TYR   6  -0.608  -7.025  -1.713
   40    HD2  TYR   6           2HD      TYR   6  -1.315  -9.979  -4.726
   41    HE1  TYR   6           1HE      TYR   6  -2.977  -6.155  -2.020
   42    HE2  TYR   6           2HE      TYR   6  -3.681  -9.099  -5.023
   43    HH   TYR   6           HH       TYR   6  -4.962  -6.614  -2.883
   44    H    THR   7           H        THR   7  -0.453  -8.340   0.358
   45    HA   THR   7           HA       THR   7  -0.906 -11.184   0.990
   46    HB   THR   7           HB       THR   7  -0.944 -10.537   3.324
   47    HG1  THR   7           1HG      THR   7  -2.151  -8.523   2.868
   48   HG21  THR   7          3HG2      THR   7   1.163  -8.667   2.147
   49   HG22  THR   7          1HG2      THR   7   1.210  -9.518   3.710
   50   HG23  THR   7          2HG2      THR   7   1.394 -10.431   2.193
   51    H    SER   8           H        SER   8  -2.712 -11.496  -0.314
   52    HA   SER   8           HA       SER   8  -4.811  -9.614  -0.284
   53    HB2  SER   8           1HB      SER   8  -4.087 -11.600  -1.987
   54    HB3  SER   8           2HB      SER   8  -5.323 -12.459  -1.090
   55    HG   SER   8           HG       SER   8  -6.815 -10.699  -1.592
   56    H    GLU   9           H        GLU   9  -3.690 -11.657   2.096
   57    HA   GLU   9           HA       GLU   9  -6.159 -12.756   2.949
   58    HB2  GLU   9           1HB      GLU   9  -3.445 -13.203   3.499
   59    HB3  GLU   9           2HB      GLU   9  -4.059 -12.545   5.003
   60    HG2  GLU   9           1HG      GLU   9  -6.048 -14.250   4.654
   61    HG3  GLU   9           2HG      GLU   9  -4.960 -15.041   3.531
   62    H    THR  10           H        THR  10  -4.104  -9.929   3.834
   63    HA   THR  10           HA       THR  10  -6.214  -9.064   5.687
   64    HB   THR  10           HB       THR  10  -3.875  -9.325   6.573
   65    HG1  THR  10           1HG      THR  10  -4.296  -7.423   7.665
   66   HG21  THR  10          3HG2      THR  10  -3.298  -7.621   4.181
   67   HG22  THR  10          1HG2      THR  10  -2.530  -7.087   5.696
   68   HG23  THR  10          2HG2      THR  10  -2.219  -8.724   5.069
   69    H    CYS  11           H        CYS  11  -4.638  -8.389   2.612
   70    HA   CYS  11           HA       CYS  11  -5.327  -5.694   2.432
   71    HB2  CYS  11           1HB      CYS  11  -3.697  -6.957   0.993
   72    HB3  CYS  11           2HB      CYS  11  -5.064  -7.659   0.151
   73    HA   PRO  12           HA       PRO  12  -9.631  -6.153   1.830
   74    HB2  PRO  12           1HB      PRO  12 -10.249  -3.594   1.094
   75    HB3  PRO  12           2HB      PRO  12 -10.054  -4.091   2.763
   76    HG2  PRO  12           1HG      PRO  12  -8.207  -2.524   1.068
   77    HG3  PRO  12           2HG      PRO  12  -8.240  -2.667   2.814
   78    HD2  PRO  12           1HD      PRO  12  -6.414  -3.961   1.020
   79    HD3  PRO  12           2HD      PRO  12  -6.521  -4.194   2.754
   80    H    TYR  13           H        TYR  13  -7.482  -5.194  -0.642
   81    HA   TYR  13           HA       TYR  13  -9.570  -5.704  -2.635
   82    HB2  TYR  13           1HB      TYR  13  -6.755  -4.457  -2.603
   83    HB3  TYR  13           2HB      TYR  13  -7.626  -4.727  -4.099
   84    HD1  TYR  13           2HD      TYR  13  -9.692  -3.432  -4.602
   85    HD2  TYR  13           1HD      TYR  13  -7.326  -2.631  -1.129
   86    HE1  TYR  13           2HE      TYR  13 -10.834  -1.176  -4.335
   87    HE2  TYR  13           1HE      TYR  13  -8.476  -0.378  -0.873
   88    HH   TYR  13           HH       TYR  13 -10.381   0.747  -1.487
   89    H    LYS  14           H        LYS  14  -8.407  -6.674  -4.779
   90    HA   LYS  14           HA       LYS  14  -6.446  -8.672  -4.144
   91    HB2  LYS  14           1HB      LYS  14  -7.987 -10.532  -4.986
   92    HB3  LYS  14           2HB      LYS  14  -8.210  -9.975  -3.340
   93    HG2  LYS  14           1HG      LYS  14 -10.420  -9.923  -4.060
   94    HG3  LYS  14           2HG      LYS  14  -9.947  -8.287  -4.471
   95    HD2  LYS  14           1HD      LYS  14  -9.211 -10.039  -6.663
   96    HD3  LYS  14           2HD      LYS  14 -10.881 -10.352  -6.235
   97    HE2  LYS  14           1HE      LYS  14 -11.285  -7.825  -6.312
   98    HE3  LYS  14           2HE      LYS  14  -9.663  -7.644  -6.949
   99    HZ1  LYS  14           3HZ      LYS  14 -11.111  -9.627  -8.346
  100    HZ2  LYS  14           1HZ      LYS  14 -11.893  -8.194  -8.383
  101    HZ3  LYS  14           2HZ      LYS  14 -10.356  -8.299  -8.923
  102    H    ASN  15           H        ASN  15  -7.218 -10.299  -6.508
  103    HA   ASN  15           HA       ASN  15  -7.137 -10.289  -8.695
  104    HB2  ASN  15           1HB      ASN  15  -8.149  -7.667  -8.232
  105    HB3  ASN  15           2HB      ASN  15  -6.799  -7.435  -9.324
  106   HD21  ASN  15          1HD2      ASN  15  -8.218  -6.818 -10.962
  107   HD22  ASN  15          2HD2      ASN  15  -9.155  -7.959 -11.869
  108    H    ASP  16           H        ASP  16  -5.349  -7.297  -7.593
  109    HA   ASP  16           HA       ASP  16  -2.873  -8.625  -8.218
  110    HB2  ASP  16           1HB      ASP  16  -4.085  -6.676  -9.966
  111    HB3  ASP  16           2HB      ASP  16  -2.691  -5.918  -9.224
  112    H    SER  17           H        SER  17  -0.969  -7.181  -7.405
  113    HA   SER  17           HA       SER  17  -1.764  -6.067  -4.908
  114    HB2  SER  17           1HB      SER  17   0.701  -5.805  -4.554
  115    HB3  SER  17           2HB      SER  17   0.246  -7.438  -4.995
  116    HG   SER  17           HG       SER  17   2.134  -6.613  -6.168
  117    H    GLN  18           H        GLN  18  -0.827  -4.951  -8.137
  118    HA   GLN  18           HA       GLN  18  -0.056  -2.374  -7.402
  119    HB2  GLN  18           1HB      GLN  18   0.364  -3.595  -9.619
  120    HB3  GLN  18           2HB      GLN  18  -1.286  -3.205 -10.061
  121    HG2  GLN  18           1HG      GLN  18  -0.718  -0.743  -9.582
  122    HG3  GLN  18           2HG      GLN  18   0.957  -1.236  -9.433
  123   HE21  GLN  18          1HE2      GLN  18  -1.230   0.042 -11.464
  124   HE22  GLN  18          2HE2      GLN  18  -0.590  -0.408 -13.009
  125    H    LEU  19           H        LEU  19  -3.127  -3.954  -7.437
  126    HA   LEU  19           HA       LEU  19  -4.712  -1.677  -8.058
  127    HB2  LEU  19           1HB      LEU  19  -5.638  -3.788  -8.495
  128    HB3  LEU  19           2HB      LEU  19  -5.245  -4.399  -6.900
  129    HG   LEU  19           HG       LEU  19  -6.939  -2.909  -5.902
  130   HD11  LEU  19          1HD1      LEU  19  -8.287  -1.446  -7.078
  131   HD12  LEU  19          2HD1      LEU  19  -6.715  -1.240  -7.888
  132   HD13  LEU  19          3HD1      LEU  19  -7.979  -2.243  -8.640
  133   HD21  LEU  19          3HD2      LEU  19  -8.795  -4.089  -7.691
  134   HD22  LEU  19          1HD2      LEU  19  -7.402  -5.190  -7.568
  135   HD23  LEU  19          2HD2      LEU  19  -8.262  -4.675  -6.097
  136    H    ALA  20           H        ALA  20  -4.239  -3.499  -4.943
  137    HA   ALA  20           HA       ALA  20  -5.377  -1.513  -3.362
  138    HB1  ALA  20           3HB      ALA  20  -3.981  -4.044  -3.059
  139    HB2  ALA  20           1HB      ALA  20  -3.455  -2.886  -1.814
  140    HB3  ALA  20           2HB      ALA  20  -5.182  -3.282  -1.989
  141    H    TRP  21           H        TRP  21  -2.189  -1.827  -4.854
  142    HA   TRP  21           HA       TRP  21  -0.868  -0.009  -3.124
  143    HB2  TRP  21           1HB      TRP  21   0.502  -1.515  -4.262
  144    HB3  TRP  21           2HB      TRP  21  -0.273  -1.220  -5.806
  145    HD1  TRP  21           HD       TRP  21   0.433   1.145  -7.075
  146    HE1  TRP  21           1HE      TRP  21   2.594   2.657  -7.000
  147    HE3  TRP  21           3HE      TRP  21   2.247  -0.751  -2.720
  148    HZ2  TRP  21           2HZ      TRP  21   4.771   2.885  -5.169
  149    HZ3  TRP  21           3HZ      TRP  21   4.396   0.171  -1.858
  150    HH2  TRP  21           HH       TRP  21   5.648   1.927  -3.007
  151    H    ASP  22           H        ASP  22  -2.687   0.179  -6.230
  152    HA   ASP  22           HA       ASP  22  -2.066   2.853  -6.711
  153    HB2  ASP  22           1HB      ASP  22  -3.598   0.763  -7.924
  154    HB3  ASP  22           2HB      ASP  22  -4.700   2.110  -7.718
  155    H    THR  23           H        THR  23  -4.131   1.235  -4.433
  156    HA   THR  23           HA       THR  23  -6.125   3.281  -4.217
  157    HB   THR  23           HB       THR  23  -5.478   0.615  -3.088
  158    HG1  THR  23           1HG      THR  23  -7.958   0.883  -3.030
  159   HG21  THR  23          3HG2      THR  23  -5.434   2.098  -0.989
  160   HG22  THR  23          1HG2      THR  23  -7.090   2.599  -1.407
  161   HG23  THR  23          2HG2      THR  23  -6.745   0.895  -1.024
  162    H    CYS  24           H        CYS  24  -3.349   2.236  -2.125
  163    HA   CYS  24           HA       CYS  24  -3.644   4.719  -0.669
  164    HB2  CYS  24           1HB      CYS  24  -3.128   3.310   0.970
  165    HB3  CYS  24           2HB      CYS  24  -2.533   2.088  -0.136
  166    H    SER  25           H        SER  25  -0.866   2.848  -2.113
  167    HA   SER  25           HA       SER  25   0.618   5.243  -2.404
  168    HB2  SER  25           1HB      SER  25   1.950   3.328  -3.907
  169    HB3  SER  25           2HB      SER  25   2.204   3.635  -2.201
  170    HG   SER  25           HG       SER  25   1.297   1.756  -1.712
  171    H    GLY  26           H        GLY  26  -1.614   5.890  -3.733
  172    HA2  GLY  26           1HA      GLY  26  -0.866   5.628  -6.581
  173    HA3  GLY  26           2HA      GLY  26  -2.522   5.434  -6.041
  174    H    GLY  27           H        GLY  27  -0.856   7.679  -4.042
  175    HA2  GLY  27           1HA      GLY  27  -0.515   9.975  -4.302
  176    HA3  GLY  27           2HA      GLY  27  -1.517   9.978  -5.740
  177    H    THR  28           H        THR  28  -3.746   8.412  -4.664
  178    HA   THR  28           HA       THR  28  -4.693  10.149  -2.494
  179    HB   THR  28           HB       THR  28  -6.866  10.336  -3.762
  180    HG1  THR  28           1HG      THR  28  -6.677   8.489  -5.121
  181   HG21  THR  28          3HG2      THR  28  -5.567  12.257  -4.264
  182   HG22  THR  28          1HG2      THR  28  -4.278  11.298  -5.029
  183   HG23  THR  28          2HG2      THR  28  -5.820  11.554  -5.879
  184    H    GLY  29           H        GLY  29  -7.307   9.037  -2.381
  185    HA2  GLY  29           1HA      GLY  29  -8.437   7.115  -1.852
  186    HA3  GLY  29           2HA      GLY  29  -6.991   6.164  -2.126
  187    H    ASN  30           H        ASN  30  -6.719   5.027  -0.225
  188    HA   ASN  30           HA       ASN  30  -6.945   6.549   2.232
  189    HB2  ASN  30           1HB      ASN  30  -6.902   4.267   3.325
  190    HB3  ASN  30           2HB      ASN  30  -8.224   4.450   2.189
  191   HD21  ASN  30          1HD2      ASN  30  -8.460   2.329   1.709
  192   HD22  ASN  30          2HD2      ASN  30  -7.308   1.380   0.831
  193    H    CYS  31           H        CYS  31  -4.660   6.999   0.494
  194    HA   CYS  31           HA       CYS  31  -2.478   5.403   0.977
  195    HB2  CYS  31           1HB      CYS  31  -1.252   7.001  -0.062
  196    HB3  CYS  31           2HB      CYS  31  -2.855   7.479  -0.584
  197    H    GLY  32           H        GLY  32  -0.759   5.519   2.566
  198    HA2  GLY  32           1HA      GLY  32  -0.407   7.319   4.578
  199    HA3  GLY  32           2HA      GLY  32  -1.666   6.265   5.189
  200    H    THR  33           H        THR  33   0.354   6.011   6.769
  201    HA   THR  33           HA       THR  33   2.321   4.139   5.752
  202    HB   THR  33           HB       THR  33   1.857   5.369   8.522
  203    HG1  THR  33           1HG      THR  33   2.501   7.054   7.191
  204   HG21  THR  33          3HG2      THR  33   4.292   4.022   7.237
  205   HG22  THR  33          1HG2      THR  33   4.309   4.889   8.792
  206   HG23  THR  33          2HG2      THR  33   3.365   3.390   8.619
  207    H    VAL  34           H        VAL  34  -0.869   3.919   6.793
  208    HA   VAL  34           HA       VAL  34  -0.516   1.487   8.302
  209    HB   VAL  34           HB       VAL  34  -2.858   3.153   7.408
  210   HG11  VAL  34          1HG1      VAL  34  -3.480   0.755   7.219
  211   HG12  VAL  34          2HG1      VAL  34  -3.025   0.527   8.925
  212   HG13  VAL  34          3HG1      VAL  34  -4.377   1.605   8.501
  213   HG21  VAL  34          3HG2      VAL  34  -1.532   2.520  10.047
  214   HG22  VAL  34          1HG2      VAL  34  -1.853   4.105   9.303
  215   HG23  VAL  34          2HG2      VAL  34  -3.197   3.144   9.966
  216    H    CYS  35           H        CYS  35  -1.294   2.555   4.992
  217    HA   CYS  35           HA       CYS  35  -2.354   0.149   4.082
  218    HB2  CYS  35           1HB      CYS  35  -2.638   1.335   2.243
  219    HB3  CYS  35           2HB      CYS  35  -1.810   2.668   3.023
  220    H    CYS  36           H        CYS  36   0.854   1.126   5.046
  221    HA   CYS  36           HA       CYS  36   2.458  -0.370   3.406
  222    HB2  CYS  36           1HB      CYS  36   2.845   0.106   6.369
  223    HB3  CYS  36           2HB      CYS  36   4.088  -0.347   5.220
  224    H    GLY  37           H        GLY  37   1.688  -1.367   6.814
  225    HA2  GLY  37           1HA      GLY  37   1.927  -4.158   6.063
  226    HA3  GLY  37           2HA      GLY  37   1.718  -3.490   7.670
  227    H    GLN  38           H        GLN  38  -0.241  -3.019   4.649
  228    HA   GLN  38           HA       GLN  38  -2.479  -4.142   6.148
  229    HB2  GLN  38           1HB      GLN  38  -2.274  -1.524   5.342
  230    HB3  GLN  38           2HB      GLN  38  -3.087  -2.218   3.953
  231    HG2  GLN  38           1HG      GLN  38  -4.831  -1.529   5.455
  232    HG3  GLN  38           2HG      GLN  38  -4.763  -3.276   5.573
  233   HE21  GLN  38          1HE2      GLN  38  -5.059  -0.546   7.300
  234   HE22  GLN  38          2HE2      GLN  38  -4.426  -1.026   8.840
  235    H    CYS  39           H        CYS  39  -0.752  -3.799   3.038
  236    HA   CYS  39           HA       CYS  39  -2.275  -6.111   2.091
  237    HB2  CYS  39           1HB      CYS  39  -1.476  -3.693   0.459
  238    HB3  CYS  39           2HB      CYS  39  -2.096  -5.187  -0.213
  239    H    PHE  40           H        PHE  40   0.690  -4.047   1.933
  240    HA   PHE  40           HA       PHE  40   2.166  -6.414   1.026
  241    HB2  PHE  40           1HB      PHE  40   3.269  -3.587   1.078
  242    HB3  PHE  40           2HB      PHE  40   3.581  -4.851  -0.095
  243    HD1  PHE  40           2HD      PHE  40   1.176  -2.266   0.945
  244    HD2  PHE  40           1HD      PHE  40   2.209  -5.100  -2.039
  245    HE1  PHE  40           2HE      PHE  40  -0.486  -1.223  -0.620
  246    HE2  PHE  40           1HE      PHE  40   0.546  -4.058  -3.604
  247    HZ   PHE  40           HZ       PHE  40  -0.781  -2.132  -2.876
  248    H    SER  41           H        SER  41   4.649  -6.157   1.769
  249    HA   SER  41           HA       SER  41   4.685  -5.238   4.517
  250    HB2  SER  41           1HB      SER  41   6.134  -7.494   4.843
  251    HB3  SER  41           2HB      SER  41   4.407  -7.433   5.135
  252    HG   SER  41           HG       SER  41   5.440  -9.168   3.615
  253    H    PHE  42           H        PHE  42   6.990  -5.059   5.362
  254    HA   PHE  42           HA       PHE  42   8.584  -3.677   3.606
  255    HB2  PHE  42           1HB      PHE  42   8.525  -4.575   6.330
  256    HB3  PHE  42           2HB      PHE  42  10.058  -5.151   5.706
  257    HD1  PHE  42           1HD      PHE  42   7.999  -2.077   6.048
  258    HD2  PHE  42           2HD      PHE  42  11.886  -3.702   5.541
  259    HE1  PHE  42           1HE      PHE  42   8.997   0.200   6.395
  260    HE2  PHE  42           2HE      PHE  42  12.884  -1.425   5.888
  261    HZ   PHE  42           HZ       PHE  42  11.427   0.499   6.311
  262    HA   PRO  43           HA       PRO  43  10.690  -3.328   3.611
  263    HB2  PRO  43           1HB      PRO  43  12.308  -2.744   1.487
  264    HB3  PRO  43           2HB      PRO  43  12.906  -3.414   2.991
  265    HG2  PRO  43           1HG      PRO  43  12.518  -4.759   0.388
  266    HG3  PRO  43           2HG      PRO  43  13.490  -5.270   1.754
  267    HD2  PRO  43           1HD      PRO  43  10.927  -6.306   0.986
  268    HD3  PRO  43           2HD      PRO  43  11.846  -6.735   2.416
  269    H    VAL  44           H        VAL  44   8.662  -4.652   1.542
  270    HA   VAL  44           HA       VAL  44   8.231  -2.495  -0.244
  271    HB   VAL  44           HB       VAL  44   6.152  -4.516   0.526
  272   HG11  VAL  44          1HG1      VAL  44   5.839  -4.491  -1.996
  273   HG12  VAL  44          2HG1      VAL  44   5.439  -2.980  -1.144
  274   HG13  VAL  44          3HG1      VAL  44   6.974  -3.121  -2.035
  275   HG21  VAL  44          3HG2      VAL  44   7.893  -6.031   0.396
  276   HG22  VAL  44          1HG2      VAL  44   7.371  -5.960  -1.305
  277   HG23  VAL  44          2HG2      VAL  44   8.807  -5.050  -0.775
  278    H    SER  45           H        SER  45   6.979  -3.447   2.979
  279    HA   SER  45           HA       SER  45   4.819  -1.809   3.109
  280    HB2  SER  45           1HB      SER  45   4.942  -3.119   4.990
  281    HB3  SER  45           2HB      SER  45   6.692  -3.050   5.057
  282    HG   SER  45           HG       SER  45   6.495  -0.846   5.898
  283    H    GLN  46           H        GLN  46   8.179  -0.965   2.852
  284    HA   GLN  46           HA       GLN  46   7.812   1.606   4.074
  285    HB2  GLN  46           1HB      GLN  46   9.968   0.042   4.018
  286    HB3  GLN  46           2HB      GLN  46  10.265   0.841   2.488
  287    HG2  GLN  46           1HG      GLN  46   9.573   2.960   4.200
  288    HG3  GLN  46           2HG      GLN  46  10.515   1.900   5.230
  289   HE21  GLN  46          1HE2      GLN  46  11.060   4.554   4.024
  290   HE22  GLN  46          2HE2      GLN  46  12.565   4.413   3.179
  291    H    SER  47           H        SER  47   7.610   0.087   0.921
  292    HA   SER  47           HA       SER  47   8.093   2.453  -0.547
  293    HB2  SER  47           1HB      SER  47   6.613  -0.045  -1.471
  294    HB3  SER  47           2HB      SER  47   7.410   1.141  -2.486
  295    HG   SER  47           HG       SER  47   8.765  -0.507  -0.525
  296    H    CYS  48           H        CYS  48   5.237   0.724   0.771
  297    HA   CYS  48           HA       CYS  48   3.243   1.994  -0.603
  298    HB2  CYS  48           1HB      CYS  48   2.442   0.295   0.674
  299    HB3  CYS  48           2HB      CYS  48   3.477   0.665   2.039
  300    H    ALA  49           H        ALA  49   4.508   2.869   2.706
  301    HA   ALA  49           HA       ALA  49   3.219   5.339   2.803
  302    HB1  ALA  49           3HB      ALA  49   3.914   4.904   4.905
  303    HB2  ALA  49           1HB      ALA  49   5.190   3.800   4.335
  304    HB3  ALA  49           2HB      ALA  49   5.494   5.553   4.404
  305    H    GLY  50           H        GLY  50   5.875   4.242   0.894
  306    HA2  GLY  50           1HA      GLY  50   7.217   6.795   0.713
  307    HA3  GLY  50           2HA      GLY  50   7.561   5.333  -0.189
  308    H    MET  51           H        MET  51   5.261   4.678  -1.513
  309    HA   MET  51           HA       MET  51   5.096   6.854  -3.370
  310    HB2  MET  51           1HB      MET  51   5.357   4.352  -3.959
  311    HB3  MET  51           2HB      MET  51   3.703   4.122  -3.426
  312    HG2  MET  51           1HG      MET  51   3.122   4.606  -5.582
  313    HG3  MET  51           2HG      MET  51   3.424   6.278  -5.152
  314    HE1  MET  51           3HE      MET  51   4.194   7.257  -7.347
  315    HE2  MET  51           1HE      MET  51   5.281   7.698  -6.009
  316    HE3  MET  51           2HE      MET  51   5.956   7.270  -7.599
  317    H    ALA  52           H        ALA  52   3.707   6.664  -0.530
  318    HA   ALA  52           HA       ALA  52   0.929   6.904  -1.348
  319    HB1  ALA  52           3HB      ALA  52   2.302   7.003   1.369
  320    HB2  ALA  52           1HB      ALA  52   0.543   7.047   1.104
  321    HB3  ALA  52           2HB      ALA  52   1.475   5.598   0.655
  322    H    ASP  53           H        ASP  53   2.815   8.836  -2.432
  323    HA   ASP  53           HA       ASP  53   3.034  10.971  -2.736
  324    HB2  ASP  53           1HB      ASP  53   0.294  10.659  -1.739
  325    HB3  ASP  53           2HB      ASP  53   0.933  12.230  -1.296
  326    H    SER  54           H        SER  54   3.490  13.146  -1.569
  327    HA   SER  54           HA       SER  54   4.490  12.521   1.073
  328    HB2  SER  54           1HB      SER  54   5.343  14.228  -1.153
  329    HB3  SER  54           2HB      SER  54   5.325  15.121   0.355
  330    HG   SER  54           HG       SER  54   7.198  13.408  -0.488
  331    H    ASN  55           H        ASN  55   3.345  15.638  -0.396
  332    HA   ASN  55           HA       ASN  55   1.670  15.930   1.972
  333    HB2  ASN  55           1HB      ASN  55   3.704  17.606   1.121
  334    HB3  ASN  55           2HB      ASN  55   2.326  18.352   0.337
  335   HD21  ASN  55          1HD2      ASN  55   4.173  18.423   3.001
  336   HD22  ASN  55          2HD2      ASN  55   3.077  19.060   4.181
  337    H    ASP  56           H        ASP  56   1.727  15.309  -1.365
  338    HA   ASP  56           HA       ASP  56  -0.402  16.952  -2.191
  339    HB2  ASP  56           1HB      ASP  56   1.479  15.372  -3.448
  340    HB3  ASP  56           2HB      ASP  56   0.058  14.358  -3.601
  341    H    CYS  57           H        CYS  57  -0.104  14.056  -0.303
  342    HA   CYS  57           HA       CYS  57  -2.637  12.947  -1.069
  343    HB2  CYS  57           1HB      CYS  57  -0.311  12.023   0.254
  344    HB3  CYS  57           2HB      CYS  57  -1.625  11.892   1.406
  345    HA   PRO  58           HA       PRO  58  -4.927  15.130   1.925
  346    HB2  PRO  58           1HB      PRO  58  -7.013  13.429   2.401
  347    HB3  PRO  58           2HB      PRO  58  -6.930  14.476   0.997
  348    HG2  PRO  58           1HG      PRO  58  -6.487  11.557   1.162
  349    HG3  PRO  58           2HG      PRO  58  -6.827  12.538  -0.250
  350    HD2  PRO  58           1HD      PRO  58  -4.281  11.465   0.522
  351    HD3  PRO  58           2HD      PRO  58  -4.600  12.541  -0.824
  352    H    ASN  59           H        ASN  59  -2.729  14.399   3.139
  353    HA   ASN  59           HA       ASN  59  -3.559  12.803   5.394
  354    HB2  ASN  59           1HB      ASN  59  -0.847  14.014   4.638
  355    HB3  ASN  59           2HB      ASN  59  -1.108  12.989   6.036
  356   HD21  ASN  59          1HD2      ASN  59   0.729  12.135   4.402
  357   HD22  ASN  59          2HD2      ASN  59   0.222  10.803   3.418
  358    H    ALA  60           H        ALA  60  -2.838  13.678   7.653
  359    HA   ALA  60           HA       ALA  60  -2.267  16.387   8.027
  360    HB1  ALA  60           3HB      ALA  60  -4.266  17.430   8.075
  361    HB2  ALA  60           1HB      ALA  60  -4.917  16.002   7.235
  362    HB3  ALA  60           2HB      ALA  60  -5.015  16.112   9.009
  Start of MODEL   17
    1    H1   ASP   1           H        ASP   1  10.635  -7.930  -6.395
    2    HA   ASP   1           HA       ASP   1   8.509  -6.635  -7.249
    3    HB2  ASP   1           1HB      ASP   1   9.079  -8.986  -7.829
    4    HB3  ASP   1           2HB      ASP   1   8.546  -9.520  -6.247
    5    H    ILE   2           H        ILE   2   6.496  -5.913  -6.423
    6    HA   ILE   2           HA       ILE   2   6.204  -5.991  -3.564
    7    HB   ILE   2           HB       ILE   2   4.704  -4.282  -3.813
    8   HG12  ILE   2          1HG1      ILE   2   4.098  -5.149  -6.654
    9   HG13  ILE   2          2HG1      ILE   2   3.133  -5.576  -5.255
   10   HG21  ILE   2          1HG2      ILE   2   5.712  -2.683  -5.182
   11   HG22  ILE   2          2HG2      ILE   2   7.018  -3.845  -4.846
   12   HG23  ILE   2          3HG2      ILE   2   6.174  -3.884  -6.412
   13   HD11  ILE   2          3HD1      ILE   2   3.584  -2.726  -5.180
   14   HD12  ILE   2          1HD1      ILE   2   3.019  -3.169  -6.809
   15   HD13  ILE   2          2HD1      ILE   2   2.045  -3.597  -5.382
   16    H    GLU   3           H        GLU   3   4.596  -7.353  -6.481
   17    HA   GLU   3           HA       GLU   3   2.386  -8.376  -5.255
   18    HB2  GLU   3           1HB      GLU   3   2.794  -8.332  -7.714
   19    HB3  GLU   3           2HB      GLU   3   3.992  -9.599  -7.542
   20    HG2  GLU   3           1HG      GLU   3   1.383 -10.254  -6.283
   21    HG3  GLU   3           2HG      GLU   3   1.282 -10.007  -8.015
   22    H    ASP   4           H        ASP   4   5.753  -9.400  -5.066
   23    HA   ASP   4           HA       ASP   4   5.198 -12.028  -4.230
   24    HB2  ASP   4           1HB      ASP   4   7.500 -10.378  -4.777
   25    HB3  ASP   4           2HB      ASP   4   7.715 -11.062  -3.178
   26    H    PHE   5           H        PHE   5   4.787  -8.948  -2.804
   27    HA   PHE   5           HA       PHE   5   4.943 -10.113  -0.112
   28    HB2  PHE   5           1HB      PHE   5   5.702  -7.437  -1.346
   29    HB3  PHE   5           2HB      PHE   5   5.133  -7.428   0.312
   30    HD1  PHE   5           1HD      PHE   5   7.797  -8.606  -1.931
   31    HD2  PHE   5           2HD      PHE   5   6.493  -8.286   2.095
   32    HE1  PHE   5           1HE      PHE   5  10.100  -9.211  -1.137
   33    HE2  PHE   5           2HE      PHE   5   8.796  -8.890   2.889
   34    HZ   PHE   5           HZ       PHE   5  10.572  -9.346   1.264
   35    H    TYR   6           H        TYR   6   2.753  -9.707  -2.362
   36    HA   TYR   6           HA       TYR   6   0.931  -7.870  -1.140
   37    HB2  TYR   6           1HB      TYR   6   1.199  -8.575  -3.630
   38    HB3  TYR   6           2HB      TYR   6   0.553 -10.143  -3.186
   39    HD1  TYR   6           2HD      TYR   6  -0.741  -7.050  -1.652
   40    HD2  TYR   6           1HD      TYR   6  -1.324  -9.972  -4.722
   41    HE1  TYR   6           2HE      TYR   6  -3.103  -6.190  -2.032
   42    HE2  TYR   6           1HE      TYR   6  -3.684  -9.102  -5.092
   43    HH   TYR   6           HH       TYR   6  -5.133  -6.840  -2.911
   44    H    THR   7           H        THR   7  -0.399  -8.265   0.554
   45    HA   THR   7           HA       THR   7  -0.907 -11.089   1.210
   46    HB   THR   7           HB       THR   7  -0.924 -10.396   3.501
   47    HG1  THR   7           1HG      THR   7  -1.065  -7.707   2.327
   48   HG21  THR   7          3HG2      THR   7   1.079  -9.034   3.858
   49   HG22  THR   7          1HG2      THR   7   1.393 -10.091   2.461
   50   HG23  THR   7          2HG2      THR   7   0.980  -8.378   2.206
   51    H    SER   8           H        SER   8  -2.674 -11.485  -0.129
   52    HA   SER   8           HA       SER   8  -4.812  -9.655  -0.225
   53    HB2  SER   8           1HB      SER   8  -4.028 -12.109  -1.525
   54    HB3  SER   8           2HB      SER   8  -5.676 -12.299  -0.960
   55    HG   SER   8           HG       SER   8  -6.356 -10.960  -2.483
   56    H    GLU   9           H        GLU   9  -3.705 -11.581   2.267
   57    HA   GLU   9           HA       GLU   9  -6.177 -12.667   3.124
   58    HB2  GLU   9           1HB      GLU   9  -3.480 -13.081   3.731
   59    HB3  GLU   9           2HB      GLU   9  -4.098 -12.334   5.191
   60    HG2  GLU   9           1HG      GLU   9  -6.116 -14.157   4.550
   61    HG3  GLU   9           2HG      GLU   9  -4.667 -15.013   4.060
   62    H    THR  10           H        THR  10  -4.101  -9.854   4.070
   63    HA   THR  10           HA       THR  10  -6.259  -8.917   5.814
   64    HB   THR  10           HB       THR  10  -4.116  -8.943   6.906
   65    HG1  THR  10           1HG      THR  10  -3.744  -6.550   6.965
   66   HG21  THR  10          3HG2      THR  10  -2.383  -9.132   5.331
   67   HG22  THR  10          1HG2      THR  10  -3.133  -7.960   4.221
   68   HG23  THR  10          2HG2      THR  10  -2.289  -7.389   5.680
   69    H    CYS  11           H        CYS  11  -4.741  -8.360   2.695
   70    HA   CYS  11           HA       CYS  11  -5.465  -5.681   2.406
   71    HB2  CYS  11           1HB      CYS  11  -3.833  -6.954   1.001
   72    HB3  CYS  11           2HB      CYS  11  -5.183  -7.759   0.228
   73    HA   PRO  12           HA       PRO  12  -9.769  -6.216   1.875
   74    HB2  PRO  12           1HB      PRO  12 -10.425  -3.712   1.000
   75    HB3  PRO  12           2HB      PRO  12 -10.203  -4.108   2.693
   76    HG2  PRO  12           1HG      PRO  12  -8.397  -2.623   0.884
   77    HG3  PRO  12           2HG      PRO  12  -8.406  -2.664   2.636
   78    HD2  PRO  12           1HD      PRO  12  -6.587  -4.041   0.897
   79    HD3  PRO  12           2HD      PRO  12  -6.671  -4.172   2.643
   80    H    TYR  13           H        TYR  13  -7.692  -5.286  -0.692
   81    HA   TYR  13           HA       TYR  13  -9.776  -6.124  -2.588
   82    HB2  TYR  13           1HB      TYR  13  -7.120  -4.602  -2.947
   83    HB3  TYR  13           2HB      TYR  13  -8.349  -4.796  -4.182
   84    HD1  TYR  13           1HD      TYR  13 -10.666  -3.736  -3.745
   85    HD2  TYR  13           2HD      TYR  13  -7.163  -2.747  -1.496
   86    HE1  TYR  13           1HE      TYR  13 -11.751  -1.562  -2.998
   87    HE2  TYR  13           2HE      TYR  13  -8.260  -0.576  -0.757
   88    HH   TYR  13           HH       TYR  13 -11.070   0.616  -2.232
   89    H    LYS  14           H        LYS  14  -8.588  -7.013  -4.731
   90    HA   LYS  14           HA       LYS  14  -6.301  -8.646  -4.089
   91    HB2  LYS  14           1HB      LYS  14  -7.365 -10.771  -4.570
   92    HB3  LYS  14           2HB      LYS  14  -8.145 -10.003  -3.202
   93    HG2  LYS  14           1HG      LYS  14  -9.194  -9.770  -6.059
   94    HG3  LYS  14           2HG      LYS  14  -9.723 -11.017  -4.947
   95    HD2  LYS  14           1HD      LYS  14 -11.240  -9.567  -4.094
   96    HD3  LYS  14           2HD      LYS  14  -9.922  -8.584  -3.486
   97    HE2  LYS  14           1HE      LYS  14 -10.825  -6.975  -4.854
   98    HE3  LYS  14           2HE      LYS  14  -9.898  -7.786  -6.101
   99    HZ1  LYS  14           3HZ      LYS  14 -11.763  -8.913  -6.824
  100    HZ2  LYS  14           1HZ      LYS  14 -12.611  -8.661  -5.451
  101    HZ3  LYS  14           2HZ      LYS  14 -12.353  -7.427  -6.489
  102    H    ASN  15           H        ASN  15  -7.284 -10.408  -6.471
  103    HA   ASN  15           HA       ASN  15  -7.232 -10.400  -8.651
  104    HB2  ASN  15           1HB      ASN  15  -8.186  -7.743  -8.129
  105    HB3  ASN  15           2HB      ASN  15  -6.940  -7.578  -9.349
  106   HD21  ASN  15          1HD2      ASN  15  -9.022  -6.861 -10.438
  107   HD22  ASN  15          2HD2      ASN  15  -9.880  -8.047 -11.364
  108    H    ASP  16           H        ASP  16  -5.427  -7.387  -7.640
  109    HA   ASP  16           HA       ASP  16  -2.965  -8.700  -8.347
  110    HB2  ASP  16           1HB      ASP  16  -4.264  -6.752 -10.049
  111    HB3  ASP  16           2HB      ASP  16  -2.818  -6.015  -9.389
  112    H    SER  17           H        SER  17  -1.060  -7.423  -7.470
  113    HA   SER  17           HA       SER  17  -1.778  -6.214  -5.018
  114    HB2  SER  17           1HB      SER  17   0.201  -7.529  -4.976
  115    HB3  SER  17           2HB      SER  17   0.833  -6.800  -6.440
  116    HG   SER  17           HG       SER  17   1.169  -6.013  -3.823
  117    H    GLN  18           H        GLN  18  -0.847  -5.132  -8.271
  118    HA   GLN  18           HA       GLN  18  -0.053  -2.560  -7.570
  119    HB2  GLN  18           1HB      GLN  18   0.312  -3.799  -9.786
  120    HB3  GLN  18           2HB      GLN  18  -1.342  -3.396 -10.200
  121    HG2  GLN  18           1HG      GLN  18  -0.800  -1.243 -10.709
  122    HG3  GLN  18           2HG      GLN  18   0.106  -1.035  -9.224
  123   HE21  GLN  18          1HE2      GLN  18   0.673  -0.202 -11.980
  124   HE22  GLN  18          2HE2      GLN  18   2.226  -0.846 -12.397
  125    H    LEU  19           H        LEU  19  -3.144  -4.102  -7.537
  126    HA   LEU  19           HA       LEU  19  -4.706  -1.800  -8.137
  127    HB2  LEU  19           1HB      LEU  19  -5.639  -3.924  -8.567
  128    HB3  LEU  19           2HB      LEU  19  -5.282  -4.507  -6.953
  129    HG   LEU  19           HG       LEU  19  -6.960  -2.957  -6.015
  130   HD11  LEU  19          1HD1      LEU  19  -8.153  -1.424  -7.196
  131   HD12  LEU  19          2HD1      LEU  19  -6.668  -1.427  -8.177
  132   HD13  LEU  19          3HD1      LEU  19  -8.087  -2.361  -8.708
  133   HD21  LEU  19          3HD2      LEU  19  -8.295  -4.718  -6.175
  134   HD22  LEU  19          1HD2      LEU  19  -8.822  -4.153  -7.779
  135   HD23  LEU  19          2HD2      LEU  19  -7.445  -5.272  -7.638
  136    H    ALA  20           H        ALA  20  -4.260  -3.652  -5.036
  137    HA   ALA  20           HA       ALA  20  -5.326  -1.639  -3.439
  138    HB1  ALA  20           3HB      ALA  20  -3.490  -3.057  -1.868
  139    HB2  ALA  20           1HB      ALA  20  -5.204  -3.464  -2.123
  140    HB3  ALA  20           2HB      ALA  20  -3.951  -4.204  -3.149
  141    H    TRP  21           H        TRP  21  -2.198  -1.995  -5.007
  142    HA   TRP  21           HA       TRP  21  -0.810  -0.227  -3.249
  143    HB2  TRP  21           1HB      TRP  21   0.555  -1.758  -4.327
  144    HB3  TRP  21           2HB      TRP  21  -0.233  -1.543  -5.878
  145    HD1  TRP  21           HD       TRP  21   0.521   0.679  -7.323
  146    HE1  TRP  21           1HE      TRP  21   2.677   2.200  -7.338
  147    HE3  TRP  21           3HE      TRP  21   2.258  -0.833  -2.790
  148    HZ2  TRP  21           2HZ      TRP  21   4.819   2.592  -5.493
  149    HZ3  TRP  21           3HZ      TRP  21   4.389   0.168  -1.970
  150    HH2  TRP  21           HH       TRP  21   5.658   1.825  -3.242
  151    H    ASP  22           H        ASP  22  -2.304  -0.027  -6.554
  152    HA   ASP  22           HA       ASP  22  -1.698   2.640  -6.937
  153    HB2  ASP  22           1HB      ASP  22  -2.525   0.940  -8.654
  154    HB3  ASP  22           2HB      ASP  22  -4.135   1.128  -7.987
  155    H    THR  23           H        THR  23  -3.848   1.084  -4.744
  156    HA   THR  23           HA       THR  23  -5.887   3.113  -4.715
  157    HB   THR  23           HB       THR  23  -5.247   0.512  -3.346
  158    HG1  THR  23           1HG      THR  23  -6.804   0.454  -4.985
  159   HG21  THR  23          3HG2      THR  23  -7.358   2.436  -2.259
  160   HG22  THR  23          1HG2      THR  23  -6.900   0.844  -1.607
  161   HG23  THR  23          2HG2      THR  23  -5.777   2.219  -1.471
  162    H    CYS  24           H        CYS  24  -3.239   2.102  -2.450
  163    HA   CYS  24           HA       CYS  24  -3.671   4.519  -0.951
  164    HB2  CYS  24           1HB      CYS  24  -2.987   3.169   0.661
  165    HB3  CYS  24           2HB      CYS  24  -2.461   1.953  -0.486
  166    H    SER  25           H        SER  25  -0.915   2.924  -2.730
  167    HA   SER  25           HA       SER  25   0.551   5.344  -2.742
  168    HB2  SER  25           1HB      SER  25   2.225   4.089  -3.976
  169    HB3  SER  25           2HB      SER  25   1.592   3.060  -2.706
  170    HG   SER  25           HG       SER  25   1.006   2.971  -5.530
  171    H    GLY  26           H        GLY  26  -1.806   6.146  -3.779
  172    HA2  GLY  26           1HA      GLY  26  -1.264   6.380  -6.676
  173    HA3  GLY  26           2HA      GLY  26  -2.874   6.082  -6.053
  174    H    GLY  27           H        GLY  27  -1.264   7.943  -3.736
  175    HA2  GLY  27           1HA      GLY  27  -0.940  10.234  -3.522
  176    HA3  GLY  27           2HA      GLY  27  -1.813  10.517  -5.015
  177    H    THR  28           H        THR  28  -4.061   8.653  -4.278
  178    HA   THR  28           HA       THR  28  -5.237  10.157  -2.044
  179    HB   THR  28           HB       THR  28  -7.343  10.292  -3.426
  180    HG1  THR  28           1HG      THR  28  -7.042   9.635  -5.683
  181   HG21  THR  28          3HG2      THR  28  -4.821  11.416  -4.752
  182   HG22  THR  28          1HG2      THR  28  -6.477  11.862  -5.229
  183   HG23  THR  28          2HG2      THR  28  -5.881  12.265  -3.601
  184    H    GLY  29           H        GLY  29  -7.735   8.912  -2.024
  185    HA2  GLY  29           1HA      GLY  29  -8.785   6.905  -1.675
  186    HA3  GLY  29           2HA      GLY  29  -7.302   6.042  -2.032
  187    H    ASN  30           H        ASN  30  -6.728   4.831  -0.278
  188    HA   ASN  30           HA       ASN  30  -7.124   6.066   2.324
  189    HB2  ASN  30           1HB      ASN  30  -6.618   3.558   3.047
  190    HB3  ASN  30           2HB      ASN  30  -8.201   3.969   2.415
  191   HD21  ASN  30          1HD2      ASN  30  -8.957   2.915   0.730
  192   HD22  ASN  30          2HD2      ASN  30  -8.064   1.873  -0.328
  193    H    CYS  31           H        CYS  31  -4.879   6.699   0.461
  194    HA   CYS  31           HA       CYS  31  -2.593   5.262   0.934
  195    HB2  CYS  31           1HB      CYS  31  -1.471   6.951  -0.098
  196    HB3  CYS  31           2HB      CYS  31  -3.104   7.277  -0.645
  197    H    GLY  32           H        GLY  32  -0.809   5.606   2.463
  198    HA2  GLY  32           1HA      GLY  32  -0.499   7.369   4.448
  199    HA3  GLY  32           2HA      GLY  32  -1.768   6.351   5.101
  200    H    THR  33           H        THR  33   0.097   6.002   6.743
  201    HA   THR  33           HA       THR  33   2.157   4.190   5.801
  202    HB   THR  33           HB       THR  33   1.498   5.327   8.570
  203    HG1  THR  33           1HG      THR  33   2.050   6.897   6.867
  204   HG21  THR  33          3HG2      THR  33   3.028   3.404   8.764
  205   HG22  THR  33          1HG2      THR  33   3.995   3.999   7.393
  206   HG23  THR  33          2HG2      THR  33   3.976   4.902   8.927
  207    H    VAL  34           H        VAL  34  -1.090   3.902   6.632
  208    HA   VAL  34           HA       VAL  34  -0.815   1.445   8.107
  209    HB   VAL  34           HB       VAL  34  -3.180   2.929   6.948
  210   HG11  VAL  34          1HG1      VAL  34  -3.833   1.046   9.052
  211   HG12  VAL  34          2HG1      VAL  34  -4.518   1.205   7.417
  212   HG13  VAL  34          3HG1      VAL  34  -3.061   0.217   7.679
  213   HG21  VAL  34          3HG2      VAL  34  -1.704   3.033   9.513
  214   HG22  VAL  34          1HG2      VAL  34  -2.689   4.273   8.700
  215   HG23  VAL  34          2HG2      VAL  34  -3.478   2.992   9.651
  216    H    CYS  35           H        CYS  35  -1.353   2.548   4.757
  217    HA   CYS  35           HA       CYS  35  -2.253   0.115   3.741
  218    HB2  CYS  35           1HB      CYS  35  -2.529   1.402   1.973
  219    HB3  CYS  35           2HB      CYS  35  -1.632   2.691   2.752
  220    H    CYS  36           H        CYS  36   0.849   1.247   4.896
  221    HA   CYS  36           HA       CYS  36   2.607  -0.181   3.353
  222    HB2  CYS  36           1HB      CYS  36   2.797   0.371   6.322
  223    HB3  CYS  36           2HB      CYS  36   4.126  -0.090   5.278
  224    H    GLY  37           H        GLY  37   1.766  -1.193   6.736
  225    HA2  GLY  37           1HA      GLY  37   2.130  -3.976   6.000
  226    HA3  GLY  37           2HA      GLY  37   1.868  -3.313   7.600
  227    H    GLN  38           H        GLN  38  -0.022  -3.041   4.504
  228    HA   GLN  38           HA       GLN  38  -2.271  -4.141   6.005
  229    HB2  GLN  38           1HB      GLN  38  -2.059  -1.583   4.848
  230    HB3  GLN  38           2HB      GLN  38  -3.031  -2.485   3.703
  231    HG2  GLN  38           1HG      GLN  38  -4.475  -1.420   5.402
  232    HG3  GLN  38           2HG      GLN  38  -4.586  -3.165   5.516
  233   HE21  GLN  38          1HE2      GLN  38  -5.424  -1.958   7.636
  234   HE22  GLN  38          2HE2      GLN  38  -4.309  -1.989   8.961
  235    H    CYS  39           H        CYS  39  -1.113  -3.509   2.609
  236    HA   CYS  39           HA       CYS  39  -2.219  -6.133   1.923
  237    HB2  CYS  39           1HB      CYS  39  -1.716  -3.767   0.106
  238    HB3  CYS  39           2HB      CYS  39  -2.359  -5.322  -0.385
  239    H    PHE  40           H        PHE  40   0.602  -4.235   2.473
  240    HA   PHE  40           HA       PHE  40   2.214  -6.292   1.156
  241    HB2  PHE  40           1HB      PHE  40   3.116  -3.396   1.315
  242    HB3  PHE  40           2HB      PHE  40   3.540  -4.598   0.112
  243    HD1  PHE  40           2HD      PHE  40   2.065  -5.037  -1.784
  244    HD2  PHE  40           1HD      PHE  40   1.090  -2.081   1.100
  245    HE1  PHE  40           2HE      PHE  40   0.356  -4.074  -3.349
  246    HE2  PHE  40           1HE      PHE  40  -0.619  -1.118  -0.465
  247    HZ   PHE  40           HZ       PHE  40  -0.966  -2.126  -2.671
  248    H    SER  41           H        SER  41   4.657  -5.948   1.937
  249    HA   SER  41           HA       SER  41   4.663  -5.043   4.683
  250    HB2  SER  41           1HB      SER  41   5.083  -7.874   3.755
  251    HB3  SER  41           2HB      SER  41   6.105  -7.291   5.054
  252    HG   SER  41           HG       SER  41   4.433  -7.263   6.422
  253    H    PHE  42           H        PHE  42   6.948  -4.812   5.532
  254    HA   PHE  42           HA       PHE  42   8.556  -3.483   3.746
  255    HB2  PHE  42           1HB      PHE  42   8.466  -4.284   6.502
  256    HB3  PHE  42           2HB      PHE  42  10.016  -4.857   5.918
  257    HD1  PHE  42           1HD      PHE  42   7.905  -1.803   6.108
  258    HD2  PHE  42           2HD      PHE  42  11.824  -3.388   5.743
  259    HE1  PHE  42           1HE      PHE  42   8.862   0.500   6.388
  260    HE2  PHE  42           2HE      PHE  42  12.781  -1.084   6.023
  261    HZ   PHE  42           HZ       PHE  42  11.289   0.832   6.342
  262    HA   PRO  43           HA       PRO  43  10.668  -3.125   3.782
  263    HB2  PRO  43           1HB      PRO  43  12.324  -2.610   1.670
  264    HB3  PRO  43           2HB      PRO  43  12.895  -3.224   3.209
  265    HG2  PRO  43           1HG      PRO  43  12.562  -4.662   0.648
  266    HG3  PRO  43           2HG      PRO  43  13.508  -5.122   2.049
  267    HD2  PRO  43           1HD      PRO  43  10.963  -6.193   1.270
  268    HD3  PRO  43           2HD      PRO  43  11.855  -6.567   2.731
  269    H    VAL  44           H        VAL  44   8.671  -4.522   1.739
  270    HA   VAL  44           HA       VAL  44   8.274  -2.444  -0.144
  271    HB   VAL  44           HB       VAL  44   6.180  -4.424   0.690
  272   HG11  VAL  44          1HG1      VAL  44   5.455  -2.990  -1.045
  273   HG12  VAL  44          2HG1      VAL  44   7.013  -3.096  -1.899
  274   HG13  VAL  44          3HG1      VAL  44   5.924  -4.504  -1.855
  275   HG21  VAL  44          3HG2      VAL  44   7.847  -5.991   0.606
  276   HG22  VAL  44          1HG2      VAL  44   7.459  -5.895  -1.129
  277   HG23  VAL  44          2HG2      VAL  44   8.866  -5.017  -0.481
  278    H    SER  45           H        SER  45   6.975  -3.246   3.102
  279    HA   SER  45           HA       SER  45   4.819  -1.604   3.137
  280    HB2  SER  45           1HB      SER  45   4.866  -2.715   5.123
  281    HB3  SER  45           2HB      SER  45   6.614  -2.841   5.116
  282    HG   SER  45           HG       SER  45   5.867  -1.528   6.886
  283    H    GLN  46           H        GLN  46   8.168  -0.761   2.828
  284    HA   GLN  46           HA       GLN  46   7.803   1.862   3.937
  285    HB2  GLN  46           1HB      GLN  46   9.950   0.893   4.355
  286    HB3  GLN  46           2HB      GLN  46  10.147   0.391   2.687
  287    HG2  GLN  46           1HG      GLN  46  11.526   2.331   2.913
  288    HG3  GLN  46           2HG      GLN  46  10.104   2.886   2.051
  289   HE21  GLN  46          1HE2      GLN  46   9.547   4.818   2.676
  290   HE22  GLN  46          2HE2      GLN  46   9.505   5.432   4.296
  291    H    SER  47           H        SER  47   7.767   0.199   0.811
  292    HA   SER  47           HA       SER  47   8.161   2.505  -0.740
  293    HB2  SER  47           1HB      SER  47   8.395  -0.005  -1.394
  294    HB3  SER  47           2HB      SER  47   6.659   0.018  -1.632
  295    HG   SER  47           HG       SER  47   7.949   2.173  -2.863
  296    H    CYS  48           H        CYS  48   5.309   0.787   0.612
  297    HA   CYS  48           HA       CYS  48   3.318   1.998  -0.820
  298    HB2  CYS  48           1HB      CYS  48   2.487   0.348   0.484
  299    HB3  CYS  48           2HB      CYS  48   3.541   0.713   1.835
  300    H    ALA  49           H        ALA  49   4.340   2.949   2.548
  301    HA   ALA  49           HA       ALA  49   3.100   5.432   2.481
  302    HB1  ALA  49           3HB      ALA  49   5.067   5.805   4.294
  303    HB2  ALA  49           1HB      ALA  49   3.631   4.807   4.622
  304    HB3  ALA  49           2HB      ALA  49   5.158   4.034   4.134
  305    H    GLY  50           H        GLY  50   5.934   4.269   0.854
  306    HA2  GLY  50           1HA      GLY  50   7.323   6.774   0.701
  307    HA3  GLY  50           2HA      GLY  50   7.646   5.309  -0.205
  308    H    MET  51           H        MET  51   5.680   4.725  -1.824
  309    HA   MET  51           HA       MET  51   5.604   6.924  -3.596
  310    HB2  MET  51           1HB      MET  51   5.772   4.472  -4.253
  311    HB3  MET  51           2HB      MET  51   4.133   4.230  -3.680
  312    HG2  MET  51           1HG      MET  51   4.073   4.553  -6.106
  313    HG3  MET  51           2HG      MET  51   3.317   5.936  -5.341
  314    HE1  MET  51           3HE      MET  51   5.954   5.600  -8.413
  315    HE2  MET  51           1HE      MET  51   7.303   5.400  -7.269
  316    HE3  MET  51           2HE      MET  51   5.879   4.337  -7.161
  317    H    ALA  52           H        ALA  52   3.829   6.303  -0.842
  318    HA   ALA  52           HA       ALA  52   1.229   6.977  -1.876
  319    HB1  ALA  52           3HB      ALA  52   2.457   6.234   0.754
  320    HB2  ALA  52           1HB      ALA  52   0.938   7.162   0.783
  321    HB3  ALA  52           2HB      ALA  52   1.006   5.591  -0.051
  322    H    ASP  53           H        ASP  53   2.876   8.922  -2.821
  323    HA   ASP  53           HA       ASP  53   3.268  11.055  -2.872
  324    HB2  ASP  53           1HB      ASP  53   0.587  10.751  -1.835
  325    HB3  ASP  53           2HB      ASP  53   1.311  12.140  -1.048
  326    H    SER  54           H        SER  54   3.503  13.193  -1.294
  327    HA   SER  54           HA       SER  54   4.793  12.177   1.116
  328    HB2  SER  54           1HB      SER  54   5.655  14.036  -0.973
  329    HB3  SER  54           2HB      SER  54   5.741  14.795   0.604
  330    HG   SER  54           HG       SER  54   6.860  12.666   1.257
  331    H    ASN  55           H        ASN  55   3.647  15.429  -0.050
  332    HA   ASN  55           HA       ASN  55   2.183  15.610   2.465
  333    HB2  ASN  55           1HB      ASN  55   4.209  17.279   1.595
  334    HB3  ASN  55           2HB      ASN  55   2.812  18.120   0.954
  335   HD21  ASN  55          1HD2      ASN  55   4.424  19.217   2.886
  336   HD22  ASN  55          2HD2      ASN  55   3.570  19.366   4.386
  337    H    ASP  56           H        ASP  56   1.975  15.236  -0.903
  338    HA   ASP  56           HA       ASP  56  -0.151  16.996  -1.445
  339    HB2  ASP  56           1HB      ASP  56   1.253  14.735  -2.825
  340    HB3  ASP  56           2HB      ASP  56  -0.377  15.067  -3.376
  341    H    CYS  57           H        CYS  57   0.242  13.644  -0.274
  342    HA   CYS  57           HA       CYS  57  -2.325  12.715  -0.802
  343    HB2  CYS  57           1HB      CYS  57   0.018  11.811   0.567
  344    HB3  CYS  57           2HB      CYS  57  -1.366  11.540   1.606
  345    HA   PRO  58           HA       PRO  58  -4.645  14.708   2.298
  346    HB2  PRO  58           1HB      PRO  58  -6.614  12.892   2.841
  347    HB3  PRO  58           2HB      PRO  58  -6.638  13.940   1.437
  348    HG2  PRO  58           1HG      PRO  58  -6.023  11.052   1.583
  349    HG3  PRO  58           2HG      PRO  58  -6.466  12.011   0.185
  350    HD2  PRO  58           1HD      PRO  58  -3.839  11.086   0.870
  351    HD3  PRO  58           2HD      PRO  58  -4.264  12.140  -0.464
  352    H    ASN  59           H        ASN  59  -2.386  14.147   3.454
  353    HA   ASN  59           HA       ASN  59  -2.837  12.353   5.611
  354    HB2  ASN  59           1HB      ASN  59  -0.589  14.258   4.829
  355    HB3  ASN  59           2HB      ASN  59  -0.559  13.441   6.379
  356   HD21  ASN  59          1HD2      ASN  59   1.365  12.424   5.663
  357   HD22  ASN  59          2HD2      ASN  59   1.328  11.030   4.635
  358    H    ALA  60           H        ALA  60  -2.177  13.311   7.952
  359    HA   ALA  60           HA       ALA  60  -2.828  14.557   9.663
  360    HB1  ALA  60           3HB      ALA  60  -2.672  17.092   9.254
  361    HB2  ALA  60           1HB      ALA  60  -1.208  16.134   8.927
  362    HB3  ALA  60           2HB      ALA  60  -2.234  16.680   7.578
  Start of MODEL   18
    1    H1   ASP   1           H        ASP   1  10.526  -6.665  -7.055
    2    HA   ASP   1           HA       ASP   1   8.151  -7.102  -7.504
    3    HB2  ASP   1           1HB      ASP   1   9.309  -9.169  -5.594
    4    HB3  ASP   1           2HB      ASP   1   8.268  -9.456  -6.975
    5    H    ILE   2           H        ILE   2   6.465  -5.969  -6.429
    6    HA   ILE   2           HA       ILE   2   6.238  -6.190  -3.560
    7    HB   ILE   2           HB       ILE   2   4.880  -4.391  -3.663
    8   HG12  ILE   2          1HG1      ILE   2   3.891  -5.286  -6.387
    9   HG13  ILE   2          2HG1      ILE   2   3.062  -5.518  -4.861
   10   HG21  ILE   2          1HG2      ILE   2   6.060  -4.006  -6.412
   11   HG22  ILE   2          2HG2      ILE   2   5.756  -2.798  -5.140
   12   HG23  ILE   2          3HG2      ILE   2   7.063  -3.991  -4.941
   13   HD11  ILE   2          3HD1      ILE   2   3.213  -3.118  -6.554
   14   HD12  ILE   2          1HD1      ILE   2   2.059  -3.519  -5.259
   15   HD13  ILE   2          2HD1      ILE   2   3.625  -2.774  -4.857
   16    H    GLU   3           H        GLU   3   4.744  -7.482  -6.533
   17    HA   GLU   3           HA       GLU   3   2.441  -8.468  -5.442
   18    HB2  GLU   3           1HB      GLU   3   2.523 -10.129  -7.337
   19    HB3  GLU   3           2HB      GLU   3   2.790  -8.471  -7.837
   20    HG2  GLU   3           1HG      GLU   3   5.128  -8.801  -8.145
   21    HG3  GLU   3           2HG      GLU   3   5.158 -10.234  -7.137
   22    H    ASP   4           H        ASP   4   5.786  -9.585  -5.136
   23    HA   ASP   4           HA       ASP   4   5.115 -12.184  -4.295
   24    HB2  ASP   4           1HB      ASP   4   7.630 -10.514  -3.826
   25    HB3  ASP   4           2HB      ASP   4   7.511 -12.234  -3.509
   26    H    PHE   5           H        PHE   5   4.569  -9.166  -2.923
   27    HA   PHE   5           HA       PHE   5   4.684 -10.286  -0.215
   28    HB2  PHE   5           1HB      PHE   5   5.643  -7.683  -1.440
   29    HB3  PHE   5           2HB      PHE   5   4.941  -7.574   0.161
   30    HD1  PHE   5           2HD      PHE   5   6.030  -8.666   2.073
   31    HD2  PHE   5           1HD      PHE   5   7.783  -8.739  -1.791
   32    HE1  PHE   5           2HE      PHE   5   8.223  -9.352   3.081
   33    HE2  PHE   5           1HE      PHE   5   9.976  -9.426  -0.782
   34    HZ   PHE   5           HZ       PHE   5  10.170  -9.724   1.642
   35    H    TYR   6           H        TYR   6   2.557  -9.938  -2.461
   36    HA   TYR   6           HA       TYR   6   0.779  -7.957  -1.402
   37    HB2  TYR   6           1HB      TYR   6   1.050  -8.822  -3.833
   38    HB3  TYR   6           2HB      TYR   6   0.376 -10.350  -3.302
   39    HD1  TYR   6           1HD      TYR   6  -0.939  -7.232  -1.887
   40    HD2  TYR   6           2HD      TYR   6  -1.432 -10.167  -4.961
   41    HE1  TYR   6           1HE      TYR   6  -3.283  -6.364  -2.351
   42    HE2  TYR   6           2HE      TYR   6  -3.774  -9.289  -5.414
   43    HH   TYR   6           HH       TYR   6  -4.892  -6.865  -5.031
   44    H    THR   7           H        THR   7  -0.415  -8.214   0.414
   45    HA   THR   7           HA       THR   7  -1.090 -10.963   1.202
   46    HB   THR   7           HB       THR   7  -1.071 -10.130   3.443
   47    HG1  THR   7           1HG      THR   7  -1.114  -7.506   2.124
   48   HG21  THR   7          3HG2      THR   7   1.027  -9.054   3.733
   49   HG22  THR   7          1HG2      THR   7   1.233  -9.854   2.156
   50   HG23  THR   7          2HG2      THR   7   0.855  -8.116   2.230
   51    H    SER   8           H        SER   8  -2.864 -11.352  -0.146
   52    HA   SER   8           HA       SER   8  -4.948  -9.449  -0.282
   53    HB2  SER   8           1HB      SER   8  -4.415 -11.108  -2.091
   54    HB3  SER   8           2HB      SER   8  -4.947 -12.405  -1.039
   55    HG   SER   8           HG       SER   8  -6.450 -10.666  -2.586
   56    H    GLU   9           H        GLU   9  -3.897 -11.290   2.257
   57    HA   GLU   9           HA       GLU   9  -6.382 -12.374   3.098
   58    HB2  GLU   9           1HB      GLU   9  -3.689 -12.776   3.748
   59    HB3  GLU   9           2HB      GLU   9  -4.333 -12.010   5.187
   60    HG2  GLU   9           1HG      GLU   9  -6.346 -13.795   4.684
   61    HG3  GLU   9           2HG      GLU   9  -4.997 -14.676   3.993
   62    H    THR  10           H        THR  10  -4.366  -9.485   3.874
   63    HA   THR  10           HA       THR  10  -6.567  -8.506   5.562
   64    HB   THR  10           HB       THR  10  -4.531  -8.584   6.826
   65    HG1  THR  10           1HG      THR  10  -5.211  -6.475   7.142
   66   HG21  THR  10          3HG2      THR  10  -3.290  -7.897   4.190
   67   HG22  THR  10          1HG2      THR  10  -2.583  -7.074   5.601
   68   HG23  THR  10          2HG2      THR  10  -2.625  -8.853   5.536
   69    H    CYS  11           H        CYS  11  -4.852  -8.071   2.542
   70    HA   CYS  11           HA       CYS  11  -5.402  -5.361   2.175
   71    HB2  CYS  11           1HB      CYS  11  -3.772  -6.728   0.875
   72    HB3  CYS  11           2HB      CYS  11  -5.116  -7.503   0.059
   73    HA   PRO  12           HA       PRO  12  -9.693  -5.644   1.412
   74    HB2  PRO  12           1HB      PRO  12 -10.143  -3.140   0.413
   75    HB3  PRO  12           2HB      PRO  12 -10.034  -3.482   2.129
   76    HG2  PRO  12           1HG      PRO  12  -8.046  -2.183   0.369
   77    HG3  PRO  12           2HG      PRO  12  -8.148  -2.155   2.118
   78    HD2  PRO  12           1HD      PRO  12  -6.334  -3.708   0.530
   79    HD3  PRO  12           2HD      PRO  12  -6.515  -3.766   2.272
   80    H    TYR  13           H        TYR  13  -7.372  -5.258  -1.001
   81    HA   TYR  13           HA       TYR  13  -9.428  -5.827  -3.027
   82    HB2  TYR  13           1HB      TYR  13  -6.525  -4.869  -3.349
   83    HB3  TYR  13           2HB      TYR  13  -7.788  -4.785  -4.561
   84    HD1  TYR  13           2HD      TYR  13  -9.684  -3.144  -4.267
   85    HD2  TYR  13           1HD      TYR  13  -6.231  -3.126  -1.741
   86    HE1  TYR  13           2HE      TYR  13 -10.234  -0.777  -3.520
   87    HE2  TYR  13           1HE      TYR  13  -6.792  -0.758  -1.003
   88    HH   TYR  13           HH       TYR  13  -8.950   0.612  -0.845
   89    H    LYS  14           H        LYS  14  -9.098  -7.550  -4.500
   90    HA   LYS  14           HA       LYS  14  -6.769  -9.233  -3.965
   91    HB2  LYS  14           1HB      LYS  14  -8.038 -11.196  -3.672
   92    HB3  LYS  14           2HB      LYS  14  -8.773 -10.003  -2.620
   93    HG2  LYS  14           1HG      LYS  14  -9.776 -10.695  -5.422
   94    HG3  LYS  14           2HG      LYS  14 -10.460 -11.327  -3.937
   95    HD2  LYS  14           1HD      LYS  14 -11.817  -9.508  -3.895
   96    HD3  LYS  14           2HD      LYS  14 -10.405  -8.550  -3.498
   97    HE2  LYS  14           1HE      LYS  14 -11.356  -7.501  -5.434
   98    HE3  LYS  14           2HE      LYS  14  -9.950  -8.365  -6.022
   99    HZ1  LYS  14           3HZ      LYS  14 -11.334 -10.105  -6.785
  100    HZ2  LYS  14           1HZ      LYS  14 -12.663  -9.486  -6.067
  101    HZ3  LYS  14           2HZ      LYS  14 -11.982  -8.710  -7.332
  102    H    ASN  15           H        ASN  15  -7.393  -7.262  -6.063
  103    HA   ASN  15           HA       ASN  15  -7.975  -9.009  -8.298
  104    HB2  ASN  15           1HB      ASN  15  -8.819  -6.446  -7.765
  105    HB3  ASN  15           2HB      ASN  15  -7.398  -6.091  -8.726
  106   HD21  ASN  15          1HD2      ASN  15 -10.211  -8.272  -8.673
  107   HD22  ASN  15          2HD2      ASN  15 -10.565  -8.218 -10.367
  108    H    ASP  16           H        ASP  16  -5.557  -6.635  -7.002
  109    HA   ASP  16           HA       ASP  16  -3.446  -8.108  -8.155
  110    HB2  ASP  16           1HB      ASP  16  -4.559  -6.251  -9.877
  111    HB3  ASP  16           2HB      ASP  16  -3.332  -5.278  -9.090
  112    H    SER  17           H        SER  17  -1.317  -7.212  -7.372
  113    HA   SER  17           HA       SER  17  -1.634  -6.002  -4.847
  114    HB2  SER  17           1HB      SER  17   0.861  -6.141  -4.762
  115    HB3  SER  17           2HB      SER  17   0.115  -7.662  -5.207
  116    HG   SER  17           HG       SER  17   2.048  -6.583  -6.519
  117    H    GLN  18           H        GLN  18  -0.698  -4.933  -8.125
  118    HA   GLN  18           HA       GLN  18   0.341  -2.459  -7.267
  119    HB2  GLN  18           1HB      GLN  18   0.646  -3.823  -9.528
  120    HB3  GLN  18           2HB      GLN  18  -0.755  -2.908 -10.047
  121    HG2  GLN  18           1HG      GLN  18   1.343  -1.278  -8.699
  122    HG3  GLN  18           2HG      GLN  18   1.857  -2.011 -10.205
  123   HE21  GLN  18          1HE2      GLN  18  -0.402   0.155  -8.657
  124   HE22  GLN  18          2HE2      GLN  18  -0.963   0.983 -10.071
  125    H    LEU  19           H        LEU  19  -2.873  -3.742  -7.911
  126    HA   LEU  19           HA       LEU  19  -4.161  -1.323  -8.509
  127    HB2  LEU  19           1HB      LEU  19  -5.332  -3.204  -9.106
  128    HB3  LEU  19           2HB      LEU  19  -4.977  -4.048  -7.611
  129    HG   LEU  19           HG       LEU  19  -7.366  -3.399  -7.895
  130   HD11  LEU  19          1HD1      LEU  19  -7.690  -3.127  -5.655
  131   HD12  LEU  19          2HD1      LEU  19  -5.975  -3.603  -5.643
  132   HD13  LEU  19          3HD1      LEU  19  -6.423  -1.886  -5.502
  133   HD21  LEU  19          3HD2      LEU  19  -7.666  -1.377  -8.836
  134   HD22  LEU  19          1HD2      LEU  19  -7.598  -0.802  -7.152
  135   HD23  LEU  19          2HD2      LEU  19  -6.147  -0.722  -8.180
  136    H    ALA  20           H        ALA  20  -4.012  -3.202  -5.397
  137    HA   ALA  20           HA       ALA  20  -5.212  -1.206  -3.870
  138    HB1  ALA  20           3HB      ALA  20  -3.212  -3.353  -3.051
  139    HB2  ALA  20           1HB      ALA  20  -4.328  -2.488  -1.967
  140    HB3  ALA  20           2HB      ALA  20  -4.970  -3.584  -3.214
  141    H    TRP  21           H        TRP  21  -1.860  -1.711  -4.982
  142    HA   TRP  21           HA       TRP  21  -0.671   0.114  -3.191
  143    HB2  TRP  21           1HB      TRP  21   0.779  -1.417  -4.147
  144    HB3  TRP  21           2HB      TRP  21   0.131  -1.200  -5.761
  145    HD1  TRP  21           HD       TRP  21   0.857   1.240  -6.994
  146    HE1  TRP  21           1HE      TRP  21   3.070   2.672  -6.873
  147    HE3  TRP  21           3HE      TRP  21   2.565  -0.803  -2.662
  148    HZ2  TRP  21           2HZ      TRP  21   5.237   2.788  -5.020
  149    HZ3  TRP  21           3HZ      TRP  21   4.738   0.026  -1.765
  150    HH2  TRP  21           HH       TRP  21   6.061   1.758  -2.870
  151    H    ASP  22           H        ASP  22  -2.239   0.330  -6.418
  152    HA   ASP  22           HA       ASP  22  -1.436   2.923  -6.971
  153    HB2  ASP  22           1HB      ASP  22  -2.907   0.949  -8.248
  154    HB3  ASP  22           2HB      ASP  22  -4.155   2.125  -7.891
  155    H    THR  23           H        THR  23  -3.541   1.629  -4.573
  156    HA   THR  23           HA       THR  23  -5.268   3.973  -4.467
  157    HB   THR  23           HB       THR  23  -5.260   1.159  -3.488
  158    HG1  THR  23           1HG      THR  23  -6.705   2.175  -5.100
  159   HG21  THR  23          3HG2      THR  23  -7.131   2.090  -1.789
  160   HG22  THR  23          1HG2      THR  23  -5.446   1.873  -1.258
  161   HG23  THR  23          2HG2      THR  23  -6.032   3.488  -1.723
  162    H    CYS  24           H        CYS  24  -3.359   2.162  -1.969
  163    HA   CYS  24           HA       CYS  24  -3.228   4.424  -0.318
  164    HB2  CYS  24           1HB      CYS  24  -2.893   2.669   1.015
  165    HB3  CYS  24           2HB      CYS  24  -2.279   1.664  -0.283
  166    H    SER  25           H        SER  25  -0.585   2.652  -2.103
  167    HA   SER  25           HA       SER  25   1.096   4.927  -1.898
  168    HB2  SER  25           1HB      SER  25   2.256   3.193  -3.767
  169    HB3  SER  25           2HB      SER  25   2.586   3.233  -2.046
  170    HG   SER  25           HG       SER  25   1.111   1.570  -1.681
  171    H    GLY  26           H        GLY  26  -1.053   5.994  -3.091
  172    HA2  GLY  26           1HA      GLY  26  -0.263   6.229  -5.929
  173    HA3  GLY  26           2HA      GLY  26  -1.941   6.067  -5.449
  174    H    GLY  27           H        GLY  27  -2.852   8.055  -5.862
  175    HA2  GLY  27           1HA      GLY  27  -1.393  10.444  -4.939
  176    HA3  GLY  27           2HA      GLY  27  -2.640  10.398  -6.169
  177    H    THR  28           H        THR  28  -4.521   8.651  -4.775
  178    HA   THR  28           HA       THR  28  -5.141  10.177  -2.353
  179    HB   THR  28           HB       THR  28  -7.484  10.466  -3.201
  180    HG1  THR  28           1HG      THR  28  -7.785   9.819  -5.459
  181   HG21  THR  28          3HG2      THR  28  -5.265  11.476  -5.050
  182   HG22  THR  28          1HG2      THR  28  -6.966  11.971  -5.217
  183   HG23  THR  28          2HG2      THR  28  -6.063  12.375  -3.738
  184    H    GLY  29           H        GLY  29  -7.717   8.968  -1.985
  185    HA2  GLY  29           1HA      GLY  29  -8.699   6.900  -1.615
  186    HA3  GLY  29           2HA      GLY  29  -7.184   6.093  -1.971
  187    H    ASN  30           H        ASN  30  -6.192   5.174  -0.236
  188    HA   ASN  30           HA       ASN  30  -6.464   6.589   2.294
  189    HB2  ASN  30           1HB      ASN  30  -6.311   4.078   3.235
  190    HB3  ASN  30           2HB      ASN  30  -7.856   4.769   2.782
  191   HD21  ASN  30          1HD2      ASN  30  -5.701   2.251   2.344
  192   HD22  ASN  30          2HD2      ASN  30  -6.371   1.506   0.931
  193    H    CYS  31           H        CYS  31  -4.257   7.351   1.296
  194    HA   CYS  31           HA       CYS  31  -2.197   5.349   1.282
  195    HB2  CYS  31           1HB      CYS  31  -0.780   6.983   0.409
  196    HB3  CYS  31           2HB      CYS  31  -2.340   7.287  -0.330
  197    H    GLY  32           H        GLY  32  -0.611   5.085   2.907
  198    HA2  GLY  32           1HA      GLY  32   0.001   6.899   4.920
  199    HA3  GLY  32           2HA      GLY  32  -1.299   5.896   5.532
  200    H    THR  33           H        THR  33   0.798   5.508   7.018
  201    HA   THR  33           HA       THR  33   2.608   3.558   5.881
  202    HB   THR  33           HB       THR  33   2.290   4.717   8.701
  203    HG1  THR  33           1HG      THR  33   3.432   6.368   7.754
  204   HG21  THR  33          3HG2      THR  33   4.703   4.068   8.910
  205   HG22  THR  33          1HG2      THR  33   3.670   2.636   8.686
  206   HG23  THR  33          2HG2      THR  33   4.615   3.273   7.319
  207    H    VAL  34           H        VAL  34  -0.559   3.453   6.969
  208    HA   VAL  34           HA       VAL  34  -0.381   1.059   8.511
  209    HB   VAL  34           HB       VAL  34  -2.673   2.530   7.201
  210   HG11  VAL  34          1HG1      VAL  34  -2.972   0.413   9.334
  211   HG12  VAL  34          2HG1      VAL  34  -4.211   1.111   8.264
  212   HG13  VAL  34          3HG1      VAL  34  -2.988   0.000   7.603
  213   HG21  VAL  34          3HG2      VAL  34  -1.355   3.622   9.104
  214   HG22  VAL  34          1HG2      VAL  34  -3.116   3.479   9.320
  215   HG23  VAL  34          2HG2      VAL  34  -2.022   2.346  10.150
  216    H    CYS  35           H        CYS  35  -1.077   1.938   5.090
  217    HA   CYS  35           HA       CYS  35  -1.852  -0.619   4.293
  218    HB2  CYS  35           1HB      CYS  35  -2.282   0.455   2.416
  219    HB3  CYS  35           2HB      CYS  35  -1.586   1.903   3.116
  220    H    CYS  36           H        CYS  36   1.151   0.654   5.388
  221    HA   CYS  36           HA       CYS  36   3.005  -0.575   3.787
  222    HB2  CYS  36           1HB      CYS  36   4.540  -0.029   5.369
  223    HB3  CYS  36           2HB      CYS  36   3.231   1.040   5.832
  224    H    GLY  37           H        GLY  37   1.359  -1.796   6.795
  225    HA2  GLY  37           1HA      GLY  37   2.156  -4.533   6.007
  226    HA3  GLY  37           2HA      GLY  37   1.916  -3.986   7.654
  227    H    GLN  38           H        GLN  38  -0.126  -3.202   4.780
  228    HA   GLN  38           HA       GLN  38  -2.254  -4.709   6.093
  229    HB2  GLN  38           1HB      GLN  38  -2.302  -2.044   5.967
  230    HB3  GLN  38           2HB      GLN  38  -2.861  -2.334   4.332
  231    HG2  GLN  38           1HG      GLN  38  -4.858  -2.218   5.629
  232    HG3  GLN  38           2HG      GLN  38  -4.616  -3.932   5.354
  233   HE21  GLN  38          1HE2      GLN  38  -5.733  -4.576   7.142
  234   HE22  GLN  38          2HE2      GLN  38  -5.170  -4.377   8.767
  235    H    CYS  39           H        CYS  39  -0.917  -3.452   2.977
  236    HA   CYS  39           HA       CYS  39  -2.365  -5.618   1.639
  237    HB2  CYS  39           1HB      CYS  39  -2.532  -2.983   1.067
  238    HB3  CYS  39           2HB      CYS  39  -1.188  -3.423   0.032
  239    H    PHE  40           H        PHE  40   0.725  -4.116   2.467
  240    HA   PHE  40           HA       PHE  40   2.072  -6.331   1.113
  241    HB2  PHE  40           1HB      PHE  40   3.312  -3.563   1.310
  242    HB3  PHE  40           2HB      PHE  40   3.612  -4.799   0.105
  243    HD1  PHE  40           2HD      PHE  40   1.313  -2.125   1.141
  244    HD2  PHE  40           1HD      PHE  40   2.262  -4.954  -1.876
  245    HE1  PHE  40           2HE      PHE  40  -0.254  -0.965  -0.439
  246    HE2  PHE  40           1HE      PHE  40   0.695  -3.794  -3.457
  247    HZ   PHE  40           HZ       PHE  40  -0.544  -1.813  -2.719
  248    H    SER  41           H        SER  41   4.673  -5.872   1.856
  249    HA   SER  41           HA       SER  41   4.689  -5.206   4.646
  250    HB2  SER  41           1HB      SER  41   4.546  -7.331   5.396
  251    HB3  SER  41           2HB      SER  41   4.491  -7.949   3.757
  252    HG   SER  41           HG       SER  41   6.846  -7.870   3.715
  253    H    PHE  42           H        PHE  42   6.971  -5.094   5.497
  254    HA   PHE  42           HA       PHE  42   8.652  -3.813   3.734
  255    HB2  PHE  42           1HB      PHE  42   8.491  -4.597   6.481
  256    HB3  PHE  42           2HB      PHE  42  10.004  -5.284   5.924
  257    HD1  PHE  42           2HD      PHE  42   8.121  -2.063   5.870
  258    HD2  PHE  42           1HD      PHE  42  11.910  -3.972   5.966
  259    HE1  PHE  42           2HE      PHE  42   9.237   0.167   6.153
  260    HE2  PHE  42           1HE      PHE  42  13.026  -1.742   6.250
  261    HZ   PHE  42           HZ       PHE  42  11.677   0.301   6.340
  262    HA   PRO  43           HA       PRO  43  10.791  -3.563   3.825
  263    HB2  PRO  43           1HB      PRO  43  12.516  -3.107   1.755
  264    HB3  PRO  43           2HB      PRO  43  13.022  -3.772   3.296
  265    HG2  PRO  43           1HG      PRO  43  12.667  -5.154   0.707
  266    HG3  PRO  43           2HG      PRO  43  13.558  -5.683   2.120
  267    HD2  PRO  43           1HD      PRO  43  10.978  -6.607   1.273
  268    HD3  PRO  43           2HD      PRO  43  11.818  -7.048   2.747
  269    H    VAL  44           H        VAL  44   8.737  -4.809   1.765
  270    HA   VAL  44           HA       VAL  44   8.497  -2.696  -0.112
  271    HB   VAL  44           HB       VAL  44   6.271  -4.551   0.656
  272   HG11  VAL  44          1HG1      VAL  44   6.153  -4.620  -1.929
  273   HG12  VAL  44          2HG1      VAL  44   5.644  -3.130  -1.097
  274   HG13  VAL  44          3HG1      VAL  44   7.245  -3.215  -1.870
  275   HG21  VAL  44          3HG2      VAL  44   7.679  -5.968  -1.250
  276   HG22  VAL  44          1HG2      VAL  44   8.967  -5.348  -0.190
  277   HG23  VAL  44          2HG2      VAL  44   7.643  -6.321   0.494
  278    H    SER  45           H        SER  45   7.079  -3.473   3.092
  279    HA   SER  45           HA       SER  45   5.026  -1.710   3.117
  280    HB2  SER  45           1HB      SER  45   4.957  -2.801   5.105
  281    HB3  SER  45           2HB      SER  45   6.683  -3.103   5.093
  282    HG   SER  45           HG       SER  45   6.239  -1.763   6.868
  283    H    GLN  46           H        GLN  46   8.460  -1.071   3.001
  284    HA   GLN  46           HA       GLN  46   8.285   1.515   4.158
  285    HB2  GLN  46           1HB      GLN  46  10.340  -0.152   3.910
  286    HB3  GLN  46           2HB      GLN  46  10.553   0.642   2.363
  287    HG2  GLN  46           1HG      GLN  46  10.174   2.823   4.017
  288    HG3  GLN  46           2HG      GLN  46  10.968   1.711   5.115
  289   HE21  GLN  46          1HE2      GLN  46  12.419   3.747   4.763
  290   HE22  GLN  46          2HE2      GLN  46  13.710   3.556   3.624
  291    H    SER  47           H        SER  47   8.006   0.074   0.923
  292    HA   SER  47           HA       SER  47   8.320   2.547  -0.420
  293    HB2  SER  47           1HB      SER  47   6.929   0.128  -1.598
  294    HB3  SER  47           2HB      SER  47   7.928   1.317  -2.412
  295    HG   SER  47           HG       SER  47   8.766  -0.797  -0.633
  296    H    CYS  48           H        CYS  48   5.614   0.545   0.821
  297    HA   CYS  48           HA       CYS  48   3.519   1.730  -0.482
  298    HB2  CYS  48           1HB      CYS  48   2.865  -0.094   0.705
  299    HB3  CYS  48           2HB      CYS  48   3.869   0.290   2.090
  300    H    ALA  49           H        ALA  49   5.141   2.645   2.638
  301    HA   ALA  49           HA       ALA  49   3.537   4.967   2.977
  302    HB1  ALA  49           3HB      ALA  49   6.006   3.794   4.265
  303    HB2  ALA  49           1HB      ALA  49   5.465   5.437   4.682
  304    HB3  ALA  49           2HB      ALA  49   4.387   4.048   4.960
  305    H    GLY  50           H        GLY  50   6.392   4.130   1.121
  306    HA2  GLY  50           1HA      GLY  50   7.481   6.769   0.945
  307    HA3  GLY  50           2HA      GLY  50   7.887   5.374  -0.035
  308    H    MET  51           H        MET  51   5.568   4.646  -1.312
  309    HA   MET  51           HA       MET  51   5.225   6.896  -3.059
  310    HB2  MET  51           1HB      MET  51   5.612   4.390  -3.714
  311    HB3  MET  51           2HB      MET  51   3.939   4.126  -3.266
  312    HG2  MET  51           1HG      MET  51   3.978   4.534  -5.656
  313    HG3  MET  51           2HG      MET  51   3.270   5.950  -4.907
  314    HE1  MET  51           3HE      MET  51   3.678   7.883  -5.210
  315    HE2  MET  51           1HE      MET  51   5.261   8.689  -5.104
  316    HE3  MET  51           2HE      MET  51   4.534   8.363  -6.695
  317    H    ALA  52           H        ALA  52   4.001   6.796  -0.259
  318    HA   ALA  52           HA       ALA  52   1.171   6.591  -0.823
  319    HB1  ALA  52           3HB      ALA  52   0.998   6.297   1.413
  320    HB2  ALA  52           1HB      ALA  52   2.771   6.147   1.399
  321    HB3  ALA  52           2HB      ALA  52   2.014   7.716   1.764
  322    H    ASP  53           H        ASP  53   2.397   8.483  -2.499
  323    HA   ASP  53           HA       ASP  53   2.279  10.545  -3.159
  324    HB2  ASP  53           1HB      ASP  53  -0.195  10.052  -2.566
  325    HB3  ASP  53           2HB      ASP  53   0.069  10.983  -1.105
  326    H    SER  54           H        SER  54   2.318  13.013  -2.332
  327    HA   SER  54           HA       SER  54   3.984  12.990   0.044
  328    HB2  SER  54           1HB      SER  54   3.931  14.536  -2.479
  329    HB3  SER  54           2HB      SER  54   4.169  15.541  -1.063
  330    HG   SER  54           HG       SER  54   6.126  14.683  -0.721
  331    H    ASN  55           H        ASN  55   2.214  15.796  -1.342
  332    HA   ASN  55           HA       ASN  55   0.771  15.937   1.187
  333    HB2  ASN  55           1HB      ASN  55   2.516  17.817   0.096
  334    HB3  ASN  55           2HB      ASN  55   0.967  18.415  -0.463
  335   HD21  ASN  55          1HD2      ASN  55  -0.289  19.521   0.863
  336   HD22  ASN  55          2HD2      ASN  55  -0.062  19.723   2.568
  337    H    ASP  56           H        ASP  56   0.576  15.340  -2.160
  338    HA   ASP  56           HA       ASP  56  -1.805  16.727  -2.735
  339    HB2  ASP  56           1HB      ASP  56  -0.556  14.283  -4.079
  340    HB3  ASP  56           2HB      ASP  56  -1.841  15.255  -4.769
  341    H    CYS  57           H        CYS  57  -1.133  14.165  -0.665
  342    HA   CYS  57           HA       CYS  57  -3.364  12.496  -1.345
  343    HB2  CYS  57           1HB      CYS  57  -0.983  12.203   0.134
  344    HB3  CYS  57           2HB      CYS  57  -2.288  12.017   1.289
  345    HA   PRO  58           HA       PRO  58  -6.195  14.533   1.263
  346    HB2  PRO  58           1HB      PRO  58  -7.884  12.514   1.998
  347    HB3  PRO  58           2HB      PRO  58  -7.970  13.317   0.443
  348    HG2  PRO  58           1HG      PRO  58  -6.916  10.631   1.085
  349    HG3  PRO  58           2HG      PRO  58  -7.400  11.277  -0.470
  350    HD2  PRO  58           1HD      PRO  58  -4.717  10.925   0.482
  351    HD3  PRO  58           2HD      PRO  58  -5.205  11.677  -1.024
  352    H    ASN  59           H        ASN  59  -3.950  14.514   2.596
  353    HA   ASN  59           HA       ASN  59  -4.615  13.237   5.115
  354    HB2  ASN  59           1HB      ASN  59  -2.062  14.198   3.808
  355    HB3  ASN  59           2HB      ASN  59  -2.119  14.187   5.559
  356   HD21  ASN  59          1HD2      ASN  59  -2.195  12.294   6.687
  357   HD22  ASN  59          2HD2      ASN  59  -1.953  10.730   5.982
  358    H    ALA  60           H        ALA  60  -3.824  14.667   7.119
  359    HA   ALA  60           HA       ALA  60  -4.368  16.439   8.357
  360    HB1  ALA  60           3HB      ALA  60  -2.678  17.896   8.068
  361    HB2  ALA  60           1HB      ALA  60  -2.302  17.050   6.548
  362    HB3  ALA  60           2HB      ALA  60  -3.365  18.478   6.533
  Start of MODEL   19
    1    H1   ASP   1           H        ASP   1  10.511  -6.491  -7.271
    2    HA   ASP   1           HA       ASP   1   8.152  -6.405  -7.651
    3    HB2  ASP   1           1HB      ASP   1   8.861  -9.068  -6.345
    4    HB3  ASP   1           2HB      ASP   1   7.699  -8.804  -7.630
    5    H    ILE   2           H        ILE   2   6.286  -5.755  -6.567
    6    HA   ILE   2           HA       ILE   2   6.192  -6.105  -3.694
    7    HB   ILE   2           HB       ILE   2   4.781  -4.347  -3.650
    8   HG12  ILE   2          1HG1      ILE   2   3.682  -5.236  -6.330
    9   HG13  ILE   2          2HG1      ILE   2   2.915  -5.400  -4.764
   10   HG21  ILE   2          1HG2      ILE   2   5.663  -3.643  -6.417
   11   HG22  ILE   2          2HG2      ILE   2   5.671  -2.673  -4.925
   12   HG23  ILE   2          3HG2      ILE   2   6.903  -3.933  -5.174
   13   HD11  ILE   2          3HD1      ILE   2   1.887  -3.435  -5.337
   14   HD12  ILE   2          1HD1      ILE   2   3.409  -2.697  -4.783
   15   HD13  ILE   2          2HD1      ILE   2   3.150  -3.007  -6.516
   16    H    GLU   3           H        GLU   3   4.646  -7.292  -6.683
   17    HA   GLU   3           HA       GLU   3   2.410  -8.410  -5.594
   18    HB2  GLU   3           1HB      GLU   3   2.511  -9.988  -7.557
   19    HB3  GLU   3           2HB      GLU   3   2.717  -8.304  -7.993
   20    HG2  GLU   3           1HG      GLU   3   5.221  -8.638  -7.966
   21    HG3  GLU   3           2HG      GLU   3   4.966 -10.338  -7.623
   22    H    ASP   4           H        ASP   4   5.795  -9.421  -5.387
   23    HA   ASP   4           HA       ASP   4   5.230 -12.075  -4.646
   24    HB2  ASP   4           1HB      ASP   4   7.546 -10.386  -5.077
   25    HB3  ASP   4           2HB      ASP   4   7.738 -11.200  -3.537
   26    H    PHE   5           H        PHE   5   4.794  -9.051  -3.121
   27    HA   PHE   5           HA       PHE   5   4.896 -10.316  -0.474
   28    HB2  PHE   5           1HB      PHE   5   5.773  -7.621  -1.582
   29    HB3  PHE   5           2HB      PHE   5   5.175  -7.658   0.065
   30    HD1  PHE   5           2HD      PHE   5   7.867  -8.730  -2.172
   31    HD2  PHE   5           1HD      PHE   5   6.439  -8.747   1.824
   32    HE1  PHE   5           2HE      PHE   5  10.132  -9.449  -1.366
   33    HE2  PHE   5           1HE      PHE   5   8.704  -9.467   2.630
   34    HZ   PHE   5           HZ       PHE   5  10.524  -9.809   1.026
   35    H    TYR   6           H        TYR   6   2.720  -9.926  -2.639
   36    HA   TYR   6           HA       TYR   6   0.955  -7.980  -1.494
   37    HB2  TYR   6           1HB      TYR   6   1.169  -8.775  -3.950
   38    HB3  TYR   6           2HB      TYR   6   0.535 -10.328  -3.446
   39    HD1  TYR   6           1HD      TYR   6  -0.785  -7.253  -1.934
   40    HD2  TYR   6           2HD      TYR   6  -1.328 -10.153  -5.032
   41    HE1  TYR   6           1HE      TYR   6  -3.154  -6.413  -2.315
   42    HE2  TYR   6           2HE      TYR   6  -3.696  -9.304  -5.402
   43    HH   TYR   6           HH       TYR   6  -5.000  -6.671  -3.399
   44    H    THR   7           H        THR   7  -0.268  -8.278   0.294
   45    HA   THR   7           HA       THR   7  -0.867 -11.053   1.060
   46    HB   THR   7           HB       THR   7  -1.053 -10.114   3.338
   47    HG1  THR   7           1HG      THR   7  -1.087  -7.841   3.531
   48   HG21  THR   7          3HG2      THR   7   1.200  -9.534   3.724
   49   HG22  THR   7          1HG2      THR   7   1.336 -10.368   2.157
   50   HG23  THR   7          2HG2      THR   7   1.314  -8.589   2.220
   51    H    SER   8           H        SER   8  -2.629 -11.399  -0.349
   52    HA   SER   8           HA       SER   8  -4.750  -9.554  -0.419
   53    HB2  SER   8           1HB      SER   8  -4.473 -10.972  -2.322
   54    HB3  SER   8           2HB      SER   8  -4.397 -12.423  -1.343
   55    HG   SER   8           HG       SER   8  -6.711 -10.771  -1.873
   56    H    GLU   9           H        GLU   9  -3.655 -11.477   2.068
   57    HA   GLU   9           HA       GLU   9  -6.141 -12.549   2.921
   58    HB2  GLU   9           1HB      GLU   9  -3.432 -12.983   3.524
   59    HB3  GLU   9           2HB      GLU   9  -4.074 -12.285   4.998
   60    HG2  GLU   9           1HG      GLU   9  -6.075 -14.095   4.260
   61    HG3  GLU   9           2HG      GLU   9  -4.610 -14.930   3.781
   62    H    THR  10           H        THR  10  -3.993  -9.807   3.932
   63    HA   THR  10           HA       THR  10  -6.161  -8.828   5.643
   64    HB   THR  10           HB       THR  10  -4.047  -8.978   6.792
   65    HG1  THR  10           1HG      THR  10  -5.154  -6.887   6.958
   66   HG21  THR  10          3HG2      THR  10  -2.964  -8.092   4.146
   67   HG22  THR  10          1HG2      THR  10  -2.201  -7.342   5.568
   68   HG23  THR  10          2HG2      THR  10  -2.206  -9.113   5.392
   69    H    CYS  11           H        CYS  11  -4.561  -8.289   2.573
   70    HA   CYS  11           HA       CYS  11  -5.121  -5.570   2.317
   71    HB2  CYS  11           1HB      CYS  11  -3.549  -6.870   0.903
   72    HB3  CYS  11           2HB      CYS  11  -4.915  -7.657   0.136
   73    HA   PRO  12           HA       PRO  12  -9.443  -5.822   1.735
   74    HB2  PRO  12           1HB      PRO  12  -9.929  -3.278   0.863
   75    HB3  PRO  12           2HB      PRO  12  -9.748  -3.692   2.556
   76    HG2  PRO  12           1HG      PRO  12  -7.834  -2.321   0.769
   77    HG3  PRO  12           2HG      PRO  12  -7.861  -2.367   2.521
   78    HD2  PRO  12           1HD      PRO  12  -6.119  -3.853   0.793
   79    HD3  PRO  12           2HD      PRO  12  -6.227  -3.984   2.537
   80    H    TYR  13           H        TYR  13  -7.213  -5.547  -0.714
   81    HA   TYR  13           HA       TYR  13  -9.353  -5.872  -2.707
   82    HB2  TYR  13           1HB      TYR  13  -6.394  -5.027  -2.900
   83    HB3  TYR  13           2HB      TYR  13  -7.497  -5.078  -4.261
   84    HD1  TYR  13           1HD      TYR  13  -9.480  -3.483  -4.296
   85    HD2  TYR  13           2HD      TYR  13  -6.274  -3.120  -1.486
   86    HE1  TYR  13           1HE      TYR  13 -10.143  -1.071  -3.840
   87    HE2  TYR  13           2HE      TYR  13  -6.948  -0.710  -1.039
   88    HH   TYR  13           HH       TYR  13  -9.731   0.512  -1.586
   89    H    LYS  14           H        LYS  14  -9.122  -7.527  -4.313
   90    HA   LYS  14           HA       LYS  14  -6.979  -9.446  -3.812
   91    HB2  LYS  14           1HB      LYS  14  -8.433 -11.298  -3.627
   92    HB3  LYS  14           2HB      LYS  14  -9.045 -10.093  -2.512
   93    HG2  LYS  14           1HG      LYS  14 -10.112 -10.528  -5.343
   94    HG3  LYS  14           2HG      LYS  14 -10.851 -11.181  -3.895
   95    HD2  LYS  14           1HD      LYS  14 -12.026  -9.248  -3.719
   96    HD3  LYS  14           2HD      LYS  14 -10.525  -8.445  -3.302
   97    HE2  LYS  14           1HE      LYS  14 -11.364  -7.204  -5.159
   98    HE3  LYS  14           2HE      LYS  14 -10.100  -8.207  -5.843
   99    HZ1  LYS  14           3HZ      LYS  14 -11.944  -9.830  -6.321
  100    HZ2  LYS  14           1HZ      LYS  14 -12.992  -8.621  -5.997
  101    HZ3  LYS  14           2HZ      LYS  14 -11.924  -8.469  -7.223
  102    H    ASN  15           H        ASN  15  -7.356  -7.355  -5.831
  103    HA   ASN  15           HA       ASN  15  -8.061  -8.959  -8.142
  104    HB2  ASN  15           1HB      ASN  15  -8.921  -6.502  -7.651
  105    HB3  ASN  15           2HB      ASN  15  -7.333  -6.002  -8.197
  106   HD21  ASN  15          1HD2      ASN  15  -9.357  -5.079  -9.588
  107   HD22  ASN  15          2HD2      ASN  15  -9.542  -5.855 -11.126
  108    H    ASP  16           H        ASP  16  -5.550  -6.621  -6.908
  109    HA   ASP  16           HA       ASP  16  -3.476  -8.256  -7.900
  110    HB2  ASP  16           1HB      ASP  16  -4.460  -6.673  -9.858
  111    HB3  ASP  16           2HB      ASP  16  -3.425  -5.486  -9.089
  112    H    SER  17           H        SER  17  -1.270  -7.114  -7.399
  113    HA   SER  17           HA       SER  17  -1.546  -5.833  -4.885
  114    HB2  SER  17           1HB      SER  17   0.977  -5.849  -4.934
  115    HB3  SER  17           2HB      SER  17   0.250  -7.427  -5.170
  116    HG   SER  17           HG       SER  17   1.519  -5.719  -7.104
  117    H    GLN  18           H        GLN  18  -1.022  -4.882  -8.247
  118    HA   GLN  18           HA       GLN  18   0.114  -2.371  -7.638
  119    HB2  GLN  18           1HB      GLN  18  -1.113  -3.587 -10.137
  120    HB3  GLN  18           2HB      GLN  18  -0.564  -1.923 -10.111
  121    HG2  GLN  18           1HG      GLN  18   1.715  -2.657  -9.446
  122    HG3  GLN  18           2HG      GLN  18   1.180  -4.325  -9.383
  123   HE21  GLN  18          1HE2      GLN  18   0.986  -5.511 -11.197
  124   HE22  GLN  18          2HE2      GLN  18   1.397  -4.971 -12.791
  125    H    LEU  19           H        LEU  19  -3.163  -3.689  -7.917
  126    HA   LEU  19           HA       LEU  19  -4.502  -1.257  -8.339
  127    HB2  LEU  19           1HB      LEU  19  -5.607  -3.268  -8.852
  128    HB3  LEU  19           2HB      LEU  19  -5.304  -3.949  -7.266
  129    HG   LEU  19           HG       LEU  19  -6.785  -1.893  -6.465
  130   HD11  LEU  19          1HD1      LEU  19  -8.168  -2.398  -9.075
  131   HD12  LEU  19          2HD1      LEU  19  -8.310  -1.026  -7.951
  132   HD13  LEU  19          3HD1      LEU  19  -6.872  -1.182  -8.987
  133   HD21  LEU  19          3HD2      LEU  19  -8.220  -3.497  -5.889
  134   HD22  LEU  19          1HD2      LEU  19  -8.574  -3.909  -7.584
  135   HD23  LEU  19          2HD2      LEU  19  -7.157  -4.619  -6.773
  136    H    ALA  20           H        ALA  20  -4.250  -3.226  -5.289
  137    HA   ALA  20           HA       ALA  20  -5.218  -1.242  -3.627
  138    HB1  ALA  20           3HB      ALA  20  -4.877  -3.711  -3.148
  139    HB2  ALA  20           1HB      ALA  20  -3.150  -3.353  -2.912
  140    HB3  ALA  20           2HB      ALA  20  -4.366  -2.614  -1.843
  141    H    TRP  21           H        TRP  21  -1.952  -1.819  -4.965
  142    HA   TRP  21           HA       TRP  21  -0.642   0.008  -3.246
  143    HB2  TRP  21           1HB      TRP  21   0.712  -1.617  -4.215
  144    HB3  TRP  21           2HB      TRP  21   0.044  -1.377  -5.817
  145    HD1  TRP  21           HD       TRP  21   1.029   0.749  -7.240
  146    HE1  TRP  21           1HE      TRP  21   3.234   2.192  -7.100
  147    HE3  TRP  21           3HE      TRP  21   2.297  -0.689  -2.530
  148    HZ2  TRP  21           2HZ      TRP  21   5.216   2.561  -5.082
  149    HZ3  TRP  21           3HZ      TRP  21   4.383   0.260  -1.549
  150    HH2  TRP  21           HH       TRP  21   5.822   1.832  -2.745
  151    H    ASP  22           H        ASP  22  -2.322   0.166  -6.418
  152    HA   ASP  22           HA       ASP  22  -1.474   2.761  -7.011
  153    HB2  ASP  22           1HB      ASP  22  -2.384   1.189  -8.702
  154    HB3  ASP  22           2HB      ASP  22  -3.941   1.193  -7.898
  155    H    THR  23           H        THR  23  -3.609   1.470  -4.650
  156    HA   THR  23           HA       THR  23  -5.417   3.748  -4.637
  157    HB   THR  23           HB       THR  23  -5.225   1.019  -3.358
  158    HG1  THR  23           1HG      THR  23  -6.625   1.254  -5.136
  159   HG21  THR  23          3HG2      THR  23  -7.170   3.151  -2.369
  160   HG22  THR  23          1HG2      THR  23  -6.894   1.524  -1.702
  161   HG23  THR  23          2HG2      THR  23  -5.663   2.793  -1.493
  162    H    CYS  24           H        CYS  24  -3.419   2.131  -2.074
  163    HA   CYS  24           HA       CYS  24  -3.382   4.528  -0.569
  164    HB2  CYS  24           1HB      CYS  24  -3.199   2.820   0.879
  165    HB3  CYS  24           2HB      CYS  24  -2.405   1.768  -0.276
  166    H    SER  25           H        SER  25  -0.814   2.576  -2.271
  167    HA   SER  25           HA       SER  25   1.016   4.731  -2.069
  168    HB2  SER  25           1HB      SER  25   2.003   2.915  -3.983
  169    HB3  SER  25           2HB      SER  25   2.408   2.965  -2.279
  170    HG   SER  25           HG       SER  25   1.037   1.311  -1.839
  171    H    GLY  26           H        GLY  26  -1.074   5.947  -3.233
  172    HA2  GLY  26           1HA      GLY  26  -0.265   6.195  -6.063
  173    HA3  GLY  26           2HA      GLY  26  -1.953   6.073  -5.608
  174    H    GLY  27           H        GLY  27  -2.941   8.039  -5.690
  175    HA2  GLY  27           1HA      GLY  27  -1.355  10.409  -4.938
  176    HA3  GLY  27           2HA      GLY  27  -2.755  10.388  -5.992
  177    H    THR  28           H        THR  28  -4.728   9.051  -4.704
  178    HA   THR  28           HA       THR  28  -4.874  10.232  -2.017
  179    HB   THR  28           HB       THR  28  -7.165  11.009  -2.561
  180    HG1  THR  28           1HG      THR  28  -7.949   9.711  -4.196
  181   HG21  THR  28          3HG2      THR  28  -5.745  12.791  -3.200
  182   HG22  THR  28          1HG2      THR  28  -4.917  11.812  -4.435
  183   HG23  THR  28          2HG2      THR  28  -6.561  12.424  -4.739
  184    H    GLY  29           H        GLY  29  -7.698   9.314  -1.810
  185    HA2  GLY  29           1HA      GLY  29  -8.881   7.327  -1.646
  186    HA3  GLY  29           2HA      GLY  29  -7.434   6.410  -2.016
  187    H    ASN  30           H        ASN  30  -6.365   5.420  -0.347
  188    HA   ASN  30           HA       ASN  30  -6.880   6.511   2.306
  189    HB2  ASN  30           1HB      ASN  30  -6.500   3.916   2.933
  190    HB3  ASN  30           2HB      ASN  30  -8.088   4.520   2.505
  191   HD21  ASN  30          1HD2      ASN  30  -5.804   2.208   1.908
  192   HD22  ASN  30          2HD2      ASN  30  -6.315   1.632   0.356
  193    H    CYS  31           H        CYS  31  -4.662   7.364   0.880
  194    HA   CYS  31           HA       CYS  31  -2.452   5.635   1.064
  195    HB2  CYS  31           1HB      CYS  31  -1.179   7.386   0.252
  196    HB3  CYS  31           2HB      CYS  31  -2.764   7.673  -0.440
  197    H    GLY  32           H        GLY  32  -1.233   5.126   2.860
  198    HA2  GLY  32           1HA      GLY  32  -0.738   6.998   4.953
  199    HA3  GLY  32           2HA      GLY  32  -1.941   5.818   5.432
  200    H    THR  33           H        THR  33   0.248   5.673   6.934
  201    HA   THR  33           HA       THR  33   2.186   3.877   5.735
  202    HB   THR  33           HB       THR  33   1.920   5.017   8.567
  203    HG1  THR  33           1HG      THR  33   2.276   6.761   7.173
  204   HG21  THR  33          3HG2      THR  33   4.521   4.338   7.194
  205   HG22  THR  33          1HG2      THR  33   4.130   4.330   8.930
  206   HG23  THR  33          2HG2      THR  33   3.581   2.995   7.889
  207    H    VAL  34           H        VAL  34  -0.911   3.517   6.915
  208    HA   VAL  34           HA       VAL  34  -0.424   1.141   8.460
  209    HB   VAL  34           HB       VAL  34  -2.960   2.413   7.410
  210   HG11  VAL  34          1HG1      VAL  34  -2.847  -0.147   8.096
  211   HG12  VAL  34          2HG1      VAL  34  -2.917   0.531   9.741
  212   HG13  VAL  34          3HG1      VAL  34  -4.217   0.883   8.577
  213   HG21  VAL  34          3HG2      VAL  34  -1.999   3.954   8.914
  214   HG22  VAL  34          1HG2      VAL  34  -3.187   3.051   9.884
  215   HG23  VAL  34          2HG2      VAL  34  -1.453   2.671  10.019
  216    H    CYS  35           H        CYS  35  -1.333   2.059   5.125
  217    HA   CYS  35           HA       CYS  35  -2.181  -0.467   4.311
  218    HB2  CYS  35           1HB      CYS  35  -2.633   0.621   2.444
  219    HB3  CYS  35           2HB      CYS  35  -1.953   2.060   3.177
  220    H    CYS  36           H        CYS  36   0.875   0.705   5.343
  221    HA   CYS  36           HA       CYS  36   2.659  -0.501   3.652
  222    HB2  CYS  36           1HB      CYS  36   2.858  -0.156   6.651
  223    HB3  CYS  36           2HB      CYS  36   4.198  -0.547   5.591
  224    H    GLY  37           H        GLY  37   1.985  -1.849   6.949
  225    HA2  GLY  37           1HA      GLY  37   2.407  -4.538   5.935
  226    HA3  GLY  37           2HA      GLY  37   2.222  -4.036   7.604
  227    H    GLN  38           H        GLN  38   0.075  -3.331   4.773
  228    HA   GLN  38           HA       GLN  38  -1.974  -4.876   6.161
  229    HB2  GLN  38           1HB      GLN  38  -2.189  -2.285   6.201
  230    HB3  GLN  38           2HB      GLN  38  -2.563  -2.405   4.493
  231    HG2  GLN  38           1HG      GLN  38  -4.705  -2.508   5.444
  232    HG3  GLN  38           2HG      GLN  38  -4.334  -4.209   5.246
  233   HE21  GLN  38          1HE2      GLN  38  -6.162  -3.008   7.088
  234   HE22  GLN  38          2HE2      GLN  38  -5.659  -3.403   8.698
  235    H    CYS  39           H        CYS  39  -0.783  -3.548   3.015
  236    HA   CYS  39           HA       CYS  39  -2.234  -5.723   1.698
  237    HB2  CYS  39           1HB      CYS  39  -2.448  -3.090   1.155
  238    HB3  CYS  39           2HB      CYS  39  -1.112  -3.492   0.094
  239    H    PHE  40           H        PHE  40   0.868  -4.197   2.446
  240    HA   PHE  40           HA       PHE  40   2.193  -6.394   1.042
  241    HB2  PHE  40           1HB      PHE  40   3.410  -3.613   1.230
  242    HB3  PHE  40           2HB      PHE  40   3.700  -4.840   0.012
  243    HD1  PHE  40           2HD      PHE  40   1.376  -2.213   1.117
  244    HD2  PHE  40           1HD      PHE  40   2.326  -4.991  -1.947
  245    HE1  PHE  40           2HE      PHE  40  -0.238  -1.064  -0.424
  246    HE2  PHE  40           1HE      PHE  40   0.712  -3.843  -3.488
  247    HZ   PHE  40           HZ       PHE  40  -0.551  -1.893  -2.709
  248    H    SER  41           H        SER  41   4.767  -6.099   1.729
  249    HA   SER  41           HA       SER  41   4.824  -5.465   4.552
  250    HB2  SER  41           1HB      SER  41   5.258  -8.178   3.326
  251    HB3  SER  41           2HB      SER  41   6.298  -7.719   4.660
  252    HG   SER  41           HG       SER  41   4.451  -7.397   5.993
  253    H    PHE  42           H        PHE  42   7.103  -5.241   5.373
  254    HA   PHE  42           HA       PHE  42   8.665  -3.744   3.681
  255    HB2  PHE  42           1HB      PHE  42   8.622  -4.758   6.366
  256    HB3  PHE  42           2HB      PHE  42  10.174  -5.258   5.725
  257    HD1  PHE  42           2HD      PHE  42   8.013  -2.250   6.102
  258    HD2  PHE  42           1HD      PHE  42  11.959  -3.764   5.717
  259    HE1  PHE  42           2HE      PHE  42   8.937   0.041   6.551
  260    HE2  PHE  42           1HE      PHE  42  12.882  -1.474   6.166
  261    HZ   PHE  42           HZ       PHE  42  11.360   0.401   6.577
  262    HA   PRO  43           HA       PRO  43  10.769  -3.348   3.722
  263    HB2  PRO  43           1HB      PRO  43  12.389  -2.637   1.639
  264    HB3  PRO  43           2HB      PRO  43  12.991  -3.358   3.118
  265    HG2  PRO  43           1HG      PRO  43  12.652  -4.597   0.456
  266    HG3  PRO  43           2HG      PRO  43  13.624  -5.146   1.807
  267    HD2  PRO  43           1HD      PRO  43  11.091  -6.203   0.973
  268    HD3  PRO  43           2HD      PRO  43  12.008  -6.673   2.391
  269    H    VAL  44           H        VAL  44   8.749  -4.612   1.636
  270    HA   VAL  44           HA       VAL  44   8.295  -2.403  -0.086
  271    HB   VAL  44           HB       VAL  44   6.239  -4.472   0.607
  272   HG11  VAL  44          1HG1      VAL  44   7.055  -2.954  -1.880
  273   HG12  VAL  44          2HG1      VAL  44   5.987  -4.377  -1.939
  274   HG13  VAL  44          3HG1      VAL  44   5.495  -2.932  -1.024
  275   HG21  VAL  44          3HG2      VAL  44   7.706  -6.131   0.262
  276   HG22  VAL  44          1HG2      VAL  44   7.722  -5.617  -1.442
  277   HG23  VAL  44          2HG2      VAL  44   8.962  -5.011  -0.318
  278    H    SER  45           H        SER  45   7.057  -3.488   3.100
  279    HA   SER  45           HA       SER  45   4.875  -1.883   3.286
  280    HB2  SER  45           1HB      SER  45   4.938  -3.158   5.168
  281    HB3  SER  45           2HB      SER  45   6.685  -3.280   5.136
  282    HG   SER  45           HG       SER  45   6.137  -2.127   7.003
  283    H    GLN  46           H        GLN  46   8.219  -0.986   3.050
  284    HA   GLN  46           HA       GLN  46   7.817   1.533   4.373
  285    HB2  GLN  46           1HB      GLN  46  10.001  -0.046   4.193
  286    HB3  GLN  46           2HB      GLN  46  10.298   0.948   2.781
  287    HG2  GLN  46           1HG      GLN  46   9.726   2.956   4.446
  288    HG3  GLN  46           2HG      GLN  46  10.127   1.783   5.684
  289   HE21  GLN  46          1HE2      GLN  46  11.327   4.217   3.929
  290   HE22  GLN  46          2HE2      GLN  46  13.009   3.813   3.848
  291    H    SER  47           H        SER  47   7.642   0.123   1.170
  292    HA   SER  47           HA       SER  47   8.110   2.547  -0.211
  293    HB2  SER  47           1HB      SER  47   6.557   0.262  -1.421
  294    HB3  SER  47           2HB      SER  47   7.756   1.299  -2.168
  295    HG   SER  47           HG       SER  47   9.424   0.196  -1.072
  296    H    CYS  48           H        CYS  48   5.267   0.723   1.009
  297    HA   CYS  48           HA       CYS  48   3.265   2.013  -0.331
  298    HB2  CYS  48           1HB      CYS  48   2.594   0.192   0.913
  299    HB3  CYS  48           2HB      CYS  48   3.464   0.699   2.347
  300    H    ALA  49           H        ALA  49   4.428   2.781   3.041
  301    HA   ALA  49           HA       ALA  49   3.116   5.212   3.232
  302    HB1  ALA  49           3HB      ALA  49   3.874   4.769   5.305
  303    HB2  ALA  49           1HB      ALA  49   5.125   3.667   4.682
  304    HB3  ALA  49           2HB      ALA  49   5.448   5.414   4.780
  305    H    GLY  50           H        GLY  50   5.854   4.267   1.313
  306    HA2  GLY  50           1HA      GLY  50   7.047   6.891   1.169
  307    HA3  GLY  50           2HA      GLY  50   7.474   5.463   0.248
  308    H    MET  51           H        MET  51   5.348   4.695  -1.191
  309    HA   MET  51           HA       MET  51   4.986   6.945  -2.931
  310    HB2  MET  51           1HB      MET  51   5.582   4.563  -3.683
  311    HB3  MET  51           2HB      MET  51   3.981   4.057  -3.183
  312    HG2  MET  51           1HG      MET  51   3.286   4.610  -5.281
  313    HG3  MET  51           2HG      MET  51   3.439   6.285  -4.788
  314    HE1  MET  51           3HE      MET  51   4.720   7.046  -7.854
  315    HE2  MET  51           1HE      MET  51   3.919   7.487  -6.327
  316    HE3  MET  51           2HE      MET  51   5.636   7.883  -6.578
  317    H    ALA  52           H        ALA  52   3.577   6.644  -0.197
  318    HA   ALA  52           HA       ALA  52   0.809   6.354  -0.985
  319    HB1  ALA  52           3HB      ALA  52   2.404   6.274   1.463
  320    HB2  ALA  52           1HB      ALA  52   0.953   7.287   1.655
  321    HB3  ALA  52           2HB      ALA  52   0.792   5.593   1.135
  322    H    ASP  53           H        ASP  53   2.816   8.599  -1.889
  323    HA   ASP  53           HA       ASP  53   2.689  10.699  -2.407
  324    HB2  ASP  53           1HB      ASP  53  -0.091   9.880  -2.164
  325    HB3  ASP  53           2HB      ASP  53   0.060  11.540  -1.624
  326    H    SER  54           H        SER  54   3.180  12.699  -1.333
  327    HA   SER  54           HA       SER  54   2.679  12.630   1.535
  328    HB2  SER  54           1HB      SER  54   5.034  13.229  -0.070
  329    HB3  SER  54           2HB      SER  54   4.634  14.611   0.931
  330    HG   SER  54           HG       SER  54   5.704  13.500   2.433
  331    H    ASN  55           H        ASN  55   3.655  15.357  -0.630
  332    HA   ASN  55           HA       ASN  55   1.622  16.957   0.567
  333    HB2  ASN  55           1HB      ASN  55   4.130  17.488  -0.477
  334    HB3  ASN  55           2HB      ASN  55   3.115  17.997  -1.812
  335   HD21  ASN  55          1HD2      ASN  55   4.439  19.956  -0.870
  336   HD22  ASN  55          2HD2      ASN  55   3.550  21.002   0.187
  337    H    ASP  56           H        ASP  56   1.792  14.721  -1.982
  338    HA   ASP  56           HA       ASP  56   0.060  16.201  -3.742
  339    HB2  ASP  56           1HB      ASP  56   1.380  13.459  -3.864
  340    HB3  ASP  56           2HB      ASP  56   0.192  13.953  -5.054
  341    H    CYS  57           H        CYS  57  -0.074  14.070  -1.029
  342    HA   CYS  57           HA       CYS  57  -2.495  12.739  -1.809
  343    HB2  CYS  57           1HB      CYS  57  -0.451  12.339   0.128
  344    HB3  CYS  57           2HB      CYS  57  -1.963  12.518   0.995
  345    HA   PRO  58           HA       PRO  58  -5.187  15.621   0.042
  346    HB2  PRO  58           1HB      PRO  58  -7.176  14.084   1.114
  347    HB3  PRO  58           2HB      PRO  58  -7.068  14.455  -0.595
  348    HG2  PRO  58           1HG      PRO  58  -6.432  11.925   0.796
  349    HG3  PRO  58           2HG      PRO  58  -6.739  12.194  -0.909
  350    HD2  PRO  58           1HD      PRO  58  -4.185  11.784   0.331
  351    HD3  PRO  58           2HD      PRO  58  -4.484  12.167  -1.353
  352    H    ASN  59           H        ASN  59  -3.036  15.673   1.527
  353    HA   ASN  59           HA       ASN  59  -3.984  15.168   4.218
  354    HB2  ASN  59           1HB      ASN  59  -1.235  15.726   3.016
  355    HB3  ASN  59           2HB      ASN  59  -1.494  15.802   4.747
  356   HD21  ASN  59          1HD2      ASN  59  -0.099  14.088   5.098
  357   HD22  ASN  59          2HD2      ASN  59  -0.523  12.439   4.775
  358    H    ALA  60           H        ALA  60  -3.087  16.984   5.859
  359    HA   ALA  60           HA       ALA  60  -3.575  19.051   6.572
  360    HB1  ALA  60           3HB      ALA  60  -1.233  18.950   5.165
  361    HB2  ALA  60           1HB      ALA  60  -2.068  20.281   4.329
  362    HB3  ALA  60           2HB      ALA  60  -1.785  20.370   6.084
  Start of MODEL   20
    1    H1   ASP   1           H        ASP   1   7.120  -7.156  -7.455
    2    HA   ASP   1           HA       ASP   1   9.332  -8.100  -6.223
    3    HB2  ASP   1           1HB      ASP   1   9.628  -5.285  -6.989
    4    HB3  ASP   1           2HB      ASP   1   9.694  -5.457  -5.246
    5    H    ILE   2           H        ILE   2   6.665  -5.707  -6.273
    6    HA   ILE   2           HA       ILE   2   6.263  -5.804  -3.436
    7    HB   ILE   2           HB       ILE   2   4.785  -4.121  -3.741
    8   HG12  ILE   2          1HG1      ILE   2   4.039  -5.167  -6.488
    9   HG13  ILE   2          2HG1      ILE   2   3.172  -5.537  -5.010
   10   HG21  ILE   2          1HG2      ILE   2   6.079  -3.823  -6.445
   11   HG22  ILE   2          2HG2      ILE   2   5.662  -2.573  -5.249
   12   HG23  ILE   2          3HG2      ILE   2   7.020  -3.681  -4.941
   13   HD11  ILE   2          3HD1      ILE   2   2.028  -3.592  -5.161
   14   HD12  ILE   2          1HD1      ILE   2   3.552  -2.672  -5.147
   15   HD13  ILE   2          2HD1      ILE   2   2.871  -3.243  -6.689
   16    H    GLU   3           H        GLU   3   4.762  -7.219  -6.394
   17    HA   GLU   3           HA       GLU   3   2.594  -8.360  -5.209
   18    HB2  GLU   3           1HB      GLU   3   2.768 -10.065  -7.103
   19    HB3  GLU   3           2HB      GLU   3   2.768  -8.383  -7.595
   20    HG2  GLU   3           1HG      GLU   3   4.735  -8.728  -8.663
   21    HG3  GLU   3           2HG      GLU   3   5.498  -9.014  -7.112
   22    H    ASP   4           H        ASP   4   5.993  -9.184  -4.908
   23    HA   ASP   4           HA       ASP   4   5.569 -11.858  -4.131
   24    HB2  ASP   4           1HB      ASP   4   7.788 -10.063  -4.576
   25    HB3  ASP   4           2HB      ASP   4   7.992 -10.777  -2.989
   26    H    PHE   5           H        PHE   5   4.668  -8.967  -2.717
   27    HA   PHE   5           HA       PHE   5   4.815 -10.134  -0.039
   28    HB2  PHE   5           1HB      PHE   5   5.676  -7.419  -1.121
   29    HB3  PHE   5           2HB      PHE   5   5.026  -7.480   0.506
   30    HD1  PHE   5           2HD      PHE   5   6.214  -8.740   2.269
   31    HD2  PHE   5           1HD      PHE   5   7.859  -8.282  -1.616
   32    HE1  PHE   5           2HE      PHE   5   8.469  -9.408   3.145
   33    HE2  PHE   5           1HE      PHE   5  10.114  -8.951  -0.739
   34    HZ   PHE   5           HZ       PHE   5  10.392  -9.506   1.631
   35    H    TYR   6           H        TYR   6   2.736  -9.811  -2.303
   36    HA   TYR   6           HA       TYR   6   0.884  -7.884  -1.274
   37    HB2  TYR   6           1HB      TYR   6   1.214  -8.713  -3.701
   38    HB3  TYR   6           2HB      TYR   6   0.608 -10.278  -3.197
   39    HD1  TYR   6           2HD      TYR   6  -0.915  -7.308  -1.713
   40    HD2  TYR   6           1HD      TYR   6  -1.146 -10.103  -4.945
   41    HE1  TYR   6           2HE      TYR   6  -3.291  -6.551  -2.208
   42    HE2  TYR   6           1HE      TYR   6  -3.522  -9.336  -5.428
   43    HH   TYR   6           HH       TYR   6  -5.403  -7.967  -3.479
   44    H    THR   7           H        THR   7  -0.378  -8.175   0.489
   45    HA   THR   7           HA       THR   7  -0.983 -10.946   1.263
   46    HB   THR   7           HB       THR   7  -1.048 -10.116   3.509
   47    HG1  THR   7           1HG      THR   7  -1.009  -7.459   2.274
   48   HG21  THR   7          3HG2      THR   7   1.287  -9.817   2.301
   49   HG22  THR   7          1HG2      THR   7   0.884  -8.084   2.330
   50   HG23  THR   7          2HG2      THR   7   1.021  -8.992   3.855
   51    H    SER   8           H        SER   8  -2.718 -11.381  -0.116
   52    HA   SER   8           HA       SER   8  -4.844  -9.532  -0.305
   53    HB2  SER   8           1HB      SER   8  -4.587 -10.927  -2.192
   54    HB3  SER   8           2HB      SER   8  -4.361 -12.370  -1.225
   55    HG   SER   8           HG       SER   8  -6.761 -11.065  -2.005
   56    H    GLU   9           H        GLU   9  -3.805 -11.349   2.260
   57    HA   GLU   9           HA       GLU   9  -6.282 -12.483   3.053
   58    HB2  GLU   9           1HB      GLU   9  -3.593 -12.817   3.763
   59    HB3  GLU   9           2HB      GLU   9  -4.292 -12.070   5.187
   60    HG2  GLU   9           1HG      GLU   9  -6.243 -13.918   4.598
   61    HG3  GLU   9           2HG      GLU   9  -4.828 -14.759   3.997
   62    H    THR  10           H        THR  10  -4.279  -9.628   4.040
   63    HA   THR  10           HA       THR  10  -6.550  -8.674   5.632
   64    HB   THR  10           HB       THR  10  -4.508  -8.709   6.897
   65    HG1  THR  10           1HG      THR  10  -5.385  -6.640   7.173
   66   HG21  THR  10          3HG2      THR  10  -2.638  -8.935   5.508
   67   HG22  THR  10          1HG2      THR  10  -3.292  -7.820   4.284
   68   HG23  THR  10          2HG2      THR  10  -2.573  -7.177   5.780
   69    H    CYS  11           H        CYS  11  -4.807  -8.166   2.631
   70    HA   CYS  11           HA       CYS  11  -5.458  -5.476   2.272
   71    HB2  CYS  11           1HB      CYS  11  -3.747  -6.731   0.991
   72    HB3  CYS  11           2HB      CYS  11  -5.023  -7.607   0.169
   73    HA   PRO  12           HA       PRO  12  -9.722  -5.932   1.436
   74    HB2  PRO  12           1HB      PRO  12 -10.261  -3.433   0.470
   75    HB3  PRO  12           2HB      PRO  12 -10.168  -3.800   2.181
   76    HG2  PRO  12           1HG      PRO  12  -8.207  -2.388   0.479
   77    HG3  PRO  12           2HG      PRO  12  -8.341  -2.393   2.226
   78    HD2  PRO  12           1HD      PRO  12  -6.433  -3.840   0.647
   79    HD3  PRO  12           2HD      PRO  12  -6.643  -3.935   2.384
   80    H    TYR  13           H        TYR  13  -7.360  -5.814  -0.831
   81    HA   TYR  13           HA       TYR  13  -9.354  -6.189  -2.964
   82    HB2  TYR  13           1HB      TYR  13  -6.407  -5.280  -2.978
   83    HB3  TYR  13           2HB      TYR  13  -7.396  -5.426  -4.417
   84    HD1  TYR  13           1HD      TYR  13  -9.351  -3.867  -4.745
   85    HD2  TYR  13           2HD      TYR  13  -6.508  -3.333  -1.592
   86    HE1  TYR  13           1HE      TYR  13 -10.111  -1.458  -4.458
   87    HE2  TYR  13           2HE      TYR  13  -7.277  -0.926  -1.316
   88    HH   TYR  13           HH       TYR  13  -9.897   0.226  -2.086
   89    H    LYS  14           H        LYS  14  -8.910  -7.855  -4.551
   90    HA   LYS  14           HA       LYS  14  -6.761  -9.691  -3.893
   91    HB2  LYS  14           1HB      LYS  14  -8.131 -11.595  -3.589
   92    HB3  LYS  14           2HB      LYS  14  -8.773 -10.358  -2.526
   93    HG2  LYS  14           1HG      LYS  14  -9.872 -10.983  -5.308
   94    HG3  LYS  14           2HG      LYS  14 -10.555 -11.594  -3.815
   95    HD2  LYS  14           1HD      LYS  14 -11.819  -9.710  -3.736
   96    HD3  LYS  14           2HD      LYS  14 -10.354  -8.834  -3.342
   97    HE2  LYS  14           1HE      LYS  14 -11.136  -7.668  -5.237
   98    HE3  LYS  14           2HE      LYS  14  -9.949  -8.751  -5.935
   99    HZ1  LYS  14           3HZ      LYS  14 -12.525  -8.583  -6.669
  100    HZ2  LYS  14           1HZ      LYS  14 -11.529  -9.828  -7.023
  101    HZ3  LYS  14           2HZ      LYS  14 -12.530  -9.924  -5.737
  102    H    ASN  15           H        ASN  15  -7.288  -7.734  -6.026
  103    HA   ASN  15           HA       ASN  15  -7.852  -9.551  -8.225
  104    HB2  ASN  15           1HB      ASN  15  -8.838  -7.012  -7.737
  105    HB3  ASN  15           2HB      ASN  15  -7.470  -6.628  -8.763
  106   HD21  ASN  15          1HD2      ASN  15  -9.813  -5.995  -9.741
  107   HD22  ASN  15          2HD2      ASN  15 -10.348  -7.064 -10.995
  108    H    ASP  16           H        ASP  16  -5.626  -6.935  -7.037
  109    HA   ASP  16           HA       ASP  16  -3.399  -8.302  -8.104
  110    HB2  ASP  16           1HB      ASP  16  -4.680  -6.504  -9.858
  111    HB3  ASP  16           2HB      ASP  16  -3.355  -5.566  -9.199
  112    H    SER  17           H        SER  17  -1.377  -7.303  -7.272
  113    HA   SER  17           HA       SER  17  -1.785  -5.967  -4.851
  114    HB2  SER  17           1HB      SER  17   0.107  -7.405  -4.986
  115    HB3  SER  17           2HB      SER  17   0.656  -6.698  -6.492
  116    HG   SER  17           HG       SER  17   1.109  -5.871  -3.853
  117    H    GLN  18           H        GLN  18  -0.917  -4.958  -8.171
  118    HA   GLN  18           HA       GLN  18  -0.021  -2.411  -7.500
  119    HB2  GLN  18           1HB      GLN  18  -0.134  -3.924  -9.798
  120    HB3  GLN  18           2HB      GLN  18  -1.378  -2.736 -10.130
  121    HG2  GLN  18           1HG      GLN  18   0.246  -0.898  -9.599
  122    HG3  GLN  18           2HG      GLN  18   1.489  -2.094  -9.290
  123   HE21  GLN  18          1HE2      GLN  18   0.594   0.068 -11.439
  124   HE22  GLN  18          2HE2      GLN  18   1.058  -0.661 -12.941
  125    H    LEU  19           H        LEU  19  -3.261  -3.801  -8.085
  126    HA   LEU  19           HA       LEU  19  -4.665  -1.438  -8.453
  127    HB2  LEU  19           1HB      LEU  19  -5.664  -3.516  -8.969
  128    HB3  LEU  19           2HB      LEU  19  -5.414  -4.136  -7.349
  129    HG   LEU  19           HG       LEU  19  -7.010  -2.251  -6.583
  130   HD11  LEU  19          1HD1      LEU  19  -8.260  -2.384  -9.275
  131   HD12  LEU  19          2HD1      LEU  19  -8.259  -1.079  -8.065
  132   HD13  LEU  19          3HD1      LEU  19  -6.831  -1.337  -9.096
  133   HD21  LEU  19          3HD2      LEU  19  -8.988  -3.767  -7.645
  134   HD22  LEU  19          1HD2      LEU  19  -7.596  -4.857  -7.850
  135   HD23  LEU  19          2HD2      LEU  19  -8.010  -4.237  -6.234
  136    H    ALA  20           H        ALA  20  -4.337  -3.363  -5.381
  137    HA   ALA  20           HA       ALA  20  -5.455  -1.430  -3.748
  138    HB1  ALA  20           3HB      ALA  20  -3.247  -3.336  -2.918
  139    HB2  ALA  20           1HB      ALA  20  -4.632  -2.758  -1.960
  140    HB3  ALA  20           2HB      ALA  20  -4.891  -3.902  -3.299
  141    H    TRP  21           H        TRP  21  -2.113  -1.854  -4.980
  142    HA   TRP  21           HA       TRP  21  -0.920   0.040  -3.287
  143    HB2  TRP  21           1HB      TRP  21   0.521  -1.459  -4.323
  144    HB3  TRP  21           2HB      TRP  21  -0.196  -1.230  -5.905
  145    HD1  TRP  21           HD       TRP  21   0.478   1.165  -7.185
  146    HE1  TRP  21           1HE      TRP  21   2.634   2.684  -7.099
  147    HE3  TRP  21           3HE      TRP  21   2.264  -0.709  -2.808
  148    HZ2  TRP  21           2HZ      TRP  21   4.796   2.926  -5.252
  149    HZ3  TRP  21           3HZ      TRP  21   4.404   0.224  -1.933
  150    HH2  TRP  21           HH       TRP  21   5.660   1.979  -3.080
  151    H    ASP  22           H        ASP  22  -2.630   0.189  -6.448
  152    HA   ASP  22           HA       ASP  22  -1.964   2.841  -6.976
  153    HB2  ASP  22           1HB      ASP  22  -3.281   0.797  -8.303
  154    HB3  ASP  22           2HB      ASP  22  -4.617   1.867  -7.926
  155    H    THR  23           H        THR  23  -3.977   1.367  -4.609
  156    HA   THR  23           HA       THR  23  -5.885   3.561  -4.481
  157    HB   THR  23           HB       THR  23  -5.668   0.751  -3.585
  158    HG1  THR  23           1HG      THR  23  -7.330   1.578  -4.987
  159   HG21  THR  23          3HG2      THR  23  -5.637   1.481  -1.308
  160   HG22  THR  23          1HG2      THR  23  -6.593   2.936  -1.675
  161   HG23  THR  23          2HG2      THR  23  -7.373   1.337  -1.672
  162    H    CYS  24           H        CYS  24  -3.294   2.075  -2.435
  163    HA   CYS  24           HA       CYS  24  -3.503   4.308  -0.628
  164    HB2  CYS  24           1HB      CYS  24  -3.060   2.508   0.654
  165    HB3  CYS  24           2HB      CYS  24  -2.218   1.652  -0.622
  166    H    SER  25           H        SER  25  -0.665   2.696  -2.242
  167    HA   SER  25           HA       SER  25   0.693   5.194  -2.297
  168    HB2  SER  25           1HB      SER  25   2.136   3.346  -3.869
  169    HB3  SER  25           2HB      SER  25   2.430   3.756  -2.191
  170    HG   SER  25           HG       SER  25   0.691   1.653  -3.168
  171    H    GLY  26           H        GLY  26  -1.551   5.712  -3.709
  172    HA2  GLY  26           1HA      GLY  26  -0.676   5.603  -6.534
  173    HA3  GLY  26           2HA      GLY  26  -2.344   5.390  -6.042
  174    H    GLY  27           H        GLY  27  -0.839   7.573  -3.896
  175    HA2  GLY  27           1HA      GLY  27  -0.488   9.879  -4.060
  176    HA3  GLY  27           2HA      GLY  27  -1.387   9.925  -5.563
  177    H    THR  28           H        THR  28  -3.610   8.187  -4.527
  178    HA   THR  28           HA       THR  28  -4.755   9.975  -2.498
  179    HB   THR  28           HB       THR  28  -6.830  10.093  -3.833
  180    HG1  THR  28           1HG      THR  28  -7.017   8.443  -5.292
  181   HG21  THR  28          3HG2      THR  28  -5.410  11.862  -4.597
  182   HG22  THR  28          1HG2      THR  28  -4.254  10.726  -5.334
  183   HG23  THR  28          2HG2      THR  28  -5.842  10.997  -6.092
  184    H    GLY  29           H        GLY  29  -7.360   8.488  -2.879
  185    HA2  GLY  29           1HA      GLY  29  -8.374   6.622  -2.123
  186    HA3  GLY  29           2HA      GLY  29  -6.871   5.743  -2.331
  187    H    ASN  30           H        ASN  30  -6.681   4.643  -0.388
  188    HA   ASN  30           HA       ASN  30  -6.993   6.234   2.018
  189    HB2  ASN  30           1HB      ASN  30  -6.882   3.920   3.145
  190    HB3  ASN  30           2HB      ASN  30  -8.273   4.184   2.113
  191   HD21  ASN  30          1HD2      ASN  30  -8.762   2.429   1.056
  192   HD22  ASN  30          2HD2      ASN  30  -7.675   1.334   0.269
  193    H    CYS  31           H        CYS  31  -4.667   6.737   0.436
  194    HA   CYS  31           HA       CYS  31  -2.489   5.131   0.971
  195    HB2  CYS  31           1HB      CYS  31  -1.212   6.767   0.023
  196    HB3  CYS  31           2HB      CYS  31  -2.790   7.152  -0.632
  197    H    GLY  32           H        GLY  32  -0.851   5.227   2.633
  198    HA2  GLY  32           1HA      GLY  32  -0.648   7.071   4.669
  199    HA3  GLY  32           2HA      GLY  32  -1.832   5.904   5.222
  200    H    THR  33           H        THR  33   0.210   5.820   6.829
  201    HA   THR  33           HA       THR  33   2.306   4.090   5.815
  202    HB   THR  33           HB       THR  33   1.750   5.339   8.559
  203    HG1  THR  33           1HG      THR  33   2.219   6.660   6.512
  204   HG21  THR  33          3HG2      THR  33   4.272   4.070   7.366
  205   HG22  THR  33          1HG2      THR  33   4.198   4.949   8.911
  206   HG23  THR  33          2HG2      THR  33   3.328   3.408   8.722
  207    H    VAL  34           H        VAL  34  -0.858   3.640   6.830
  208    HA   VAL  34           HA       VAL  34  -0.362   1.277   8.396
  209    HB   VAL  34           HB       VAL  34  -2.875   2.529   7.274
  210   HG11  VAL  34          1HG1      VAL  34  -2.780  -0.055   7.830
  211   HG12  VAL  34          2HG1      VAL  34  -2.907   0.528   9.507
  212   HG13  VAL  34          3HG1      VAL  34  -4.171   0.941   8.323
  213   HG21  VAL  34          3HG2      VAL  34  -3.239   3.083   9.733
  214   HG22  VAL  34          1HG2      VAL  34  -1.531   2.649   9.985
  215   HG23  VAL  34          2HG2      VAL  34  -1.957   3.994   8.900
  216    H    CYS  35           H        CYS  35  -1.270   2.172   5.042
  217    HA   CYS  35           HA       CYS  35  -1.972  -0.383   4.203
  218    HB2  CYS  35           1HB      CYS  35  -2.488   0.750   2.384
  219    HB3  CYS  35           2HB      CYS  35  -1.742   2.180   3.069
  220    H    CYS  36           H        CYS  36   1.031   0.968   5.235
  221    HA   CYS  36           HA       CYS  36   2.865  -0.221   3.577
  222    HB2  CYS  36           1HB      CYS  36   3.040   0.308   6.550
  223    HB3  CYS  36           2HB      CYS  36   4.401  -0.130   5.537
  224    H    GLY  37           H        GLY  37   1.503  -1.449   6.729
  225    HA2  GLY  37           1HA      GLY  37   2.292  -4.173   5.906
  226    HA3  GLY  37           2HA      GLY  37   2.098  -3.613   7.555
  227    H    GLN  38           H        GLN  38  -0.048  -3.030   4.696
  228    HA   GLN  38           HA       GLN  38  -2.091  -4.527   6.144
  229    HB2  GLN  38           1HB      GLN  38  -2.183  -1.836   5.810
  230    HB3  GLN  38           2HB      GLN  38  -2.923  -2.317   4.296
  231    HG2  GLN  38           1HG      GLN  38  -4.363  -3.935   5.854
  232    HG3  GLN  38           2HG      GLN  38  -3.887  -2.822   7.120
  233   HE21  GLN  38          1HE2      GLN  38  -5.430  -1.449   7.533
  234   HE22  GLN  38          2HE2      GLN  38  -6.434  -0.616   6.393
  235    H    CYS  39           H        CYS  39  -0.961  -3.311   2.923
  236    HA   CYS  39           HA       CYS  39  -2.343  -5.598   1.728
  237    HB2  CYS  39           1HB      CYS  39  -2.663  -3.015   1.061
  238    HB3  CYS  39           2HB      CYS  39  -1.303  -3.397   0.023
  239    H    PHE  40           H        PHE  40   0.711  -4.006   2.450
  240    HA   PHE  40           HA       PHE  40   2.091  -6.189   1.079
  241    HB2  PHE  40           1HB      PHE  40   3.233  -3.372   1.235
  242    HB3  PHE  40           2HB      PHE  40   3.585  -4.615   0.050
  243    HD1  PHE  40           1HD      PHE  40   1.219  -1.989   1.025
  244    HD2  PHE  40           2HD      PHE  40   2.194  -4.902  -1.902
  245    HE1  PHE  40           1HE      PHE  40  -0.400  -0.926  -0.571
  246    HE2  PHE  40           2HE      PHE  40   0.575  -3.839  -3.499
  247    HZ   PHE  40           HZ       PHE  40  -0.703  -1.864  -2.814
  248    H    SER  41           H        SER  41   4.646  -5.858   1.781
  249    HA   SER  41           HA       SER  41   4.716  -5.114   4.568
  250    HB2  SER  41           1HB      SER  41   4.913  -7.902   3.526
  251    HB3  SER  41           2HB      SER  41   6.146  -7.456   4.689
  252    HG   SER  41           HG       SER  41   4.643  -7.897   6.151
  253    H    PHE  42           H        PHE  42   7.013  -4.958   5.381
  254    HA   PHE  42           HA       PHE  42   8.625  -3.601   3.621
  255    HB2  PHE  42           1HB      PHE  42   8.555  -4.486   6.345
  256    HB3  PHE  42           2HB      PHE  42  10.073  -5.102   5.724
  257    HD1  PHE  42           1HD      PHE  42   8.088  -1.974   6.032
  258    HD2  PHE  42           2HD      PHE  42  11.936  -3.701   5.570
  259    HE1  PHE  42           1HE      PHE  42   9.140   0.280   6.368
  260    HE2  PHE  42           2HE      PHE  42  12.988  -1.447   5.906
  261    HZ   PHE  42           HZ       PHE  42  11.578   0.517   6.301
  262    HA   PRO  43           HA       PRO  43  10.731  -3.283   3.609
  263    HB2  PRO  43           1HB      PRO  43  12.344  -2.729   1.474
  264    HB3  PRO  43           2HB      PRO  43  12.942  -3.401   2.978
  265    HG2  PRO  43           1HG      PRO  43  12.521  -4.752   0.382
  266    HG3  PRO  43           2HG      PRO  43  13.493  -5.271   1.745
  267    HD2  PRO  43           1HD      PRO  43  10.912  -6.275   0.996
  268    HD3  PRO  43           2HD      PRO  43  11.833  -6.710   2.423
  269    H    VAL  44           H        VAL  44   8.650  -4.578   1.592
  270    HA   VAL  44           HA       VAL  44   8.246  -2.432  -0.217
  271    HB   VAL  44           HB       VAL  44   6.130  -4.397   0.589
  272   HG11  VAL  44          1HG1      VAL  44   6.960  -2.991  -1.954
  273   HG12  VAL  44          2HG1      VAL  44   5.888  -4.412  -1.975
  274   HG13  VAL  44          3HG1      VAL  44   5.397  -2.939  -1.104
  275   HG21  VAL  44          3HG2      VAL  44   7.526  -5.706  -1.405
  276   HG22  VAL  44          1HG2      VAL  44   8.823  -5.062  -0.371
  277   HG23  VAL  44          2HG2      VAL  44   7.563  -6.106   0.329
  278    H    SER  45           H        SER  45   7.042  -3.314   3.039
  279    HA   SER  45           HA       SER  45   4.896  -1.668   3.193
  280    HB2  SER  45           1HB      SER  45   4.996  -2.795   5.162
  281    HB3  SER  45           2HB      SER  45   6.736  -2.982   5.064
  282    HG   SER  45           HG       SER  45   6.015  -1.675   6.903
  283    H    GLN  46           H        GLN  46   8.241  -0.828   2.798
  284    HA   GLN  46           HA       GLN  46   7.910   1.775   3.966
  285    HB2  GLN  46           1HB      GLN  46  10.059   0.707   4.291
  286    HB3  GLN  46           2HB      GLN  46  10.234   0.386   2.577
  287    HG2  GLN  46           1HG      GLN  46  11.578   2.299   2.865
  288    HG3  GLN  46           2HG      GLN  46  10.076   2.987   2.280
  289   HE21  GLN  46          1HE2      GLN  46  11.863   4.512   3.645
  290   HE22  GLN  46          2HE2      GLN  46  11.251   4.956   5.203
  291    H    SER  47           H        SER  47   7.755   0.167   0.825
  292    HA   SER  47           HA       SER  47   8.142   2.492  -0.703
  293    HB2  SER  47           1HB      SER  47   6.656  -0.046  -1.506
  294    HB3  SER  47           2HB      SER  47   7.388   1.123  -2.587
  295    HG   SER  47           HG       SER  47   8.829  -0.485  -0.653
  296    H    CYS  48           H        CYS  48   5.307   0.776   0.690
  297    HA   CYS  48           HA       CYS  48   3.291   2.030  -0.663
  298    HB2  CYS  48           1HB      CYS  48   2.600   0.296   0.676
  299    HB3  CYS  48           2HB      CYS  48   3.545   0.821   2.055
  300    H    ALA  49           H        ALA  49   4.396   2.926   2.693
  301    HA   ALA  49           HA       ALA  49   3.181   5.405   2.725
  302    HB1  ALA  49           3HB      ALA  49   5.304   3.971   4.239
  303    HB2  ALA  49           1HB      ALA  49   5.296   5.743   4.401
  304    HB3  ALA  49           2HB      ALA  49   3.844   4.804   4.825
  305    H    GLY  50           H        GLY  50   5.978   4.282   0.972
  306    HA2  GLY  50           1HA      GLY  50   7.301   6.812   0.746
  307    HA3  GLY  50           2HA      GLY  50   7.608   5.354  -0.176
  308    H    MET  51           H        MET  51   5.377   4.754  -1.566
  309    HA   MET  51           HA       MET  51   5.205   6.997  -3.340
  310    HB2  MET  51           1HB      MET  51   5.519   4.523  -4.018
  311    HB3  MET  51           2HB      MET  51   3.860   4.247  -3.525
  312    HG2  MET  51           1HG      MET  51   3.328   4.792  -5.683
  313    HG3  MET  51           2HG      MET  51   3.555   6.452  -5.169
  314    HE1  MET  51           3HE      MET  51   4.445   3.608  -7.115
  315    HE2  MET  51           1HE      MET  51   4.391   4.856  -8.382
  316    HE3  MET  51           2HE      MET  51   5.912   3.996  -8.045
  317    H    ALA  52           H        ALA  52   3.791   6.738  -0.541
  318    HA   ALA  52           HA       ALA  52   1.015   6.922  -1.382
  319    HB1  ALA  52           3HB      ALA  52   2.504   6.281   1.055
  320    HB2  ALA  52           1HB      ALA  52   1.202   7.457   1.357
  321    HB3  ALA  52           2HB      ALA  52   0.827   5.885   0.611
  322    H    ASP  53           H        ASP  53   2.976   8.915  -2.341
  323    HA   ASP  53           HA       ASP  53   3.127  11.058  -2.624
  324    HB2  ASP  53           1HB      ASP  53   0.371  10.722  -1.589
  325    HB3  ASP  53           2HB      ASP  53   1.011  12.328  -1.306
  326    H    SER  54           H        SER  54   3.462  13.238  -1.391
  327    HA   SER  54           HA       SER  54   4.422  12.574   1.260
  328    HB2  SER  54           1HB      SER  54   5.306  14.331  -0.910
  329    HB3  SER  54           2HB      SER  54   5.214  15.209   0.605
  330    HG   SER  54           HG       SER  54   6.583  12.677   0.273
  331    H    ASN  55           H        ASN  55   3.225  15.678  -0.200
  332    HA   ASN  55           HA       ASN  55   1.514  15.913   2.147
  333    HB2  ASN  55           1HB      ASN  55   3.493  17.657   1.303
  334    HB3  ASN  55           2HB      ASN  55   2.094  18.350   0.506
  335   HD21  ASN  55          1HD2      ASN  55   0.902  19.712   1.598
  336   HD22  ASN  55          2HD2      ASN  55   0.826  19.893   3.319
  337    H    ASP  56           H        ASP  56   1.606  15.263  -1.178
  338    HA   ASP  56           HA       ASP  56  -0.563  16.833  -2.038
  339    HB2  ASP  56           1HB      ASP  56   0.479  14.206  -3.196
  340    HB3  ASP  56           2HB      ASP  56  -0.505  15.384  -4.043
  341    H    CYS  57           H        CYS  57  -0.113  13.735  -0.382
  342    HA   CYS  57           HA       CYS  57  -2.655  12.664  -1.051
  343    HB2  CYS  57           1HB      CYS  57  -0.293  11.766   0.225
  344    HB3  CYS  57           2HB      CYS  57  -1.590  11.575   1.388
  345    HA   PRO  58           HA       PRO  58  -4.994  14.572   2.089
  346    HB2  PRO  58           1HB      PRO  58  -6.763  12.638   2.864
  347    HB3  PRO  58           2HB      PRO  58  -6.953  13.578   1.397
  348    HG2  PRO  58           1HG      PRO  58  -6.078  10.771   1.699
  349    HG3  PRO  58           2HG      PRO  58  -6.675  11.587   0.268
  350    HD2  PRO  58           1HD      PRO  58  -3.944  10.939   0.860
  351    HD3  PRO  58           2HD      PRO  58  -4.530  11.856  -0.514
  352    H    ASN  59           H        ASN  59  -2.623  14.257   3.136
  353    HA   ASN  59           HA       ASN  59  -3.061  12.771   5.579
  354    HB2  ASN  59           1HB      ASN  59  -0.560  14.105   4.415
  355    HB3  ASN  59           2HB      ASN  59  -0.581  13.243   5.940
  356   HD21  ASN  59          1HD2      ASN  59   1.159  12.236   4.413
  357   HD22  ASN  59          2HD2      ASN  59   0.679  10.794   3.582
  358    H    ALA  60           H        ALA  60  -2.627  13.857   7.691
  359    HA   ALA  60           HA       ALA  60  -1.993  16.569   7.898
  360    HB1  ALA  60           3HB      ALA  60  -4.287  17.381   8.603
  361    HB2  ALA  60           1HB      ALA  60  -4.113  17.054   6.862
  362    HB3  ALA  60           2HB      ALA  60  -4.956  15.885   7.907