*HEADER    ELECTRON TRANSPORT                      11-FEB-13   2M4Y              
*TITLE     RUBREDOXIN TYPE PROTEIN FROM MYCOBACTERIUM ULCERANS                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RUBREDOXIN;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM ULCERANS;                         
*SOURCE   3 ORGANISM_TAXID: 362242;                                              
*SOURCE   4 STRAIN: AGY99;                                                       
*SOURCE   5 GENE: RUBA, MUL_2595;                                                
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET28A-AVA                                
*KEYWDS    RUBREDOXIN, ELECTRON TRANSPORT, STRUCTURAL GENOMICS, SEATTLE          
*KEYWDS   2 STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (SSGCID)           
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    R.BARNWAL, G.VARANI, SEATTLE STRUCTURAL GENOMICS CENTER FOR           
*AUTHOR   2 INFECTIOUS DISEASE (SSGCID)                                          
*REVDAT   1   13-MAR-13 2M4Y    0                                                


  1 MET  HA      2 THR  H       3.23            #peak     2 #SUP  0.50  #QF  0.50
  2 THR  HA      3 ALA  H       3.30            #peak     5 #SUP  0.86  #QF  0.86
  3 ALA  H       3 ALA  QB      3.47            #peak     6 #SUP  0.97  #QF  0.97
  3 ALA  H       4 TYR  H       4.36            #peak    10 #SUP  0.97  #QF  0.97
  4 TYR  H       4 TYR  QD      3.88            #peak    11 #SUP  0.73  #QF  0.73
  3 ALA  HA      4 TYR  H       3.30            #peak    12 #SUP  0.86  #QF  0.86
  4 TYR  H      14 ASP  HB2     4.53            #peak    14 #SUP  0.88  #QF  0.88
  3 ALA  QB      4 TYR  H       3.75            #peak    15 #SUP  0.82  #QF  0.82
  4 TYR  HA      5 ARG  H       3.27            #peak    18 #SUP  0.75  #QF  0.75
  4 TYR  HB3     5 ARG  H       3.87            #peak    19 #SUP  0.90  #QF  0.90
  5 ARG  HA      6 CYS  H       3.35            #peak    22 #SUP  0.80  #QF  0.80
  6 CYS  H      50 PHE  QD      4.20            #peak    27 #SUP  0.50  #QF  0.50
  2 THR  H       2 THR  HB      4.13            #peak    28 #SUP  0.81  #QF  0.81
  2 THR  H       2 THR  QG2     4.08            #peak    29 #SUP  0.71  #QF  0.71
  2 THR  H       3 ALA  H       4.58            #peak    30 #SUP  0.93  #QF  0.93
  4 TYR  H      13 TYR  H       5.13            #peak    31 #SUP  0.94  #QF  0.94
  8 VAL  H       9 CYS  H       5.50            #peak    35 #SUP  0.97  #QF  0.97
  9 CYS  H      10 ASP  H       3.50            #peak    38 #SUP  0.87  #QF  0.87
 42 CYS  H      42 CYS  HB2     3.78            #peak    42 #SUP  0.85  #QF  0.29
 10 ASP  H      42 CYS  HB2     4.09            #peak    50 #SUP  0.78  #QF  0.78
 11 TYR  HA     12 THR  H       3.05            #peak    56 #SUP  0.43  #QF  0.43
 12 THR  H      12 THR  HB      3.91            #peak    57 #SUP  0.63  #QF  0.63
 12 THR  H      12 THR  QG2     4.43            #peak    59 #SUP  0.59  #QF  0.59
  5 ARG  HA     13 TYR  H       4.50            #peak    61 #SUP  0.72  #QF  0.72
 12 THR  HA     13 TYR  H       3.23            #peak    62 #SUP  0.78  #QF  0.78
 12 THR  HB     13 TYR  H       4.73            #peak    65 #SUP  0.75  #QF  0.75
 13 TYR  H      13 TYR  HB3     4.07            #peak    66 #SUP  0.97  #QF  0.97
 13 TYR  H      13 TYR  HB2     4.07            #peak    67 #SUP  0.86  #QF  0.86
 13 TYR  H      14 ASP  HB2     5.50            #peak    68 #SUP  0.78  #QF  0.78
 12 THR  QG2    13 TYR  H       4.13            #peak    69 #SUP  0.64  #QF  0.64
 14 ASP  H      15 GLU  H       4.69            #peak    77 #SUP  0.91  #QF  0.91
 13 TYR  QD     14 ASP  H       4.77            #peak    79 #SUP  0.99  #QF  0.99
 13 TYR  HA     14 ASP  H       3.16            #peak    80 #SUP  0.57  #QF  0.57
 14 ASP  H      14 ASP  HB3     3.57            #peak    82 #SUP  0.82  #QF  0.82
 14 ASP  H      14 ASP  HB2     3.83            #peak    83 #SUP  0.77  #QF  0.77
  3 ALA  HA     15 GLU  H       4.11            #peak    87 #SUP  0.85  #QF  0.85
 14 ASP  HA     15 GLU  H       3.11            #peak    88 #SUP  0.82  #QF  0.82
 15 GLU  H      15 GLU  HG2     4.48            #peak    90 #SUP  0.96  #QF  0.96
 14 ASP  HB2    15 GLU  H       4.13            #peak    91 #SUP  0.82  #QF  0.27
 15 GLU  H      30 TRP  HD1     5.29            #peak    93 #SUP  0.99  #QF  0.99
 16 GLY  H      17 LYS  H       3.68            #peak    97 #SUP  0.64  #QF  0.64
 14 ASP  HA     16 GLY  H       4.72            #peak    98 #SUP  0.80  #QF  0.80
 17 LYS  H      18 GLY  H       3.15            #peak   102 #SUP  0.81  #QF  0.81
 14 ASP  HA     17 LYS  H       4.60            #peak   104 #SUP  0.82  #QF  0.82
 14 ASP  HB3    17 LYS  H       4.26            #peak   107 #SUP  0.81  #QF  0.81
 18 GLY  H      26 ALA  HA      4.81            #peak   117 #SUP  0.60  #QF  0.60
 17 LYS  HG3    18 GLY  H       4.72            #peak   119 #SUP  0.66  #QF  0.66
 21 ARG  H      22 GLU  H       3.48            #peak   135 #SUP  0.86  #QF  0.86
 22 GLU  H      22 GLU  HG2     4.48            #peak   141 #SUP  0.89  #QF  0.89
 21 ARG  H      23 GLY  H       4.41            #peak   144 #SUP  0.39  #QF  0.39
 20 PRO  HA     23 GLY  H       4.28            #peak   148 #SUP  0.98  #QF  0.62
 22 GLU  HB3    23 GLY  H       4.80            #peak   151 #SUP  0.88  #QF  0.88
 22 GLU  HB2    23 GLY  H       4.80            #peak   152 #SUP  0.69  #QF  0.69
 24 PHE  H      24 PHE  QD      4.48            #peak   155 #SUP  0.94  #QF  0.94
 20 PRO  HA     24 PHE  H       3.85            #peak   156 #SUP  0.41  #QF  0.41
 22 GLU  HB3    24 PHE  H       4.65            #peak   160 #SUP  0.68  #QF  0.68
 22 GLU  HB2    24 PHE  H       4.65            #peak   161 #SUP  0.60  #QF  0.60
 25 PRO  HA     26 ALA  H       3.25            #peak   167 #SUP  0.64  #QF  0.64
 25 PRO  HB2    26 ALA  H       4.14            #peak   169 #SUP  0.76  #QF  0.76
 25 PRO  HB3    26 ALA  H       4.08            #peak   170 #SUP  0.96  #QF  0.96
 26 ALA  H      26 ALA  QB      3.33            #peak   171 #SUP  0.75  #QF  0.75
 18 GLY  H      27 GLY  H       5.17            #peak   172 #SUP  0.57  #QF  0.57
 26 ALA  QB     27 GLY  H       3.97            #peak   179 #SUP  0.70  #QF  0.70
 31 ASP  H      33 ILE  H       4.79            #peak   182 #SUP  0.91  #QF  0.91
 31 ASP  H      31 ASP  HB2     4.18            #peak   185 #SUP  0.67  #QF  0.67
 29 ARG  HB2    31 ASP  H       3.94            #peak   186 #SUP  0.51  #QF  0.51
 29 ARG  HB3    31 ASP  H       3.94            #peak   187 #SUP  0.50  #QF  0.50
 28 THR  H      29 ARG  H       4.58            #peak   188 #SUP  1.00
 27 GLY  H      28 THR  H       3.70            #peak   189 #SUP  0.50  #QF  0.50
 28 THR  H      28 THR  HB      3.37            #peak   194 #SUP  0.77  #QF  0.77
 28 THR  H      28 THR  QG2     4.33            #peak   198 #SUP  0.81  #QF  0.81
 28 THR  HA     29 ARG  H       3.19            #peak   201 #SUP  0.75  #QF  0.75
 28 THR  QG2    29 ARG  H       3.90            #peak   204 #SUP  0.70  #QF  0.70
 30 TRP  H      30 TRP  HD1     4.35            #peak   208 #SUP  0.90  #QF  0.90
  4 TYR  QD     30 TRP  H       5.50            #peak   209 #SUP  0.94  #QF  0.94
 29 ARG  HA     30 TRP  H       3.33            #peak   211 #SUP  0.89  #QF  0.89
 31 ASP  H      32 GLN  H       3.86            #peak   215 #SUP  0.61  #QF  0.61
 28 THR  QG2    32 GLN  H       4.72            #peak   221 #SUP  0.54  #QF  0.54
 32 GLN  H      33 ILE  HB      5.07            #peak   222 #SUP  0.83  #QF  0.83
 32 GLN  H      33 ILE  H       3.12            #peak   234 #SUP  0.90  #QF  0.90
 30 TRP  HA     33 ILE  H       3.83            #peak   237 #SUP  0.76  #QF  0.76
 33 ILE  H      34 PRO  HD2     4.86            #peak   238 #SUP  0.96  #QF  0.96
 28 THR  QG2    33 ILE  H       4.42            #peak   242 #SUP  0.89  #QF  0.89
 33 ILE  H      33 ILE  HB      3.30            #peak   243 #SUP  0.87  #QF  0.87
 33 ILE  H      33 ILE  HG13    4.15            #peak   244 #SUP  0.66  #QF  0.66
 33 ILE  H      33 ILE  QD1     4.74            #peak   245 #SUP  0.88  #QF  0.88
 33 ILE  H      33 ILE  HG12    4.15            #peak   246 #SUP  0.73  #QF  0.73
 35 ASP  H      36 ASP  H       3.79            #peak   249 #SUP  0.60  #QF  0.60
 34 PRO  HA     35 ASP  H       3.00            #peak   251 #SUP  0.93  #QF  0.53
 34 PRO  HB2    35 ASP  H       4.08            #peak   253 #SUP  0.56  #QF  0.56
 34 PRO  HA     36 ASP  H       4.35            #peak   255 #SUP  0.85  #QF  0.53
 36 ASP  H      36 ASP  HB3     3.97            #peak   256 #SUP  0.82  #QF  0.82
 36 ASP  H      36 ASP  HB2     3.97            #peak   257 #SUP  0.78  #QF  0.78
 34 PRO  HB2    36 ASP  H       3.92            #peak   258 #SUP  0.64  #QF  0.64
 36 ASP  H      37 TRP  H       3.59            #peak   261 #SUP  0.98  #QF  0.98
 37 TRP  H      37 TRP  HB2     3.15            #peak   266 #SUP  0.61  #QF  0.61
 34 PRO  HB2    37 TRP  H       3.99            #peak   268 #SUP  0.60  #QF  0.60
 33 ILE  QG2    37 TRP  H       4.93            #peak   269 #SUP  0.78  #QF  0.78
 37 TRP  HD1    38 CYS  H       4.02            #peak   270 #SUP  0.63  #QF  0.63
 37 TRP  HA     38 CYS  H       3.15            #peak   273 #SUP  0.59  #QF  0.59
 37 TRP  HB2    38 CYS  H       4.39            #peak   274 #SUP  0.84  #QF  0.84
 38 CYS  HA     39 CYS  H       3.33            #peak   279 #SUP  0.62  #QF  0.62
 40 PRO  HD2    41 ASP  H       3.92            #peak   291 #SUP  0.23  #QF  0.23
 40 PRO  HG3    41 ASP  H       5.06            #peak   292 #SUP  0.94  #QF  0.77
 44 VAL  H      45 ARG  H       5.50            #peak   305 #SUP  0.89  #QF  0.89
 43 SER  H      45 ARG  H       4.67            #peak   311 #SUP  0.29  #QF  0.29
 43 SER  HB3    45 ARG  H       5.10            #peak   314 #SUP  0.55  #QF  0.55
 44 VAL  HB     45 ARG  H       4.51            #peak   316 #SUP  0.95  #QF  0.95
 45 ARG  H      45 ARG  HB2     3.99            #peak   317 #SUP  0.88  #QF  0.88
 45 ARG  H      45 ARG  HB3     4.08            #peak   318 #SUP  0.86  #QF  0.86
 46 GLU  H      46 GLU  HB3     3.80            #peak   321 #SUP  0.95  #QF  0.95
 46 GLU  H      46 GLU  HB2     3.80            #peak   322 #SUP  0.96  #QF  0.96
 45 ARG  HA     46 GLU  H       3.45            #peak   328 #SUP  0.95  #QF  0.71
 46 GLU  H      47 LYS  H       4.67            #peak   330 #SUP  0.79  #QF  0.79
 46 GLU  HA     47 LYS  H       3.21            #peak   334 #SUP  0.86  #QF  0.86
 47 LYS  H      48 VAL  QG1     4.66            #peak   338 #SUP  0.77  #QF  0.62
 48 VAL  QG1    50 PHE  H       5.18            #peak   338 #SUP  0.77  #QF  0.62
 47 LYS  H      47 LYS  HD2     5.33            #peak   340 #SUP  0.72  #QF  0.37
 47 LYS  H      47 LYS  HD3     5.33            #peak   340 #SUP  0.72  #QF  0.37
 50 PHE  H      50 PHE  HB2     3.29            #peak   343 #SUP  0.79  #QF  0.79
  4 TYR  QD     50 PHE  H       5.11            #peak   344 #SUP  0.94  #QF  0.94
 50 PHE  H      50 PHE  QD      3.46            #peak   345 #SUP  0.83  #QF  0.83
 48 VAL  H      48 VAL  HB      3.38            #peak   353 #SUP  0.75  #QF  0.75
 48 VAL  H      48 VAL  QG1     3.22            #peak   355 #SUP  0.62  #QF  0.62
 46 GLU  HA     48 VAL  H       4.99            #peak   357 #SUP  0.51  #QF  0.51
 48 VAL  H      49 ASP  H       4.02            #peak   358 #SUP  0.88  #QF  0.88
 49 ASP  H      50 PHE  QD      4.46            #peak   360 #SUP  0.46  #QF  0.46
 48 VAL  QG1    49 ASP  H       3.81            #peak   364 #SUP  0.77  #QF  0.77
 50 PHE  HA     51 GLU  H       3.31            #peak   365 #SUP  0.99  #QF  0.76
  6 CYS  HA     51 GLU  H       5.17            #peak   367 #SUP  0.53  #QF  0.53
 50 PHE  HB3    51 GLU  H       4.02            #peak   368 #SUP  0.79  #QF  0.79
 51 GLU  H      52 ARG  H       5.12            #peak   373 #SUP  0.99  #QF  0.99
 50 PHE  QD     51 GLU  H       4.65            #peak   376 #SUP  0.95  #QF  0.95
  4 TYR  QD     52 ARG  H       4.76            #peak   381 #SUP  0.69  #QF  0.69
 51 GLU  HA     52 ARG  H       3.06            #peak   382 #SUP  0.44  #QF  0.44
 52 ARG  H      52 ARG  HB3     4.16            #peak   386 #SUP  0.87  #QF  0.87
  2 THR  QG2    53 MET  H       5.50            #peak   392 #SUP  0.72  #QF  0.23
  4 TYR  HA     53 MET  H       4.18            #peak   393 #SUP  0.52  #QF  0.52
 52 ARG  HA     53 MET  H       3.22            #peak   395 #SUP  0.76  #QF  0.76
 55 GLY  H      56 LYS  H       5.08            #peak   409 #SUP  0.66  #QF  0.66
 15 GLU  H      15 GLU  HG3     4.48            #peak    27 #SUP  0.85  #QF  0.85
 34 PRO  HD2    37 TRP  HB2     4.34            #peak    32 #SUP  0.82  #QF  0.82
 34 PRO  HD3    37 TRP  HB2     5.18            #peak    35 #SUP  0.86  #QF  0.86
  5 ARG  HA     50 PHE  QD      4.44            #peak    47 #SUP  0.70  #QF  0.70
  3 ALA  HA      4 TYR  HB2     5.26            #peak    59 #SUP  1.00  #QF  0.61
 24 PHE  HA     24 PHE  QE      4.79            #peak    65 #SUP  0.55  #QF  0.55
 24 PHE  HA     25 PRO  HD2     3.60            #peak    68 #SUP  0.99  #QF  0.99
 24 PHE  HA     25 PRO  HD3     3.60            #peak    69 #SUP  0.97  #QF  0.97
 24 PHE  HA     25 PRO  HB3     5.34            #peak    72 #SUP  0.96  #QF  0.96
  2 THR  HB      3 ALA  H       4.63            #peak    88 #SUP  0.94  #QF  0.94
  2 THR  HB      4 TYR  QD      4.69            #peak    89 #SUP  0.99  #QF  0.99
  3 ALA  QB     15 GLU  H       4.65            #peak    91 #SUP  0.96  #QF  0.96
  3 ALA  QB     53 MET  HA      5.29            #peak    96 #SUP  0.66  #QF  0.66
  2 THR  HB      3 ALA  QB      5.15            #peak    97 #SUP  0.98  #QF  0.98
  3 ALA  QB     52 ARG  HA      5.23            #peak    98 #SUP  0.61  #QF  0.61
  3 ALA  QB     53 MET  HB2     4.11            #peak   101 #SUP  0.67  #QF  0.67
  4 TYR  HB3    50 PHE  QD      4.22            #peak   108 #SUP  1.00
  4 TYR  HB3    50 PHE  HB2     4.78            #peak   113 #SUP  1.00
  4 TYR  HB3    50 PHE  HB3     4.13            #peak   114 #SUP  0.96  #QF  0.96
  2 THR  QG2     3 ALA  H       3.86            #peak   160 #SUP  0.85  #QF  0.85
  2 THR  QG2    15 GLU  H       4.65            #peak   161 #SUP  0.45  #QF  0.45
 45 ARG  HA     45 ARG  HD3     4.16            #peak   184 #SUP  0.54  #QF  0.54
  8 VAL  HB      9 CYS  H       4.32            #peak   219 #SUP  0.72  #QF  0.72
  9 CYS  HB2    42 CYS  HB2     4.07            #peak   239 #SUP  0.96  #QF  0.96
 14 ASP  HB3    17 LYS  HA      5.07            #peak   252 #SUP  0.93  #QF  0.78
 10 ASP  HA     40 PRO  HD2     5.50            #peak   252 #SUP  0.93  #QF  0.78
 15 GLU  HA     30 TRP  HD1     4.72            #peak   299 #SUP  0.97  #QF  0.97
 20 PRO  HG3    25 PRO  HB3     4.13            #peak   338 #SUP  0.55  #QF  0.55
 26 ALA  HA     27 GLY  H       3.38            #peak   372 #SUP  0.75  #QF  0.75
 28 THR  HB     29 ARG  H       4.58            #peak   435 #SUP  1.00
 31 ASP  H      31 ASP  HB3     4.18            #peak   485 #SUP  0.71  #QF  0.71
 32 GLN  H      32 GLN  HG2     5.37            #peak   501 #SUP  0.96  #QF  0.80
 32 GLN  H      32 GLN  HG3     5.37            #peak   501 #SUP  0.96  #QF  0.80
 33 ILE  HB     47 LYS  HE2     4.55            #peak   508 #SUP  0.89  #QF  0.89
 33 ILE  QG2    33 ILE  QD1     3.67            #peak   517 #SUP  0.99  #QF  0.99
 33 ILE  QG2    33 ILE  HG12    4.17            #peak   521 #SUP  1.00
 33 ILE  QG2    34 PRO  HD3     3.71            #peak   522 #SUP  0.85  #QF  0.85
 33 ILE  QG2    37 TRP  HB3     4.12            #peak   524 #SUP  0.97  #QF  0.97
 33 ILE  H      33 ILE  QG2     4.79            #peak   528 #SUP  0.92  #QF  0.92
 28 THR  QG2    33 ILE  HG12    4.80            #peak   532 #SUP  0.96  #QF  0.96
 28 THR  QG2    33 ILE  HG13    4.80            #peak   533 #SUP  0.72  #QF  0.72
 13 TYR  QD     33 ILE  QD1     4.81            #peak   545 #SUP  0.81  #QF  0.81
 24 PHE  QE     33 ILE  QD1     3.81            #peak   547 #SUP  0.73  #QF  0.73
 34 PRO  HB2    35 ASP  HA      5.08            #peak   582 #SUP  0.80  #QF  0.80
 37 TRP  HA     37 TRP  HE1     5.50            #peak   620 #SUP  0.97  #QF  0.97
  1 MET  HA      2 THR  HB      4.72            #peak   636 #SUP  0.60  #QF  0.60
 40 PRO  HD2    43 SER  H       4.88            #peak   681 #SUP  0.77  #QF  0.77
 39 CYS  HA     40 PRO  HD3     3.73            #peak   687 #SUP  0.99  #QF  0.99
 39 CYS  HA     40 PRO  HD2     3.75            #peak   690 #SUP  0.99  #QF  0.99
 41 ASP  HB2    42 CYS  H       5.08            #peak   699 #SUP  0.84  #QF  0.50
 41 ASP  HB3    42 CYS  H       5.08            #peak   700 #SUP  0.99  #QF  0.84
  9 CYS  HB3    42 CYS  HB3     4.43            #peak   713 #SUP  1.00
  4 TYR  HB3    52 ARG  HA      5.30            #peak   847 #SUP  0.57  #QF  0.30
  4 TYR  QD     52 ARG  HA      4.31            #peak   851 #SUP  0.99  #QF  0.99
 52 ARG  H      52 ARG  HB2     4.16            #peak   857 #SUP  0.97  #QF  0.97
 34 PRO  HB3    35 ASP  H       4.23            #peak   904 #SUP  0.87  #QF  0.87
 22 GLU  H      22 GLU  HG3     4.48            #peak   908 #SUP  0.62  #QF  0.62
  5 ARG  HA     12 THR  QG2     4.58            #peak    37 #SUP  0.96  #QF  0.96
  3 ALA  HA      4 TYR  QD      4.33            #peak    41 #SUP  0.99  #QF  0.99
  3 ALA  HA     14 ASP  HA      3.48            #peak    43 #SUP  1.00
  3 ALA  HA     14 ASP  HB2     4.64            #peak    44 #SUP  0.99  #QF  0.99
  3 ALA  HA     14 ASP  H       5.50            #peak    46 #SUP  0.70  #QF  0.70
 12 THR  HA     50 PHE  QD      5.43            #peak    53 #SUP  0.31  #QF  0.31
  5 ARG  HA     12 THR  HA      3.55            #peak    54 #SUP  0.86  #QF  0.86
 19 ASP  HA     20 PRO  HD2     3.55            #peak    63 #SUP  0.98  #QF  0.98
  4 TYR  HA     52 ARG  HA      3.78            #peak    70 #SUP  0.93  #QF  0.93
  4 TYR  HA      4 TYR  QD      4.21            #peak    71 #SUP  0.94  #QF  0.94
 49 ASP  HA     50 PHE  HA      4.99            #peak    80 #SUP  0.49  #QF  0.49
  3 ALA  QB     14 ASP  HB3     4.67            #peak    93 #SUP  0.95  #QF  0.95
  3 ALA  QB     14 ASP  HB2     3.93            #peak    94 #SUP  0.97  #QF  0.97
  3 ALA  QB     53 MET  HB3     4.11            #peak    96 #SUP  0.84  #QF  0.84
  3 ALA  QB     14 ASP  HA      3.70            #peak   102 #SUP  0.99  #QF  0.99
  2 THR  HA      3 ALA  QB      4.65            #peak   103 #SUP  0.96  #QF  0.96
  4 TYR  HB2    50 PHE  QD      4.59            #peak   113 #SUP  1.00
 24 PHE  QE     33 ILE  HA      4.92            #peak   133 #SUP  0.92  #QF  0.92
  2 THR  HA      2 THR  QG2     3.57            #peak   239 #SUP  0.21  #QF  0.21
 29 ARG  HB3    29 ARG  HD2     4.20            #peak   246 #SUP  0.83  #QF  0.66
  8 VAL  HA      8 VAL  QG2     3.38            #peak   293 #SUP  0.96  #QF  0.55
 28 THR  HA     28 THR  QG2     3.31            #peak   293 #SUP  0.96  #QF  0.55
 24 PHE  HB3    28 THR  HA      5.12            #peak   296 #SUP  0.91  #QF  0.91
 17 LYS  HA     17 LYS  HD3     4.02            #peak   322 #SUP  0.47  #QF  0.47
  4 TYR  QD     50 PHE  HB2     4.78            #peak   330 #SUP  0.99  #QF  0.99
 11 TYR  HA     11 TYR  QD      4.20            #peak   343 #SUP  1.00
 13 TYR  HA     13 TYR  QD      3.85            #peak   358 #SUP  0.89  #QF  0.89
 20 PRO  HA     25 PRO  HA      3.89            #peak   492 #SUP  0.86  #QF  0.86
 24 PHE  HB3    28 THR  HB      4.01            #peak   524 #SUP  0.88  #QF  0.88
 24 PHE  HB3    28 THR  QG2     3.98            #peak   526 #SUP  0.91  #QF  0.91
 29 ARG  HB2    29 ARG  HD2     4.20            #peak   548 #SUP  1.00
 29 ARG  HB3    29 ARG  HD3     4.20            #peak   556 #SUP  0.93  #QF  0.93
 29 ARG  HB2    29 ARG  HD3     4.20            #peak   558 #SUP  1.00
  4 TYR  QD     30 TRP  HB2     4.44            #peak   569 #SUP  0.99  #QF  0.99
  4 TYR  QD     30 TRP  HB3     4.44            #peak   570 #SUP  0.88  #QF  0.88
 33 ILE  HB     47 LYS  HE3     4.55            #peak   587 #SUP  0.90  #QF  0.90
 33 ILE  QG2    34 PRO  HA      5.10            #peak   595 #SUP  0.98  #QF  0.91
 33 ILE  QG2    35 ASP  HA      5.50            #peak   595 #SUP  0.98  #QF  0.91
 33 ILE  HA     33 ILE  QG2     3.78            #peak   597 #SUP  0.91  #QF  0.64
 33 ILE  QG2    37 TRP  HB2     3.95            #peak   598 #SUP  0.65  #QF  0.65
 33 ILE  QG2    34 PRO  HB2     4.58            #peak   600 #SUP  0.61  #QF  0.61
 33 ILE  QG2    33 ILE  HG13    4.17            #peak   605 #SUP  0.94  #QF  0.94
 30 TRP  HA     33 ILE  HG12    5.23            #peak   607 #SUP  0.99  #QF  0.99
 30 TRP  HA     33 ILE  HG13    5.23            #peak   608 #SUP  1.00  #QF  0.99
 30 TRP  HA     33 ILE  QD1     4.10            #peak   629 #SUP  0.98  #QF  0.98
 33 ILE  QD1    34 PRO  HD2     5.12            #peak   630 #SUP  0.94  #QF  0.94
 33 ILE  HA     33 ILE  QD1     4.40            #peak   631 #SUP  0.97  #QF  0.97
 24 PHE  HB3    33 ILE  QD1     5.18            #peak   632 #SUP  0.85  #QF  0.52
 33 ILE  HB     33 ILE  QD1     3.80            #peak   636 #SUP  0.95  #QF  0.95
 37 TRP  HA     37 TRP  HD1     4.26            #peak   686 #SUP  0.94  #QF  0.94
 34 PRO  HB2    37 TRP  HB2     4.53            #peak   695 #SUP  0.65  #QF  0.65
  6 CYS  HA     50 PHE  HA      4.99            #peak   748 #SUP  0.45  #QF  0.45
 50 PHE  HA     50 PHE  QD      4.34            #peak   751 #SUP  1.00
  9 CYS  HB3    42 CYS  HB2     4.07            #peak   752 #SUP  0.66  #QF  0.66
 45 ARG  HA     45 ARG  HD2     4.16            #peak   762 #SUP  0.66  #QF  0.66
 47 LYS  HA     47 LYS  HD3     4.65            #peak   785 #SUP  0.89  #QF  0.89
 47 LYS  HA     48 VAL  HA      5.24            #peak   787 #SUP  0.75  #QF  0.56
 47 LYS  HA     50 PHE  HB2     5.50            #peak   787 #SUP  0.75  #QF  0.56
 47 LYS  HA     50 PHE  QD      4.33            #peak   788 #SUP  0.81  #QF  0.81
 47 LYS  HA     50 PHE  QE      4.58            #peak   789 #SUP  0.81  #QF  0.81
 50 PHE  HB2    51 GLU  HA      5.23            #peak   846 #SUP  0.65  #QF  0.65
 24 PHE  QD     34 PRO  HD3     5.50            #peak     5 #SUP  0.89  #QF  0.89
 24 PHE  QD     28 THR  QG2     4.00            #peak     8 #SUP  0.92  #QF  0.92
 24 PHE  QD     33 ILE  QD1     5.25            #peak    10 #SUP  0.89  #QF  0.84
 24 PHE  HA     28 THR  QG2     4.69            #peak    20 #SUP  0.90  #QF  0.90
 13 TYR  QD     22 GLU  HG3     5.17            #peak    64 #SUP  0.91  #QF  0.91
 13 TYR  QD     22 GLU  HG2     5.17            #peak    75 #SUP  0.82  #QF  0.82
 37 TRP  HD1    39 CYS  HA      5.26            #peak    76 #SUP  0.93  #QF  0.64
 39 CYS  HA     43 SER  H       5.50            #peak    76 #SUP  0.93  #QF  0.64
 30 TRP  HA     30 TRP  HD1     4.35            #peak    85 #SUP  0.87  #QF  0.87
  2 THR  HB     30 TRP  HD1     3.98            #peak    87 #SUP  0.58  #QF  0.58
 24 PHE  QE     34 PRO  HD3     4.55            #peak    98 #SUP  0.50  #QF  0.50
 15 GLU  HG2    30 TRP  HD1     3.75            #peak   106 #SUP  0.88  #QF  0.88
  4 TYR  QD     50 PHE  HB3     4.07            #peak   107 #SUP  0.94  #QF  0.43
 15 GLU  HG3    30 TRP  HD1     3.75            #peak   109 #SUP  0.89  #QF  0.89
 15 GLU  HB3    30 TRP  HD1     4.93            #peak   112 #SUP  0.78  #QF  0.78
 15 GLU  HB2    30 TRP  HD1     4.93            #peak   117 #SUP  0.93  #QF  0.93
  2 THR  QG2     4 TYR  QD      3.69            #peak   125 #SUP  0.83  #QF  0.83
 24 PHE  QE     28 THR  QG2     4.69            #peak   126 #SUP  0.66  #QF  0.66
 33 ILE  QG2    37 TRP  HD1     5.31            #peak   134 #SUP  0.37  #QF  0.37
 24 PHE  QE     33 ILE  QG2     4.41            #peak   136 #SUP  0.90  #QF  0.90
  2 THR  QG2     3 ALA  HA      4.45            #peak   149 #SUP  0.97  #QF  0.77
 12 THR  HA     12 THR  QG2     3.58            #peak   150 #SUP  0.98  #QF  0.98
 42 CYS  HB2    43 SER  H       5.24            #peak   156 #SUP  0.99  #QF  0.95
 42 CYS  HB3    43 SER  H       5.46            #peak   161 #SUP  1.00  #QF  0.99
  4 TYR  QD     50 PHE  QE      5.07            #peak   165 #SUP  0.44  #QF  0.44
  4 TYR  QD     30 TRP  HD1     4.47            #peak   215 #SUP  0.81  #QF  0.81
 24 PHE  HA     24 PHE  QD      3.81            #peak   226 #SUP  0.98  #QF  0.98
  4 TYR  QD     50 PHE  QD      3.83            #peak   227 #SUP  0.57  #QF  0.57
 24 PHE  H      24 PHE  QE      5.20            #peak   232 #SUP  0.58  #QF  0.58
  9 CYS  HA     42 CYS  HB2     4.41            #peak   242 #SUP  0.95  #QF  0.38
 19 ASP  HA     20 PRO  HG3     4.78            #peak   243 #SUP  0.37  #QF  0.37
 36 ASP  HA     37 TRP  HB2     5.50            #peak   267 #SUP  0.41  #QF  0.41
 48 VAL  HA     48 VAL  QG1     3.24            #peak   280 #SUP  0.82  #QF  0.82
  8 VAL  HA      8 VAL  QG1     3.38            #peak   282 #SUP  0.94  #QF  0.47
 10 ASP  HA     40 PRO  HG2     4.78            #peak   284 #SUP  0.79  #QF  0.79
 17 LYS  HA     17 LYS  HG3     3.21            #peak   286 #SUP  0.79  #QF  0.79
 17 LYS  HA     17 LYS  HD2     4.02            #peak   288 #SUP  1.00  #QF  0.47
 33 ILE  HA     34 PRO  HD2     3.40            #peak   331 #SUP  0.81  #QF  0.81
 30 TRP  HA     33 ILE  HB      4.69            #peak   341 #SUP  0.52  #QF  0.52
 47 LYS  HA     47 LYS  HD2     4.65            #peak   342 #SUP  0.90  #QF  0.90
 33 ILE  HB     34 PRO  HD2     4.94            #peak   344 #SUP  0.73  #QF  0.57
 33 ILE  QG2    34 PRO  HD2     4.12            #peak   347 #SUP  0.95  #QF  0.95
 33 ILE  HA     33 ILE  HG13    4.25            #peak   350 #SUP  0.34  #QF  0.34
 33 ILE  HA     33 ILE  HG12    4.25            #peak   361 #SUP  0.74  #QF  0.74
 33 ILE  HA     34 PRO  HD3     3.56            #peak   383 #SUP  0.54  #QF  0.54
  9 CYS  HB2    42 CYS  HB3     4.43            #peak   415 #SUP  0.87  #QF  0.87
 28 THR  QG2    33 ILE  QD1     4.13            #peak   461 #SUP  0.43  #QF  0.43
  2 THR  QG2     3 ALA  QB      4.02            #peak   486 #SUP  0.79  #QF  0.79
  1 MET  QB      1 MET  QE      3.74            #peak    80
  1 MET  QB      2 THR  H       3.61            #peak     3
  1 MET  QB     16 GLY  H       4.39            #peak    74
  1 MET  QB     16 GLY  QA      4.92            #peak   383
  2 THR  HB     15 GLU  QG      4.55            #peak    16
  2 THR  QG2    15 GLU  QG      4.50            #peak   505
  2 THR  QG2    52 ARG  QB      4.51            #peak   878
  4 TYR  HB2    30 TRP  QB      4.73            #peak   108
  4 TYR  QD     52 ARG  QB      4.27            #peak   123
  5 ARG  H       5 ARG  QB      3.53            #peak    20
  5 ARG  QB      5 ARG  QD      2.99            #peak   248
  5 ARG  QB     53 MET  QB      4.58            #peak   125
  5 ARG  QB     53 MET  QG      3.52            #peak   422
  5 ARG  QD      6 CYS  H       4.41            #peak    24
  5 ARG  QD      7 PRO  QD      3.87            #peak   176
  5 ARG  QD     12 THR  QG2     3.66            #peak   532
  8 VAL  QQG     9 CYS  H       3.92            #peak    44
  8 VAL  QQG    45 ARG  HA      5.44            #peak   310
  8 VAL  QQG    45 ARG  HB3     3.99            #peak   305
  8 VAL  QQG    45 ARG  QG      3.36            #peak   481
  8 VAL  QQG    45 ARG  QD      4.15            #peak   309
  8 VAL  QQG    49 ASP  QB      5.07            #peak   224
  9 CYS  H       9 CYS  QB      3.70            #peak    41
  9 CYS  QB     10 ASP  H       4.32            #peak    49
  9 CYS  QB     42 CYS  H       4.71            #peak   237
  9 CYS  QB     42 CYS  HA      4.07            #peak   270
  9 CYS  QB     42 CYS  HB2     3.34            #peak   752
  9 CYS  QB     42 CYS  HB3     3.62            #peak   415
 10 ASP  QB     40 PRO  HD2     4.09            #peak   259
 11 TYR  QB     12 THR  H       4.27            #peak    58
 13 TYR  H      13 TYR  QB      3.52            #peak    67
 13 TYR  QD     22 GLU  QB      4.55            #peak    69
 13 TYR  QD     22 GLU  QG      4.32            #peak    64
 14 ASP  H      17 LYS  QD      4.69            #peak    84
 14 ASP  HB2    17 LYS  QD      4.73            #peak     3
 14 ASP  HB3    17 LYS  QB      4.46            #peak   391
 14 ASP  HB3    17 LYS  QD      4.08            #peak   508
 15 GLU  H      15 GLU  QG      3.74            #peak    90
 15 GLU  HA     15 GLU  QG      3.62            #peak   295
 15 GLU  QB     30 TRP  HD1     4.33            #peak   117
 15 GLU  QG     29 ARG  HA      3.53            #peak   447
 15 GLU  QG     30 TRP  HD1     3.21            #peak   106
 17 LYS  H      17 LYS  QD      4.25            #peak   108
 17 LYS  HA     17 LYS  QD      3.16            #peak   322
 17 LYS  QB     18 GLY  H       3.93            #peak   118
 17 LYS  HG3    17 LYS  QD      2.53            #peak   396
 18 GLY  QA     19 ASP  H       2.95            #peak   126
 18 GLY  QA     26 ALA  HA      3.52            #peak   452
 18 GLY  QA     26 ALA  QB      4.20            #peak   515
 18 GLY  QA     27 GLY  H       4.43            #peak   177
 19 ASP  HA     21 ARG  QB      4.47            #peak    66
 19 ASP  HA     21 ARG  QD      4.47            #peak   239
 20 PRO  HA     25 PRO  QD      4.27            #peak   405
 20 PRO  QB     25 PRO  HA      3.72            #peak   274
 20 PRO  QB     25 PRO  HB3     2.95            #peak   430
 20 PRO  HD2    21 ARG  QB      4.30            #peak   417
 21 ARG  H      21 ARG  QB      3.15            #peak   133
 21 ARG  H      21 ARG  QG      3.71            #peak   134
 21 ARG  HA     21 ARG  QG      3.51            #peak   291
 21 ARG  QB     21 ARG  QD      3.24            #peak   447
 21 ARG  QG     22 GLU  H       5.34            #peak    67
 21 ARG  QD     22 GLU  H       4.81            #peak   140
 22 GLU  H      22 GLU  QB      3.41            #peak   143
 22 GLU  H      22 GLU  QG      3.94            #peak   141
 22 GLU  HA     22 GLU  QG      3.08            #peak   458
 22 GLU  QB     23 GLY  H       4.13            #peak   151
 22 GLU  QB     24 PHE  H       4.09            #peak   160
 22 GLU  QB     24 PHE  QD      4.75            #peak     7
 22 GLU  QB     24 PHE  QE      5.34            #peak   113
 22 GLU  QB     33 ILE  QD1     5.34            #peak   633
 22 GLU  QG     24 PHE  QD      5.34            #peak     6
 23 GLY  QA     24 PHE  HA      4.88            #peak    70
 24 PHE  HA     25 PRO  QG      4.42            #peak    51
 24 PHE  HB2    25 PRO  QD      4.68            #peak   429
 24 PHE  QD     25 PRO  QD      4.99            #peak     4
 24 PHE  QE     33 ILE  QG1     4.91            #peak   141
 26 ALA  HA     27 GLY  QA      4.36            #peak   451
 26 ALA  QB     27 GLY  QA      4.31            #peak   285
 27 GLY  QA     28 THR  HA      4.32            #peak   321
 28 THR  HA     29 ARG  QB      4.75            #peak   210
 28 THR  HA     32 GLN  QB      4.37            #peak   295
 28 THR  QG2    32 GLN  QB      3.35            #peak   533
 28 THR  QG2    33 ILE  QG1     4.09            #peak   532
 29 ARG  H      29 ARG  QB      3.23            #peak   203
 29 ARG  H      29 ARG  QD      4.72            #peak   202
 29 ARG  HA     29 ARG  QG      3.60            #peak   544
 29 ARG  HA     29 ARG  QD      3.95            #peak   562
 29 ARG  HA     30 TRP  QB      4.72            #peak   446
 29 ARG  QB     29 ARG  QD      3.15            #peak   246
 29 ARG  QB     30 TRP  H       3.78            #peak   213
 29 ARG  QB     31 ASP  H       3.40            #peak   186
 30 TRP  H      30 TRP  QB      3.07            #peak   212
 30 TRP  HA     33 ILE  QG1     4.58            #peak   607
 30 TRP  QB     30 TRP  HD1     3.38            #peak   102
 30 TRP  QB     33 ILE  QD1     5.25            #peak   632
 31 ASP  H      31 ASP  QB      3.32            #peak   185
 31 ASP  QB     32 GLN  H       4.44            #peak   219
 32 GLN  H      32 GLN  QB      3.69            #peak   497
 32 GLN  H      32 GLN  QG      4.52            #peak   501
 32 GLN  H      32 GLN  QE2     4.51            #peak   169
 32 GLN  HA     32 GLN  QG      3.74            #peak   492
 32 GLN  HA     32 GLN  QE2     4.88            #peak   496
 32 GLN  QB     32 GLN  QG      2.37            #peak   585
 32 GLN  QB     33 ILE  HA      4.60            #peak   127
 32 GLN  QB     33 ILE  QD1     5.23            #peak   634
 33 ILE  H      33 ILE  QG1     3.61            #peak   246
 33 ILE  QG2    34 PRO  QG      4.65            #peak   599
 33 ILE  QG2    47 LYS  QG      5.34            #peak   518
 33 ILE  QG2    47 LYS  QE      3.86            #peak   519
 35 ASP  H      35 ASP  QB      3.14            #peak   252
 35 ASP  HA     47 LYS  QD      4.13            #peak   660
 35 ASP  HA     47 LYS  QE      4.13            #peak   589
 36 ASP  H      36 ASP  QB      3.29            #peak   257
 36 ASP  QB     37 TRP  H       4.41            #peak   267
 37 TRP  HB2    47 LYS  QE      4.90            #peak   811
 38 CYS  H      38 CYS  QB      3.62            #peak   275
 39 CYS  H      39 CYS  QB      3.13            #peak   282
 39 CYS  QB     43 SER  H       3.63            #peak   385
 41 ASP  H      41 ASP  QB      3.27            #peak   290
 41 ASP  QB     42 CYS  H       4.31            #peak   699
 44 VAL  QQG    45 ARG  H       4.25            #peak   320
 45 ARG  H      45 ARG  QG      4.83            #peak   319
 45 ARG  HA     45 ARG  QD      3.63            #peak   762
 45 ARG  HB2    49 ASP  QB      4.68            #peak   835
 45 ARG  HB3    45 ARG  QD      3.69            #peak   246
 45 ARG  HB3    49 ASP  QB      3.74            #peak   369
 45 ARG  QD     46 GLU  H       4.92            #peak   324
 46 GLU  H      49 ASP  QB      4.13            #peak   325
 46 GLU  QB     47 LYS  H       3.43            #peak   336
 46 GLU  QB     48 VAL  QG1     3.02            #peak   433
 47 LYS  H      47 LYS  QB      3.14            #peak   337
 47 LYS  H      47 LYS  QD      4.62            #peak   340
 47 LYS  HA     47 LYS  QD      3.88            #peak   785
 47 LYS  QB     48 VAL  HB      4.41            #peak   795
 47 LYS  QB     50 PHE  QD      5.34            #peak    67
 47 LYS  QG     47 LYS  QE      3.11            #peak   483
 47 LYS  QG     48 VAL  H       5.07            #peak   356
 49 ASP  H      49 ASP  QB      3.26            #peak   363
 49 ASP  QB     50 PHE  H       3.49            #peak   342
 50 PHE  HA     51 GLU  QG      4.48            #peak   750
 50 PHE  HB3    51 GLU  QG      5.21            #peak   862
 51 GLU  H      51 GLU  QB      3.39            #peak   370
 51 GLU  H      51 GLU  QG      3.94            #peak   369
 51 GLU  HA     51 GLU  QG      3.44            #peak   819
 51 GLU  QB     51 GLU  QG      2.23            #peak   831
 51 GLU  QB     52 ARG  H       4.43            #peak   385
 51 GLU  QG     52 ARG  H       5.34            #peak   388
 52 ARG  H      52 ARG  QB      3.49            #peak   386
 52 ARG  H      52 ARG  QG      4.65            #peak   387
 52 ARG  HA     52 ARG  QG      3.73            #peak   850
 52 ARG  HA     53 MET  QG      5.34            #peak   847
 52 ARG  QB     52 ARG  QD      2.99            #peak   249
 52 ARG  QG     53 MET  H       4.29            #peak   391
 53 MET  H      53 MET  QB      3.41            #peak   390
 53 MET  H      53 MET  QG      3.78            #peak   389
 53 MET  HA     53 MET  QG      3.42            #peak   903
 53 MET  HA     54 GLY  QA      4.52            #peak   886
 53 MET  QB     53 MET  QG      2.29            #peak   895
var info echo
echo:=off
info:=none
atom stereo "HB2  HB3     4"   # TYR
atom stereo "HB2  HB3    14"   # ASP
atom stereo "HG2  HG3    17"   # LYS
atom stereo "HG2  HG3    20"   # PRO
atom stereo "HD2  HD3    20"   # PRO
atom stereo "HB2  HB3    24"   # PHE
atom stereo "HB2  HB3    25"   # PRO
atom stereo "HB2  HB3    34"   # PRO
atom stereo "HD2  HD3    34"   # PRO
atom stereo "HB2  HB3    37"   # TRP
atom stereo "HG2  HG3    40"   # PRO
atom stereo "HD2  HD3    40"   # PRO
atom stereo "HB2  HB3    42"   # CYS
atom stereo "HB2  HB3    43"   # SER
atom stereo "HB2  HB3    45"   # ARG
atom stereo "QG1  QG2    48"   # VAL
atom stereo "HB2  HB3    50"   # PHE
unset info
print "    17 stereospecific assignments defined."
   2   THR  PHI    -137.4   -91.9
   2   THR  PSI     110.6   155.0
   3   ALA  PHI    -158.1  -104.0
   3   ALA  PSI     115.7   183.3
   4   TYR  PHI    -151.7  -111.7
   4   TYR  PSI     105.1   166.7
   5   ARG  PHI    -159.1  -102.0
   5   ARG  PSI     103.5   156.9
   6   CYS  PHI    -152.6   -64.6
   6   CYS  PSI      90.8   154.2
 #  7   PRO  PHI     -80.8   -40.8
 #  7   PRO  PSI     126.2   166.2
   8   VAL  PHI     -81.8   -41.5
   8   VAL  PSI     -53.6   -13.6
   9   CYS  PHI    -117.5   -42.7
   9   CYS  PSI     -57.3     2.0
  10   ASP  PHI    -155.2   -24.3
  10   ASP  PSI      95.7   159.8
  11   TYR  PHI    -160.0   -40.1
  11   TYR  PSI      97.5   155.8
  12   THR  PHI    -149.0  -109.0
  12   THR  PSI     105.4   162.8
  13   TYR  PHI    -148.0   -79.4
  13   TYR  PSI      99.9   140.4
  14   ASP  PHI    -151.9   -70.5
  14   ASP  PSI      68.1   166.8
  15   GLU  PHI     -78.7   -38.7
  15   GLU  PSI     -56.2   -16.2
  16   GLY  PHI     -94.0   -43.4
  16   GLY  PSI     -67.0    12.5
  17   LYS  PHI    -110.3   -61.0
  17   LYS  PSI     -48.6     2.1
#  20   PRO  PHI     -74.9   -34.9
#  20   PRO  PSI     -53.6   -13.6
  21   ARG  PHI     -84.3   -44.3
  21   ARG  PSI     -53.7    -1.9
  22   GLU  PHI    -117.9   -68.5
  22   GLU  PSI     -27.9    25.9
  23   GLY  PHI      46.5    96.8
  23   GLY  PSI       2.9    52.5
  24   PHE  PHI    -143.6   -62.2
  24   PHE  PSI      86.3   167.0
#  25   PRO  PHI     -82.7   -42.7
#  25   PRO  PSI     123.4   168.3
  26   ALA  PHI     -76.4   -36.4
  26   ALA  PSI     114.7   154.7
  27   GLY  PHI      74.9   114.9
  27   GLY  PSI     -39.4    22.5
  28   THR  PHI     -98.0   -52.0
  28   THR  PSI     109.0   149.0
  29   ARG  PHI    -150.8   -24.9
  29   ARG  PSI      85.1   192.2
  30   TRP  PHI     -78.7   -38.7
  30   TRP  PSI     -57.1    -7.0
  31   ASP  PHI     -92.6   -41.9
  31   ASP  PSI     -52.1    17.2
  32   GLN  PHI    -115.2   -63.5
  32   GLN  PSI     -38.1    15.8
  33   ILE  PHI    -147.4   -27.5
  33   ILE  PSI      79.1   170.8
#  34   PRO  PHI     -77.4   -37.4
#  34   PRO  PSI     125.4   166.6
  35   ASP  PHI     -79.2   -39.2
  35   ASP  PSI     -52.0     1.1
  36   ASP  PHI    -118.8   -78.8
  36   ASP  PSI     -23.1    29.7
  37   TRP  PHI     -92.9   -48.0
  37   TRP  PSI     116.1   156.1
  38   CYS  PHI    -158.2   -97.5
  38   CYS  PSI     122.3   179.2
  39   CYS  PHI    -181.4   -65.5
  39   CYS  PSI      99.3   167.0
#  40   PRO  PHI     -79.6   -39.6
#  40   PRO  PSI     124.6   164.6
  41   ASP  PHI     -87.1   -37.8
  41   ASP  PSI     -52.8   -12.8
  42   CYS  PHI     -80.6   -40.6
  42   CYS  PSI     -63.2   -23.2
  43   SER  PHI    -101.8   -50.6
  43   SER  PSI     -59.1   -19.1
  44   VAL  PHI    -135.5   -71.3
  44   VAL  PSI     -47.7    33.5
  45   ARG  PHI    -168.6  -104.6
  45   ARG  PSI     117.7   166.2
  46   GLU  PHI    -141.1   -37.6
  46   GLU  PSI     138.7   178.7
  47   LYS  PHI     -81.6   -39.3
  47   LYS  PSI     -60.9   -12.2
  48   VAL  PHI     -91.3   -50.3
  48   VAL  PSI     -48.0     4.6
  49   ASP  PHI    -117.2   -62.7
  49   ASP  PSI     -58.5   -11.0
  50   PHE  PHI    -123.9   -25.4
  50   PHE  PSI     115.1   171.1
  51   GLU  PHI    -149.7   -66.9
  51   GLU  PSI     108.5   166.8
  52   ARG  PHI     -99.9   -59.9
  52   ARG  PSI     104.7   144.7

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H        MET   1   1.522  -0.730   1.265
    2    HA   MET   1           HA       MET   1   1.240  -2.108  -1.243
    3    HB2  MET   1           1HB      MET   1   2.873   0.276  -0.378
    4    HB3  MET   1           2HB      MET   1   2.926  -0.373  -2.012
    5    HG2  MET   1           1HG      MET   1   1.376   1.276  -2.266
    6    HG3  MET   1           2HG      MET   1   0.330  -0.089  -1.881
    7    HE1  MET   1           3HE      MET   1   1.590   3.375  -0.945
    8    HE2  MET   1           1HE      MET   1  -0.060   3.292  -1.562
    9    HE3  MET   1           2HE      MET   1   0.237   3.847   0.085
   10    H    THR   2           H        THR   2   3.095  -2.829  -2.525
   11    HA   THR   2           HA       THR   2   4.926  -4.378  -0.868
   12    HB   THR   2           HB       THR   2   4.408  -4.468  -3.846
   13    HG1  THR   2           HG1      THR   2   2.764  -5.603  -3.136
   14   HG21  THR   2          3HG2      THR   2   5.640  -6.729  -3.527
   15   HG22  THR   2          1HG2      THR   2   6.308  -5.972  -2.082
   16   HG23  THR   2          2HG2      THR   2   6.592  -5.251  -3.666
   17    H    ALA   3           H        ALA   3   7.150  -4.255  -0.978
   18    HA   ALA   3           HA       ALA   3   8.379  -2.292  -2.747
   19    HB1  ALA   3           1HB      ALA   3   9.305  -2.042   0.030
   20    HB2  ALA   3           2HB      ALA   3   9.026  -0.802  -1.193
   21    HB3  ALA   3           3HB      ALA   3   7.670  -1.453  -0.272
   22    H    TYR   4           H        TYR   4   9.992  -3.347  -3.684
   23    HA   TYR   4           HA       TYR   4  11.543  -5.266  -2.073
   24    HB2  TYR   4           1HB      TYR   4  10.670  -5.348  -4.945
   25    HB3  TYR   4           2HB      TYR   4  12.092  -6.242  -4.420
   26    HD1  TYR   4           HD1      TYR   4  11.807  -7.943  -2.545
   27    HD2  TYR   4           HD2      TYR   4   8.519  -6.227  -4.629
   28    HE1  TYR   4           HE1      TYR   4  10.371  -9.792  -1.789
   29    HE2  TYR   4           HE2      TYR   4   7.074  -8.070  -3.878
   30    HH   TYR   4           HH       TYR   4   8.073 -10.880  -2.831
   31    H    ARG   5           H        ARG   5  13.346  -4.231  -1.478
   32    HA   ARG   5           HA       ARG   5  14.863  -2.807  -3.567
   33    HB2  ARG   5           1HB      ARG   5  14.059  -1.219  -1.926
   34    HB3  ARG   5           2HB      ARG   5  14.684  -2.206  -0.611
   35    HG2  ARG   5           1HG      ARG   5  16.736  -1.491  -2.537
   36    HG3  ARG   5           2HG      ARG   5  15.960  -0.084  -1.807
   37    HD2  ARG   5           1HD      ARG   5  16.317  -1.609   0.380
   38    HD3  ARG   5           2HD      ARG   5  17.683  -2.151  -0.594
   39    HE   ARG   5           HE       ARG   5  18.677  -0.104  -0.293
   40   HH11  ARG   5          1HH1      ARG   5  15.345   0.062   0.703
   41   HH12  ARG   5          2HH1      ARG   5  15.501   1.633   1.416
   42   HH21  ARG   5          1HH2      ARG   5  18.895   1.964   0.643
   43   HH22  ARG   5          2HH2      ARG   5  17.520   2.715   1.381
   44    H    CYS   6           H        CYS   6  16.558  -3.981  -4.157
   45    HA   CYS   6           HA       CYS   6  18.379  -4.996  -2.149
   46    HB2  CYS   6           1HB      CYS   6  16.732  -6.844  -2.507
   47    HB3  CYS   6           2HB      CYS   6  17.211  -6.888  -4.199
   48    HG   CYS   6           HG       CYS   6  19.973  -7.114  -2.564
   49    HA   PRO   7           HA       PRO   7  20.535  -3.245  -5.789
   50    HB2  PRO   7           1HB      PRO   7  22.583  -2.214  -4.336
   51    HB3  PRO   7           2HB      PRO   7  21.043  -1.374  -4.557
   52    HG2  PRO   7           1HG      PRO   7  21.996  -3.003  -2.233
   53    HG3  PRO   7           2HG      PRO   7  21.132  -1.455  -2.234
   54    HD2  PRO   7           1HD      PRO   7  19.888  -3.818  -1.783
   55    HD3  PRO   7           2HD      PRO   7  19.085  -2.455  -2.589
   56    H    VAL   8           H        VAL   8  21.204  -5.654  -3.506
   57    HA   VAL   8           HA       VAL   8  23.886  -6.280  -4.173
   58    HB   VAL   8           HB       VAL   8  21.764  -8.149  -3.110
   59   HG11  VAL   8          1HG1      VAL   8  24.680  -8.365  -3.552
   60   HG12  VAL   8          2HG1      VAL   8  24.054  -9.025  -2.039
   61   HG13  VAL   8          3HG1      VAL   8  23.431  -9.609  -3.583
   62   HG21  VAL   8          3HG2      VAL   8  22.828  -7.592  -0.890
   63   HG22  VAL   8          1HG2      VAL   8  23.624  -6.246  -1.704
   64   HG23  VAL   8          2HG2      VAL   8  21.864  -6.307  -1.618
   65    H    CYS   9           H        CYS   9  20.871  -6.875  -5.730
   66    HA   CYS   9           HA       CYS   9  22.209  -8.686  -7.631
   67    HB2  CYS   9           1HB      CYS   9  19.229  -8.586  -7.400
   68    HB3  CYS   9           2HB      CYS   9  20.265  -9.916  -7.901
   69    HG   CYS   9           HG       CYS   9  21.258 -10.137  -5.145
   70    H    ASP  10           H        ASP  10  19.643  -6.233  -7.372
   71    HA   ASP  10           HA       ASP  10  20.579  -4.958  -9.790
   72    HB2  ASP  10           1HB      ASP  10  18.489  -5.124 -11.010
   73    HB3  ASP  10           2HB      ASP  10  19.079  -6.743 -10.643
   74    H    TYR  11           H        TYR  11  19.407  -2.929 -10.232
   75    HA   TYR  11           HA       TYR  11  19.261  -1.251  -8.086
   76    HB2  TYR  11           1HB      TYR  11  17.950  -1.148 -10.784
   77    HB3  TYR  11           2HB      TYR  11  17.648   0.121  -9.602
   78    HD1  TYR  11           HD2      TYR  11  19.867   1.103  -8.496
   79    HD2  TYR  11           HD1      TYR  11  19.677  -0.834 -12.280
   80    HE1  TYR  11           HE2      TYR  11  21.944   2.234  -9.174
   81    HE2  TYR  11           HE1      TYR  11  21.753   0.290 -12.967
   82    HH   TYR  11           HH       TYR  11  23.841   1.313 -11.567
   83    H    THR  12           H        THR  12  17.464  -0.182  -7.028
   84    HA   THR  12           HA       THR  12  15.234  -2.042  -6.551
   85    HB   THR  12           HB       THR  12  16.367  -1.709  -4.508
   86    HG1  THR  12           HG1      THR  12  14.363   0.279  -4.311
   87   HG21  THR  12          3HG2      THR  12  16.848   0.572  -3.616
   88   HG22  THR  12          1HG2      THR  12  16.368   1.234  -5.177
   89   HG23  THR  12          2HG2      THR  12  17.766   0.165  -5.065
   90    H    TYR  13           H        TYR  13  13.174  -1.424  -6.885
   91    HA   TYR  13           HA       TYR  13  12.518   1.393  -7.205
   92    HB2  TYR  13           1HB      TYR  13  11.963  -0.621  -9.393
   93    HB3  TYR  13           2HB      TYR  13  11.456   1.065  -9.385
   94    HD1  TYR  13           HD2      TYR  13  13.404   2.814  -9.153
   95    HD2  TYR  13           HD1      TYR  13  13.928  -1.197 -10.473
   96    HE1  TYR  13           HE2      TYR  13  15.511   3.456 -10.248
   97    HE2  TYR  13           HE1      TYR  13  16.037  -0.567 -11.571
   98    HH   TYR  13           HH       TYR  13  17.077   1.525 -12.496
   99    H    ASP  14           H        ASP  14  10.944   1.561  -5.745
  100    HA   ASP  14           HA       ASP  14   9.191  -0.568  -5.046
  101    HB2  ASP  14           1HB      ASP  14   9.775   1.171  -3.434
  102    HB3  ASP  14           2HB      ASP  14   9.012   2.393  -4.448
  103    H    GLU  15           H        GLU  15   6.867  -0.581  -5.267
  104    HA   GLU  15           HA       GLU  15   5.973  -0.336  -7.878
  105    HB2  GLU  15           1HB      GLU  15   4.949  -1.377  -5.563
  106    HB3  GLU  15           2HB      GLU  15   3.873  -0.017  -5.848
  107    HG2  GLU  15           1HG      GLU  15   4.380  -1.605  -8.236
  108    HG3  GLU  15           2HG      GLU  15   3.622  -2.516  -6.930
  109    H    GLY  16           H        GLY  16   5.426   1.874  -5.142
  110    HA2  GLY  16           1HA      GLY  16   4.154   3.811  -6.904
  111    HA3  GLY  16           2HA      GLY  16   4.345   3.951  -5.162
  112    H    LYS  17           H        LYS  17   7.203   3.039  -6.727
  113    HA   LYS  17           HA       LYS  17   8.521   5.452  -6.008
  114    HB2  LYS  17           1HB      LYS  17   9.431   2.999  -6.304
  115    HB3  LYS  17           2HB      LYS  17   9.708   3.521  -7.960
  116    HG2  LYS  17           1HG      LYS  17  11.731   3.945  -6.921
  117    HG3  LYS  17           2HG      LYS  17  10.933   5.520  -6.899
  118    HD2  LYS  17           1HD      LYS  17  10.174   5.048  -4.585
  119    HD3  LYS  17           2HD      LYS  17  11.099   3.545  -4.623
  120    HE2  LYS  17           1HE      LYS  17  12.200   6.339  -4.905
  121    HE3  LYS  17           2HE      LYS  17  12.358   5.290  -3.498
  122    HZ1  LYS  17           3HZ      LYS  17  13.884   5.326  -5.922
  123    HZ2  LYS  17           1HZ      LYS  17  13.320   3.777  -5.540
  124    HZ3  LYS  17           2HZ      LYS  17  14.257   4.635  -4.423
  125    H    GLY  18           H        GLY  18   7.475   4.072  -9.103
  126    HA2  GLY  18           1HA      GLY  18   6.867   5.195 -11.038
  127    HA3  GLY  18           2HA      GLY  18   7.262   6.712 -10.243
  128    H    ASP  19           H        ASP  19   8.851   3.811 -11.563
  129    HA   ASP  19           HA       ASP  19  10.978   5.579 -12.583
  130    HB2  ASP  19           1HB      ASP  19  11.120   3.028 -11.103
  131    HB3  ASP  19           2HB      ASP  19  12.194   3.149 -12.493
  132    HA   PRO  20           HA       PRO  20   8.864   3.564 -16.177
  133    HB2  PRO  20           1HB      PRO  20   8.851   5.803 -17.712
  134    HB3  PRO  20           2HB      PRO  20   7.581   5.436 -16.539
  135    HG2  PRO  20           1HG      PRO  20   9.937   7.263 -16.271
  136    HG3  PRO  20           2HG      PRO  20   8.257   7.521 -15.765
  137    HD2  PRO  20           1HD      PRO  20  10.204   6.789 -14.031
  138    HD3  PRO  20           2HD      PRO  20   8.513   6.281 -13.839
  139    H    ARG  21           H        ARG  21  11.850   5.025 -15.524
  140    HA   ARG  21           HA       ARG  21  13.001   4.932 -18.126
  141    HB2  ARG  21           1HB      ARG  21  14.056   5.240 -15.344
  142    HB3  ARG  21           2HB      ARG  21  15.180   4.884 -16.648
  143    HG2  ARG  21           1HG      ARG  21  15.197   7.209 -16.464
  144    HG3  ARG  21           2HG      ARG  21  14.158   6.882 -17.853
  145    HD2  ARG  21           1HD      ARG  21  12.221   7.414 -16.688
  146    HD3  ARG  21           2HD      ARG  21  12.982   7.171 -15.117
  147    HE   ARG  21           HE       ARG  21  12.938   9.581 -16.654
  148   HH11  ARG  21          1HH1      ARG  21  14.765   7.752 -14.322
  149   HH12  ARG  21          2HH1      ARG  21  15.563   9.142 -13.663
  150   HH21  ARG  21          1HH2      ARG  21  13.982  11.418 -15.795
  151   HH22  ARG  21          2HH2      ARG  21  15.116  11.227 -14.501
  152    H    GLU  22           H        GLU  22  12.495   2.603 -15.610
  153    HA   GLU  22           HA       GLU  22  14.305   0.685 -16.875
  154    HB2  GLU  22           1HB      GLU  22  13.704   1.177 -14.231
  155    HB3  GLU  22           2HB      GLU  22  12.746  -0.254 -14.583
  156    HG2  GLU  22           1HG      GLU  22  14.982  -1.125 -15.622
  157    HG3  GLU  22           2HG      GLU  22  15.700   0.095 -14.571
  158    H    GLY  23           H        GLY  23  11.700   1.616 -18.030
  159    HA2  GLY  23           1HA      GLY  23  10.110   0.618 -19.368
  160    HA3  GLY  23           2HA      GLY  23  10.806  -0.940 -18.945
  161    H    PHE  24           H        PHE  24   9.996   0.934 -16.241
  162    HA   PHE  24           HA       PHE  24   7.365  -0.356 -16.012
  163    HB2  PHE  24           1HB      PHE  24   9.296  -0.152 -13.702
  164    HB3  PHE  24           2HB      PHE  24   7.792  -1.065 -13.777
  165    HD1  PHE  24           HD1      PHE  24   7.801  -2.751 -15.930
  166    HD2  PHE  24           HD2      PHE  24  11.193  -1.420 -13.731
  167    HE1  PHE  24           HE1      PHE  24   9.047  -4.746 -16.651
  168    HE2  PHE  24           HE2      PHE  24  12.445  -3.413 -14.449
  169    HZ   PHE  24           HZ       PHE  24  11.372  -5.079 -15.912
  170    HA   PRO  25           HA       PRO  25   6.947   4.140 -15.158
  171    HB2  PRO  25           1HB      PRO  25   4.489   4.338 -16.293
  172    HB3  PRO  25           2HB      PRO  25   5.988   4.441 -17.224
  173    HG2  PRO  25           1HG      PRO  25   4.145   2.111 -16.852
  174    HG3  PRO  25           2HG      PRO  25   4.944   2.681 -18.329
  175    HD2  PRO  25           1HD      PRO  25   5.870   0.584 -16.888
  176    HD3  PRO  25           2HD      PRO  25   6.945   1.676 -17.784
  177    H    ALA  26           H        ALA  26   4.914   5.268 -14.194
  178    HA   ALA  26           HA       ALA  26   4.391   4.243 -11.688
  179    HB1  ALA  26           1HB      ALA  26   3.063   6.305 -13.378
  180    HB2  ALA  26           2HB      ALA  26   2.286   5.799 -11.878
  181    HB3  ALA  26           3HB      ALA  26   3.912   6.480 -11.842
  182    H    GLY  27           H        GLY  27   2.862   2.946 -10.781
  183    HA2  GLY  27           1HA      GLY  27   0.816   1.770 -10.694
  184    HA3  GLY  27           2HA      GLY  27   0.639   1.997 -12.428
  185    H    THR  28           H        THR  28   3.345   1.091 -13.028
  186    HA   THR  28           HA       THR  28   2.873  -1.584 -13.555
  187    HB   THR  28           HB       THR  28   5.583  -0.295 -13.183
  188    HG1  THR  28           HG1      THR  28   4.290  -0.671 -15.665
  189   HG21  THR  28          3HG2      THR  28   4.734  -2.749 -14.726
  190   HG22  THR  28          1HG2      THR  28   5.717  -2.725 -13.263
  191   HG23  THR  28          2HG2      THR  28   6.344  -2.031 -14.759
  192    H    ARG  29           H        ARG  29   2.443  -3.103 -12.088
  193    HA   ARG  29           HA       ARG  29   3.390  -3.036  -9.412
  194    HB2  ARG  29           1HB      ARG  29   2.278  -5.436 -10.866
  195    HB3  ARG  29           2HB      ARG  29   2.278  -5.140  -9.133
  196    HG2  ARG  29           1HG      ARG  29   0.774  -3.479 -11.142
  197    HG3  ARG  29           2HG      ARG  29   0.076  -4.803 -10.207
  198    HD2  ARG  29           1HD      ARG  29   1.129  -3.407  -8.201
  199    HD3  ARG  29           2HD      ARG  29   0.900  -2.087  -9.347
  200    HE   ARG  29           HE       ARG  29  -1.122  -3.420  -7.861
  201   HH11  ARG  29          1HH1      ARG  29  -0.475  -1.893 -10.922
  202   HH12  ARG  29          2HH1      ARG  29  -2.128  -1.454 -11.200
  203   HH21  ARG  29          1HH2      ARG  29  -3.301  -2.848  -8.215
  204   HH22  ARG  29          2HH2      ARG  29  -3.735  -1.996  -9.659
  205    H    TRP  30           H        TRP  30   4.850  -4.450  -8.372
  206    HA   TRP  30           HA       TRP  30   7.282  -4.851  -9.665
  207    HB2  TRP  30           1HB      TRP  30   7.838  -6.309  -7.689
  208    HB3  TRP  30           2HB      TRP  30   7.232  -4.708  -7.276
  209    HD1  TRP  30           HD1      TRP  30   4.864  -4.561  -6.071
  210    HE1  TRP  30           HE1      TRP  30   3.411  -6.322  -4.883
  211    HE3  TRP  30           HE3      TRP  30   7.161  -8.796  -7.781
  212    HZ2  TRP  30           HZ2      TRP  30   3.259  -9.134  -4.694
  213    HZ3  TRP  30           HZ3      TRP  30   6.300 -10.982  -7.049
  214    HH2  TRP  30           HH2      TRP  30   4.390 -11.145  -5.537
  215    H    ASP  31           H        ASP  31   4.483  -6.906  -9.428
  216    HA   ASP  31           HA       ASP  31   5.740  -9.340 -10.170
  217    HB2  ASP  31           1HB      ASP  31   3.444 -10.127 -10.646
  218    HB3  ASP  31           2HB      ASP  31   3.565  -9.337  -9.076
  219    H    GLN  32           H        GLN  32   4.887  -6.539 -11.920
  220    HA   GLN  32           HA       GLN  32   4.358  -7.636 -14.456
  221    HB2  GLN  32           1HB      GLN  32   5.593  -4.966 -13.760
  222    HB3  GLN  32           2HB      GLN  32   4.920  -5.401 -15.325
  223    HG2  GLN  32           1HG      GLN  32   3.294  -5.455 -12.804
  224    HG3  GLN  32           2HG      GLN  32   3.466  -4.008 -13.795
  225   HE21  GLN  32          2HE2      GLN  32   1.126  -5.710 -13.150
  226   HE22  GLN  32          1HE2      GLN  32   0.457  -6.157 -14.678
  227    H    ILE  33           H        ILE  33   7.362  -6.760 -12.837
  228    HA   ILE  33           HA       ILE  33   9.087  -7.019 -15.040
  229    HB   ILE  33           HB       ILE  33   9.714  -7.544 -12.132
  230   HG12  ILE  33          1HG1      ILE  33  10.702  -5.040 -13.017
  231   HG13  ILE  33          2HG1      ILE  33   9.018  -5.132 -13.523
  232   HG21  ILE  33          1HG2      ILE  33  11.389  -8.420 -13.716
  233   HG22  ILE  33          2HG2      ILE  33  11.554  -6.805 -14.403
  234   HG23  ILE  33          3HG2      ILE  33  12.016  -7.101 -12.727
  235   HD11  ILE  33          3HD1      ILE  33   9.610  -5.947 -10.750
  236   HD12  ILE  33          1HD1      ILE  33   9.783  -4.235 -11.134
  237   HD13  ILE  33          2HD1      ILE  33   8.242  -5.049 -11.408
  238    HA   PRO  34           HA       PRO  34   8.997 -11.391 -15.708
  239    HB2  PRO  34           1HB      PRO  34  11.175 -11.538 -17.323
  240    HB3  PRO  34           2HB      PRO  34   9.616 -10.908 -17.868
  241    HG2  PRO  34           1HG      PRO  34  12.054  -9.418 -16.975
  242    HG3  PRO  34           2HG      PRO  34  10.979  -9.086 -18.346
  243    HD2  PRO  34           1HD      PRO  34  10.818  -7.731 -16.007
  244    HD3  PRO  34           2HD      PRO  34   9.398  -8.060 -17.020
  245    H    ASP  35           H        ASP  35   9.739 -13.020 -14.505
  246    HA   ASP  35           HA       ASP  35  11.803 -12.672 -12.605
  247    HB2  ASP  35           1HB      ASP  35  10.281 -15.093 -13.560
  248    HB3  ASP  35           2HB      ASP  35  11.533 -15.202 -12.325
  249    H    ASP  36           H        ASP  36  11.891 -13.438 -15.897
  250    HA   ASP  36           HA       ASP  36  14.446 -14.846 -15.710
  251    HB2  ASP  36           1HB      ASP  36  12.588 -14.284 -18.023
  252    HB3  ASP  36           2HB      ASP  36  14.176 -15.019 -18.225
  253    H    TRP  37           H        TRP  37  14.088 -11.969 -15.053
  254    HA   TRP  37           HA       TRP  37  15.161 -10.362 -17.108
  255    HB2  TRP  37           1HB      TRP  37  13.980  -9.489 -15.097
  256    HB3  TRP  37           2HB      TRP  37  15.377  -9.933 -14.121
  257    HD1  TRP  37           HD1      TRP  37  17.673  -8.524 -14.585
  258    HE1  TRP  37           HE1      TRP  37  18.000  -6.113 -15.424
  259    HE3  TRP  37           HE3      TRP  37  13.038  -7.726 -16.588
  260    HZ2  TRP  37           HZ2      TRP  37  16.492  -4.135 -16.758
  261    HZ3  TRP  37           HZ3      TRP  37  12.561  -5.547 -17.626
  262    HH2  TRP  37           HH2      TRP  37  14.254  -3.789 -17.708
  263    H    CYS  38           H        CYS  38  17.255  -9.604 -17.464
  264    HA   CYS  38           HA       CYS  38  19.369 -11.320 -16.348
  265    HB2  CYS  38           1HB      CYS  38  19.088  -9.928 -19.002
  266    HB3  CYS  38           2HB      CYS  38  20.654 -10.478 -18.419
  267    HG   CYS  38           HG       CYS  38  18.268 -12.188 -19.906
  268    H    CYS  39           H        CYS  39  20.750 -10.417 -14.982
  269    HA   CYS  39           HA       CYS  39  21.378  -7.565 -15.260
  270    HB2  CYS  39           1HB      CYS  39  20.021  -8.863 -13.018
  271    HB3  CYS  39           2HB      CYS  39  21.452  -7.966 -12.526
  272    HG   CYS  39           HG       CYS  39  18.478  -6.829 -13.136
  273    HA   PRO  40           HA       PRO  40  25.568  -8.694 -14.634
  274    HB2  PRO  40           1HB      PRO  40  26.523  -6.631 -13.151
  275    HB3  PRO  40           2HB      PRO  40  26.105  -6.472 -14.861
  276    HG2  PRO  40           1HG      PRO  40  24.514  -5.706 -12.444
  277    HG3  PRO  40           2HG      PRO  40  24.750  -4.812 -13.957
  278    HD2  PRO  40           1HD      PRO  40  22.509  -6.241 -13.444
  279    HD3  PRO  40           2HD      PRO  40  23.165  -6.050 -15.082
  280    H    ASP  41           H        ASP  41  24.190  -7.406 -11.603
  281    HA   ASP  41           HA       ASP  41  25.904  -9.095 -10.006
  282    HB2  ASP  41           1HB      ASP  41  24.701  -6.682  -9.553
  283    HB3  ASP  41           2HB      ASP  41  23.639  -7.775  -8.670
  284    H    CYS  42           H        CYS  42  22.387  -8.796 -10.499
  285    HA   CYS  42           HA       CYS  42  21.587 -10.953  -8.949
  286    HB2  CYS  42           1HB      CYS  42  20.105  -9.222 -10.037
  287    HB3  CYS  42           2HB      CYS  42  20.278 -10.118 -11.541
  288    HG   CYS  42           HG       CYS  42  18.097 -10.559  -9.191
  289    H    SER  43           H        SER  43  23.186 -10.914 -11.996
  290    HA   SER  43           HA       SER  43  22.426 -13.278 -13.181
  291    HB2  SER  43           1HB      SER  43  23.937 -12.273 -14.546
  292    HB3  SER  43           2HB      SER  43  24.863 -11.611 -13.198
  293    HG   SER  43           HG       SER  43  25.940 -13.277 -14.472
  294    H    VAL  44           H        VAL  44  24.419 -12.791 -10.359
  295    HA   VAL  44           HA       VAL  44  24.821 -15.704 -10.157
  296    HB   VAL  44           HB       VAL  44  26.386 -13.568  -8.708
  297   HG11  VAL  44          1HG1      VAL  44  27.884 -15.896  -8.926
  298   HG12  VAL  44          2HG1      VAL  44  27.063 -15.299  -7.482
  299   HG13  VAL  44          3HG1      VAL  44  26.256 -16.453  -8.544
  300   HG21  VAL  44          3HG2      VAL  44  27.023 -13.197 -10.904
  301   HG22  VAL  44          1HG2      VAL  44  28.208 -14.387 -10.367
  302   HG23  VAL  44          2HG2      VAL  44  26.836 -14.892 -11.353
  303    H    ARG  45           H        ARG  45  23.301 -12.974  -8.768
  304    HA   ARG  45           HA       ARG  45  22.787 -14.415  -6.260
  305    HB2  ARG  45           1HB      ARG  45  22.558 -11.507  -7.016
  306    HB3  ARG  45           2HB      ARG  45  21.847 -12.149  -5.542
  307    HG2  ARG  45           1HG      ARG  45  23.899 -11.289  -4.864
  308    HG3  ARG  45           2HG      ARG  45  24.189 -13.024  -5.010
  309    HD2  ARG  45           1HD      ARG  45  25.297 -12.745  -7.094
  310    HD3  ARG  45           2HD      ARG  45  24.784 -11.062  -7.214
  311    HE   ARG  45           HE       ARG  45  26.285 -11.299  -4.889
  312   HH11  ARG  45          1HH1      ARG  45  26.743 -11.642  -8.323
  313   HH12  ARG  45          2HH1      ARG  45  28.414 -11.186  -8.277
  314   HH21  ARG  45          1HH2      ARG  45  28.483 -10.698  -4.816
  315   HH22  ARG  45          2HH2      ARG  45  29.403 -10.650  -6.282
  316    H    GLU  46           H        GLU  46  20.895 -15.387  -5.988
  317    HA   GLU  46           HA       GLU  46  18.901 -15.559  -7.888
  318    HB2  GLU  46           1HB      GLU  46  18.974 -16.084  -4.942
  319    HB3  GLU  46           2HB      GLU  46  17.441 -16.182  -5.795
  320    HG2  GLU  46           1HG      GLU  46  19.816 -17.666  -6.823
  321    HG3  GLU  46           2HG      GLU  46  18.881 -18.310  -5.474
  322    H    LYS  47           H        LYS  47  16.679 -14.792  -7.846
  323    HA   LYS  47           HA       LYS  47  16.574 -11.950  -7.393
  324    HB2  LYS  47           1HB      LYS  47  15.561 -13.033  -9.389
  325    HB3  LYS  47           2HB      LYS  47  14.394 -13.821  -8.336
  326    HG2  LYS  47           1HG      LYS  47  13.098 -12.067  -8.814
  327    HG3  LYS  47           2HG      LYS  47  14.084 -11.218  -7.621
  328    HD2  LYS  47           1HD      LYS  47  15.230 -10.043  -9.204
  329    HD3  LYS  47           2HD      LYS  47  15.099 -11.327 -10.408
  330    HE2  LYS  47           1HE      LYS  47  12.581 -10.008  -9.593
  331    HE3  LYS  47           2HE      LYS  47  13.710  -9.036 -10.535
  332    HZ1  LYS  47           3HZ      LYS  47  13.629 -11.450 -11.821
  333    HZ2  LYS  47           1HZ      LYS  47  12.857 -10.027 -12.312
  334    HZ3  LYS  47           2HZ      LYS  47  12.019 -11.168 -11.385
  335    H    VAL  48           H        VAL  48  15.470 -14.816  -5.782
  336    HA   VAL  48           HA       VAL  48  13.494 -13.540  -4.154
  337    HB   VAL  48           HB       VAL  48  13.504 -15.986  -4.657
  338   HG11  VAL  48          1HG1      VAL  48  15.532 -16.357  -2.499
  339   HG12  VAL  48          2HG1      VAL  48  15.052 -17.456  -3.794
  340   HG13  VAL  48          3HG1      VAL  48  16.068 -16.059  -4.152
  341   HG21  VAL  48          3HG2      VAL  48  12.145 -16.130  -2.906
  342   HG22  VAL  48          1HG2      VAL  48  13.524 -16.222  -1.811
  343   HG23  VAL  48          2HG2      VAL  48  12.854 -14.652  -2.255
  344    H    ASP  49           H        ASP  49  16.829 -13.414  -4.165
  345    HA   ASP  49           HA       ASP  49  17.466 -13.471  -1.425
  346    HB2  ASP  49           1HB      ASP  49  19.021 -13.445  -3.509
  347    HB3  ASP  49           2HB      ASP  49  18.899 -11.693  -3.377
  348    H    PHE  50           H        PHE  50  15.771 -11.178  -3.305
  349    HA   PHE  50           HA       PHE  50  16.338  -8.760  -2.103
  350    HB2  PHE  50           1HB      PHE  50  13.911  -9.912  -3.397
  351    HB3  PHE  50           2HB      PHE  50  13.739  -8.396  -2.518
  352    HD1  PHE  50           HD1      PHE  50  16.071  -9.941  -4.991
  353    HD2  PHE  50           HD2      PHE  50  13.948  -6.471  -3.737
  354    HE1  PHE  50           HE1      PHE  50  16.924  -8.716  -6.947
  355    HE2  PHE  50           HE2      PHE  50  14.796  -5.241  -5.692
  356    HZ   PHE  50           HZ       PHE  50  16.285  -6.364  -7.301
  357    H    GLU  51           H        GLU  51  14.811  -7.534  -0.611
  358    HA   GLU  51           HA       GLU  51  13.693  -9.218   1.503
  359    HB2  GLU  51           1HB      GLU  51  16.002  -7.350   1.775
  360    HB3  GLU  51           2HB      GLU  51  14.848  -7.440   3.099
  361    HG2  GLU  51           1HG      GLU  51  16.105  -9.905   1.953
  362    HG3  GLU  51           2HG      GLU  51  16.913  -8.942   3.188
  363    H    ARG  52           H        ARG  52  11.639  -8.569   1.524
  364    HA   ARG  52           HA       ARG  52  10.701  -6.061   0.695
  365    HB2  ARG  52           1HB      ARG  52   9.276  -8.051   0.780
  366    HB3  ARG  52           2HB      ARG  52   9.391  -8.072   2.534
  367    HG2  ARG  52           1HG      ARG  52   8.338  -5.774   2.501
  368    HG3  ARG  52           2HG      ARG  52   7.997  -6.063   0.793
  369    HD2  ARG  52           1HD      ARG  52   6.042  -6.712   1.915
  370    HD3  ARG  52           2HD      ARG  52   6.878  -8.221   1.551
  371    HE   ARG  52           HE       ARG  52   7.746  -7.611   4.042
  372   HH11  ARG  52          1HH1      ARG  52   4.590  -7.898   2.600
  373   HH12  ARG  52          2HH1      ARG  52   3.824  -8.411   4.067
  374   HH21  ARG  52          1HH2      ARG  52   6.748  -8.285   5.979
  375   HH22  ARG  52          2HH2      ARG  52   5.052  -8.630   5.988
  376    H    MET  53           H        MET  53  10.293  -4.176   1.732
  377    HA   MET  53           HA       MET  53  11.510  -3.808   4.330
  378    HB2  MET  53           1HB      MET  53  10.420  -2.008   2.211
  379    HB3  MET  53           2HB      MET  53  10.577  -1.384   3.847
  380    HG2  MET  53           1HG      MET  53  12.862  -2.691   2.411
  381    HG3  MET  53           2HG      MET  53  12.503  -0.973   2.249
  382    HE1  MET  53           3HE      MET  53  15.552  -0.661   4.273
  383    HE2  MET  53           1HE      MET  53  15.498  -2.409   4.042
  384    HE3  MET  53           2HE      MET  53  15.005  -1.331   2.736
  385    H    GLY  54           H        GLY  54  10.225  -2.194   5.823
  386    HA2  GLY  54           1HA      GLY  54   7.374  -2.570   5.884
  387    HA3  GLY  54           2HA      GLY  54   8.214  -3.530   7.093
  388    H    GLY  55           H        GLY  55   7.942  -0.195   5.883
  389    HA2  GLY  55           1HA      GLY  55   8.546   0.740   8.616
  390    HA3  GLY  55           2HA      GLY  55   8.800   1.684   7.155
  391    H    LYS  56           H        LYS  56   7.561   3.152   8.778
  392    HA   LYS  56           HA       LYS  56   4.668   2.740   8.563
  393    HB2  LYS  56           1HB      LYS  56   4.536   4.639  10.186
  394    HB3  LYS  56           2HB      LYS  56   5.401   3.233  10.794
  395    HG2  LYS  56           1HG      LYS  56   7.456   4.291  10.697
  396    HG3  LYS  56           2HG      LYS  56   6.897   5.489   9.527
  397    HD2  LYS  56           1HD      LYS  56   5.322   6.273  11.411
  398    HD3  LYS  56           2HD      LYS  56   6.383   5.352  12.479
  399    HE2  LYS  56           1HE      LYS  56   7.142   7.615  12.468
  400    HE3  LYS  56           2HE      LYS  56   8.307   6.653  11.559
  401    HZ1  LYS  56           3HZ      LYS  56   6.284   7.664   9.848
  402    HZ2  LYS  56           1HZ      LYS  56   7.959   7.889   9.770
  403    HZ3  LYS  56           2HZ      LYS  56   7.009   8.928  10.706
  Start of MODEL    2
    1    H1   MET   1           H        MET   1   1.343  -0.934   0.512
    2    HA   MET   1           HA       MET   1   1.108  -1.206  -2.391
    3    HB2  MET   1           1HB      MET   1   2.726   0.635  -2.737
    4    HB3  MET   1           2HB      MET   1   1.208   1.188  -2.044
    5    HG2  MET   1           1HG      MET   1   2.618   2.322  -0.699
    6    HG3  MET   1           2HG      MET   1   2.551   0.816   0.213
    7    HE1  MET   1           3HE      MET   1   4.211   3.340  -1.531
    8    HE2  MET   1           1HE      MET   1   5.773   3.186  -0.725
    9    HE3  MET   1           2HE      MET   1   5.590   2.663  -2.400
   10    H    THR   2           H        THR   2   3.028  -1.940  -3.428
   11    HA   THR   2           HA       THR   2   4.705  -3.535  -1.655
   12    HB   THR   2           HB       THR   2   4.492  -3.528  -4.672
   13    HG1  THR   2           HG1      THR   2   2.899  -4.866  -4.323
   14   HG21  THR   2          3HG2      THR   2   6.126  -5.190  -2.769
   15   HG22  THR   2          1HG2      THR   2   6.670  -4.290  -4.184
   16   HG23  THR   2          2HG2      THR   2   5.707  -5.754  -4.387
   17    H    ALA   3           H        ALA   3   6.907  -3.351  -1.488
   18    HA   ALA   3           HA       ALA   3   8.360  -1.467  -3.140
   19    HB1  ALA   3           1HB      ALA   3   9.120  -0.059  -1.349
   20    HB2  ALA   3           2HB      ALA   3   7.356  -0.065  -1.354
   21    HB3  ALA   3           3HB      ALA   3   8.238  -1.020  -0.161
   22    H    TYR   4           H        TYR   4  10.128  -2.554  -3.676
   23    HA   TYR   4           HA       TYR   4  11.476  -4.157  -1.605
   24    HB2  TYR   4           1HB      TYR   4  10.861  -4.823  -4.462
   25    HB3  TYR   4           2HB      TYR   4  12.278  -5.523  -3.689
   26    HD1  TYR   4           HD1      TYR   4   8.590  -5.283  -3.507
   27    HD2  TYR   4           HD2      TYR   4  12.073  -7.321  -2.159
   28    HE1  TYR   4           HE1      TYR   4   7.175  -7.032  -2.512
   29    HE2  TYR   4           HE2      TYR   4  10.668  -9.076  -1.162
   30    HH   TYR   4           HH       TYR   4   8.566  -9.649  -0.591
   31    H    ARG   5           H        ARG   5  13.697  -4.066  -1.521
   32    HA   ARG   5           HA       ARG   5  15.112  -2.448  -3.499
   33    HB2  ARG   5           1HB      ARG   5  14.437  -0.857  -1.766
   34    HB3  ARG   5           2HB      ARG   5  15.167  -1.875  -0.531
   35    HG2  ARG   5           1HG      ARG   5  16.932  -1.019  -2.736
   36    HG3  ARG   5           2HG      ARG   5  16.396   0.235  -1.616
   37    HD2  ARG   5           1HD      ARG   5  17.088  -1.803   0.075
   38    HD3  ARG   5           2HD      ARG   5  18.275  -1.972  -1.218
   39    HE   ARG   5           HE       ARG   5  18.205   0.056   0.764
   40   HH11  ARG   5          1HH1      ARG   5  18.973  -0.511  -2.584
   41   HH12  ARG   5          2HH1      ARG   5  20.128   0.777  -2.672
   42   HH21  ARG   5          1HH2      ARG   5  19.724   1.754   0.661
   43   HH22  ARG   5          2HH2      ARG   5  20.556   2.064  -0.825
   44    H    CYS   6           H        CYS   6  16.607  -3.839  -4.184
   45    HA   CYS   6           HA       CYS   6  18.508  -4.913  -2.282
   46    HB2  CYS   6           1HB      CYS   6  16.383  -6.533  -3.233
   47    HB3  CYS   6           2HB      CYS   6  17.849  -7.081  -4.036
   48    HG   CYS   6           HG       CYS   6  19.148  -7.948  -1.875
   49    HA   PRO   7           HA       PRO   7  20.495  -3.491  -6.150
   50    HB2  PRO   7           1HB      PRO   7  22.743  -2.607  -4.910
   51    HB3  PRO   7           2HB      PRO   7  21.270  -1.638  -5.036
   52    HG2  PRO   7           1HG      PRO   7  22.270  -3.275  -2.738
   53    HG3  PRO   7           2HG      PRO   7  21.549  -1.655  -2.727
   54    HD2  PRO   7           1HD      PRO   7  20.145  -3.880  -2.085
   55    HD3  PRO   7           2HD      PRO   7  19.399  -2.475  -2.874
   56    H    VAL   8           H        VAL   8  21.146  -5.877  -3.836
   57    HA   VAL   8           HA       VAL   8  23.697  -6.770  -4.617
   58    HB   VAL   8           HB       VAL   8  22.503  -7.492  -2.547
   59   HG11  VAL   8          1HG1      VAL   8  20.767  -9.049  -2.565
   60   HG12  VAL   8          2HG1      VAL   8  20.341  -7.936  -3.866
   61   HG13  VAL   8          3HG1      VAL   8  21.063  -9.501  -4.243
   62   HG21  VAL   8          3HG2      VAL   8  23.057 -10.105  -3.591
   63   HG22  VAL   8          1HG2      VAL   8  24.234  -8.948  -4.212
   64   HG23  VAL   8          2HG2      VAL   8  24.007  -9.127  -2.472
   65    H    CYS   9           H        CYS   9  20.632  -7.004  -6.147
   66    HA   CYS   9           HA       CYS   9  21.740  -8.925  -8.088
   67    HB2  CYS   9           1HB      CYS   9  19.165  -9.247  -8.575
   68    HB3  CYS   9           2HB      CYS   9  19.953 -10.120  -7.267
   69    HG   CYS   9           HG       CYS   9  17.953  -9.466  -5.760
   70    H    ASP  10           H        ASP  10  19.385  -6.271  -7.768
   71    HA   ASP  10           HA       ASP  10  20.429  -5.014 -10.150
   72    HB2  ASP  10           1HB      ASP  10  18.372  -5.020 -11.411
   73    HB3  ASP  10           2HB      ASP  10  18.796  -6.687 -11.027
   74    H    TYR  11           H        TYR  11  19.432  -2.892 -10.544
   75    HA   TYR  11           HA       TYR  11  19.358  -1.279  -8.335
   76    HB2  TYR  11           1HB      TYR  11  17.977  -0.894 -10.995
   77    HB3  TYR  11           2HB      TYR  11  18.130   0.372  -9.782
   78    HD1  TYR  11           HD1      TYR  11  20.365   1.279  -9.218
   79    HD2  TYR  11           HD2      TYR  11  19.819  -1.506 -12.387
   80    HE1  TYR  11           HE1      TYR  11  22.572   1.883 -10.121
   81    HE2  TYR  11           HE2      TYR  11  22.025  -0.911 -13.298
   82    HH   TYR  11           HH       TYR  11  23.594   1.674 -12.773
   83    H    THR  12           H        THR  12  17.630  -0.116  -7.284
   84    HA   THR  12           HA       THR  12  15.213  -1.771  -7.000
   85    HB   THR  12           HB       THR  12  16.319  -1.664  -4.906
   86    HG1  THR  12           HG1      THR  12  13.964  -1.008  -5.054
   87   HG21  THR  12          3HG2      THR  12  16.495   0.946  -4.072
   88   HG22  THR  12          1HG2      THR  12  16.972   1.054  -5.766
   89   HG23  THR  12          2HG2      THR  12  17.837  -0.027  -4.673
   90    H    TYR  13           H        TYR  13  13.212  -0.903  -7.245
   91    HA   TYR  13           HA       TYR  13  12.896   1.978  -7.505
   92    HB2  TYR  13           1HB      TYR  13  12.045   0.107  -9.723
   93    HB3  TYR  13           2HB      TYR  13  11.828   1.853  -9.684
   94    HD1  TYR  13           HD2      TYR  13  13.970   3.290  -9.572
   95    HD2  TYR  13           HD1      TYR  13  13.951  -0.813 -10.698
   96    HE1  TYR  13           HE2      TYR  13  16.147   3.590 -10.676
   97    HE2  TYR  13           HE1      TYR  13  16.129  -0.525 -11.804
   98    HH   TYR  13           HH       TYR  13  17.418   1.454 -12.846
   99    H    ASP  14           H        ASP  14  11.446   2.176  -5.894
  100    HA   ASP  14           HA       ASP  14   9.390   0.284  -5.363
  101    HB2  ASP  14           1HB      ASP  14  10.382   1.828  -3.661
  102    HB3  ASP  14           2HB      ASP  14   9.539   3.161  -4.445
  103    H    GLU  15           H        GLU  15   7.236   0.306  -5.868
  104    HA   GLU  15           HA       GLU  15   6.403   1.326  -8.296
  105    HB2  GLU  15           1HB      GLU  15   4.716   0.619  -5.889
  106    HB3  GLU  15           2HB      GLU  15   4.092   0.858  -7.515
  107    HG2  GLU  15           1HG      GLU  15   5.793  -0.986  -8.166
  108    HG3  GLU  15           2HG      GLU  15   5.770  -1.363  -6.444
  109    H    GLY  16           H        GLY  16   5.745   2.638  -5.050
  110    HA2  GLY  16           1HA      GLY  16   4.249   4.861  -5.871
  111    HA3  GLY  16           2HA      GLY  16   5.142   4.742  -4.362
  112    H    LYS  17           H        LYS  17   7.601   4.245  -6.173
  113    HA   LYS  17           HA       LYS  17   8.359   7.039  -6.291
  114    HB2  LYS  17           1HB      LYS  17   9.731   4.755  -5.669
  115    HB3  LYS  17           2HB      LYS  17  10.254   5.041  -7.323
  116    HG2  LYS  17           1HG      LYS  17  11.744   6.468  -6.521
  117    HG3  LYS  17           2HG      LYS  17  10.405   7.530  -6.078
  118    HD2  LYS  17           1HD      LYS  17  11.471   7.295  -4.053
  119    HD3  LYS  17           2HD      LYS  17  10.286   5.990  -3.961
  120    HE2  LYS  17           1HE      LYS  17  12.210   4.584  -5.051
  121    HE3  LYS  17           2HE      LYS  17  13.237   5.857  -4.393
  122    HZ1  LYS  17           3HZ      LYS  17  12.829   3.837  -2.945
  123    HZ2  LYS  17           1HZ      LYS  17  11.260   4.428  -2.720
  124    HZ3  LYS  17           2HZ      LYS  17  12.589   5.347  -2.221
  125    H    GLY  18           H        GLY  18   8.149   4.299  -8.553
  126    HA2  GLY  18           1HA      GLY  18   7.181   4.665 -10.747
  127    HA3  GLY  18           2HA      GLY  18   7.898   6.269 -10.735
  128    H    ASP  19           H        ASP  19   9.822   6.551 -11.682
  129    HA   ASP  19           HA       ASP  19  11.749   6.110 -12.807
  130    HB2  ASP  19           1HB      ASP  19  11.900   3.405 -11.511
  131    HB3  ASP  19           2HB      ASP  19  13.210   4.501 -11.945
  132    HA   PRO  20           HA       PRO  20   9.298   3.461 -15.743
  133    HB2  PRO  20           1HB      PRO  20   9.280   5.285 -17.754
  134    HB3  PRO  20           2HB      PRO  20   8.063   5.256 -16.472
  135    HG2  PRO  20           1HG      PRO  20  10.492   6.985 -16.739
  136    HG3  PRO  20           2HG      PRO  20   8.851   7.430 -16.233
  137    HD2  PRO  20           1HD      PRO  20  10.862   7.027 -14.465
  138    HD3  PRO  20           2HD      PRO  20   9.167   6.656 -14.086
  139    H    ARG  21           H        ARG  21  12.361   4.914 -15.593
  140    HA   ARG  21           HA       ARG  21  13.490   4.448 -18.071
  141    HB2  ARG  21           1HB      ARG  21  14.472   4.744 -15.324
  142    HB3  ARG  21           2HB      ARG  21  15.530   3.788 -16.353
  143    HG2  ARG  21           1HG      ARG  21  16.372   5.871 -16.727
  144    HG3  ARG  21           2HG      ARG  21  15.175   5.788 -18.021
  145    HD2  ARG  21           1HD      ARG  21  13.574   6.839 -16.285
  146    HD3  ARG  21           2HD      ARG  21  15.049   7.269 -15.420
  147    HE   ARG  21           HE       ARG  21  15.275   8.081 -18.102
  148   HH11  ARG  21          1HH1      ARG  21  13.543   8.870 -15.187
  149   HH12  ARG  21          2HH1      ARG  21  13.348  10.541 -15.600
  150   HH21  ARG  21          1HH2      ARG  21  15.024  10.279 -18.657
  151   HH22  ARG  21          2HH2      ARG  21  14.189  11.341 -17.575
  152    H    GLU  22           H        GLU  22  13.336   2.207 -15.307
  153    HA   GLU  22           HA       GLU  22  14.510   0.038 -16.728
  154    HB2  GLU  22           1HB      GLU  22  13.516   0.547 -14.061
  155    HB3  GLU  22           2HB      GLU  22  12.984  -1.029 -14.631
  156    HG2  GLU  22           1HG      GLU  22  15.093  -1.147 -13.399
  157    HG3  GLU  22           2HG      GLU  22  15.265  -1.685 -15.069
  158    H    GLY  23           H        GLY  23  11.462   1.446 -16.876
  159    HA2  GLY  23           1HA      GLY  23   9.847   0.789 -18.485
  160    HA3  GLY  23           2HA      GLY  23  10.454  -0.857 -18.383
  161    H    PHE  24           H        PHE  24   9.844   0.936 -15.478
  162    HA   PHE  24           HA       PHE  24   7.257  -0.390 -15.121
  163    HB2  PHE  24           1HB      PHE  24   9.370  -0.439 -12.967
  164    HB3  PHE  24           2HB      PHE  24   7.833  -1.297 -12.992
  165    HD1  PHE  24           HD1      PHE  24   7.545  -2.933 -15.056
  166    HD2  PHE  24           HD2      PHE  24  11.271  -1.613 -13.477
  167    HE1  PHE  24           HE1      PHE  24   8.655  -4.894 -16.044
  168    HE2  PHE  24           HE2      PHE  24  12.387  -3.571 -14.463
  169    HZ   PHE  24           HZ       PHE  24  11.079  -5.215 -15.749
  170    HA   PRO  25           HA       PRO  25   7.041   4.021 -13.848
  171    HB2  PRO  25           1HB      PRO  25   4.513   4.379 -14.770
  172    HB3  PRO  25           2HB      PRO  25   5.941   4.529 -15.801
  173    HG2  PRO  25           1HG      PRO  25   4.060   2.220 -15.495
  174    HG3  PRO  25           2HG      PRO  25   4.765   2.901 -16.973
  175    HD2  PRO  25           1HD      PRO  25   5.731   0.662 -15.797
  176    HD3  PRO  25           2HD      PRO  25   6.769   1.804 -16.673
  177    H    ALA  26           H        ALA  26   5.230   5.113 -12.564
  178    HA   ALA  26           HA       ALA  26   4.812   3.808 -10.168
  179    HB1  ALA  26           1HB      ALA  26   3.268   6.073 -11.417
  180    HB2  ALA  26           2HB      ALA  26   3.049   5.539  -9.750
  181    HB3  ALA  26           3HB      ALA  26   4.607   6.179 -10.272
  182    H    GLY  27           H        GLY  27   3.565   2.159  -9.588
  183    HA2  GLY  27           1HA      GLY  27   1.294   1.288  -9.387
  184    HA3  GLY  27           2HA      GLY  27   1.051   1.719 -11.074
  185    H    THR  28           H        THR  28   3.778   0.703 -11.749
  186    HA   THR  28           HA       THR  28   3.080  -1.844 -12.629
  187    HB   THR  28           HB       THR  28   5.900  -0.882 -12.122
  188    HG1  THR  28           HG1      THR  28   4.358  -0.590 -14.499
  189   HG21  THR  28          3HG2      THR  28   4.793  -3.279 -13.256
  190   HG22  THR  28          1HG2      THR  28   6.482  -2.857 -12.977
  191   HG23  THR  28          2HG2      THR  28   5.694  -2.392 -14.485
  192    H    ARG  29           H        ARG  29   2.548  -3.496 -11.352
  193    HA   ARG  29           HA       ARG  29   3.393  -3.829  -8.690
  194    HB2  ARG  29           1HB      ARG  29   2.295  -5.887 -10.614
  195    HB3  ARG  29           2HB      ARG  29   2.416  -6.087  -8.871
  196    HG2  ARG  29           1HG      ARG  29   0.792  -3.941 -10.218
  197    HG3  ARG  29           2HG      ARG  29   0.147  -5.490  -9.673
  198    HD2  ARG  29           1HD      ARG  29   1.120  -4.869  -7.384
  199    HD3  ARG  29           2HD      ARG  29   1.258  -3.235  -8.034
  200    HE   ARG  29           HE       ARG  29  -1.153  -4.593  -7.244
  201   HH11  ARG  29          1HH1      ARG  29   0.207  -2.047  -9.190
  202   HH12  ARG  29          2HH1      ARG  29  -1.263  -1.133  -9.254
  203   HH21  ARG  29          1HH2      ARG  29  -3.095  -3.398  -7.321
  204   HH22  ARG  29          2HH2      ARG  29  -3.140  -1.902  -8.190
  205    H    TRP  30           H        TRP  30   5.117  -4.790  -7.797
  206    HA   TRP  30           HA       TRP  30   7.428  -5.318  -9.260
  207    HB2  TRP  30           1HB      TRP  30   6.542  -5.738  -6.469
  208    HB3  TRP  30           2HB      TRP  30   7.885  -6.744  -7.004
  209    HD1  TRP  30           HD1      TRP  30   6.949  -3.031  -6.558
  210    HE1  TRP  30           HE1      TRP  30   9.124  -1.677  -6.310
  211    HE3  TRP  30           HE3      TRP  30  10.332  -6.756  -7.459
  212    HZ2  TRP  30           HZ2      TRP  30  11.905  -2.128  -6.475
  213    HZ3  TRP  30           HZ3      TRP  30  12.731  -6.212  -7.396
  214    HH2  TRP  30           HH2      TRP  30  13.499  -3.945  -6.914
  215    H    ASP  31           H        ASP  31   4.739  -7.367  -8.470
  216    HA   ASP  31           HA       ASP  31   6.025  -9.860  -8.948
  217    HB2  ASP  31           1HB      ASP  31   3.622 -10.680  -9.208
  218    HB3  ASP  31           2HB      ASP  31   4.040  -9.945  -7.663
  219    H    GLN  32           H        GLN  32   4.601  -7.444 -10.983
  220    HA   GLN  32           HA       GLN  32   4.115  -9.053 -13.260
  221    HB2  GLN  32           1HB      GLN  32   3.234  -6.705 -12.783
  222    HB3  GLN  32           2HB      GLN  32   4.803  -6.120 -13.319
  223    HG2  GLN  32           1HG      GLN  32   3.434  -5.949 -15.195
  224    HG3  GLN  32           2HG      GLN  32   4.375  -7.415 -15.464
  225   HE21  GLN  32          2HE2      GLN  32   1.398  -6.576 -13.717
  226   HE22  GLN  32          1HE2      GLN  32   0.441  -7.843 -14.397
  227    H    ILE  33           H        ILE  33   6.966  -7.559 -11.960
  228    HA   ILE  33           HA       ILE  33   8.605  -7.365 -14.176
  229    HB   ILE  33           HB       ILE  33   9.437  -8.274 -11.418
  230   HG12  ILE  33          1HG1      ILE  33   9.264  -5.495 -12.604
  231   HG13  ILE  33          2HG1      ILE  33   8.192  -6.155 -11.373
  232   HG21  ILE  33          1HG2      ILE  33  11.636  -7.454 -11.996
  233   HG22  ILE  33          2HG2      ILE  33  11.123  -8.659 -13.176
  234   HG23  ILE  33          3HG2      ILE  33  11.060  -6.944 -13.582
  235   HD11  ILE  33          3HD1      ILE  33   9.558  -5.373  -9.828
  236   HD12  ILE  33          1HD1      ILE  33  10.811  -6.471 -10.408
  237   HD13  ILE  33          2HD1      ILE  33  10.698  -4.837 -11.062
  238    HA   PRO  34           HA       PRO  34   9.013 -11.544 -15.568
  239    HB2  PRO  34           1HB      PRO  34  11.110 -11.147 -17.246
  240    HB3  PRO  34           2HB      PRO  34   9.461 -10.640 -17.632
  241    HG2  PRO  34           1HG      PRO  34  11.743  -9.018 -16.571
  242    HG3  PRO  34           2HG      PRO  34  10.570  -8.605 -17.835
  243    HD2  PRO  34           1HD      PRO  34  10.362  -7.683 -15.298
  244    HD3  PRO  34           2HD      PRO  34   8.943  -8.021 -16.310
  245    H    ASP  35           H        ASP  35   9.956 -13.204 -14.575
  246    HA   ASP  35           HA       ASP  35  12.256 -12.817 -12.898
  247    HB2  ASP  35           1HB      ASP  35  11.001 -15.469 -13.595
  248    HB3  ASP  35           2HB      ASP  35  11.891 -15.035 -12.138
  249    H    ASP  36           H        ASP  36  11.764 -13.664 -16.148
  250    HA   ASP  36           HA       ASP  36  14.116 -15.290 -16.458
  251    HB2  ASP  36           1HB      ASP  36  12.128 -14.069 -18.352
  252    HB3  ASP  36           2HB      ASP  36  13.619 -14.785 -18.959
  253    H    TRP  37           H        TRP  37  13.413 -11.931 -16.414
  254    HA   TRP  37           HA       TRP  37  15.328 -10.835 -18.071
  255    HB2  TRP  37           1HB      TRP  37  13.540  -9.833 -16.269
  256    HB3  TRP  37           2HB      TRP  37  15.068  -9.487 -15.464
  257    HD1  TRP  37           HD1      TRP  37  16.289  -7.353 -16.216
  258    HE1  TRP  37           HE1      TRP  37  16.032  -5.687 -18.160
  259    HE3  TRP  37           HE3      TRP  37  12.740  -9.826 -18.941
  260    HZ2  TRP  37           HZ2      TRP  37  14.523  -5.451 -20.535
  261    HZ3  TRP  37           HZ3      TRP  37  11.943  -8.812 -21.036
  262    HH2  TRP  37           HH2      TRP  37  12.817  -6.669 -21.814
  263    H    CYS  38           H        CYS  38  17.489 -10.516 -18.000
  264    HA   CYS  38           HA       CYS  38  18.946 -11.864 -15.849
  265    HB2  CYS  38           1HB      CYS  38  19.591 -11.134 -18.680
  266    HB3  CYS  38           2HB      CYS  38  20.906 -11.372 -17.535
  267    HG   CYS  38           HG       CYS  38  21.021 -13.849 -18.243
  268    H    CYS  39           H        CYS  39  21.132 -10.823 -15.318
  269    HA   CYS  39           HA       CYS  39  21.318  -7.973 -15.495
  270    HB2  CYS  39           1HB      CYS  39  20.009  -9.194 -13.178
  271    HB3  CYS  39           2HB      CYS  39  21.357  -8.151 -12.743
  272    HG   CYS  39           HG       CYS  39  20.221  -6.031 -14.428
  273    HA   PRO  40           HA       PRO  40  25.557  -8.774 -14.712
  274    HB2  PRO  40           1HB      PRO  40  26.342  -6.553 -13.363
  275    HB3  PRO  40           2HB      PRO  40  25.954  -6.542 -15.087
  276    HG2  PRO  40           1HG      PRO  40  24.262  -5.715 -12.760
  277    HG3  PRO  40           2HG      PRO  40  24.475  -4.916 -14.329
  278    HD2  PRO  40           1HD      PRO  40  22.319  -6.451 -13.755
  279    HD3  PRO  40           2HD      PRO  40  22.998  -6.332 -15.391
  280    H    ASP  41           H        ASP  41  24.016  -7.382 -11.808
  281    HA   ASP  41           HA       ASP  41  25.808  -8.807 -10.055
  282    HB2  ASP  41           1HB      ASP  41  23.869  -6.653  -9.818
  283    HB3  ASP  41           2HB      ASP  41  23.717  -7.816  -8.504
  284    H    CYS  42           H        CYS  42  22.315  -8.895 -10.736
  285    HA   CYS  42           HA       CYS  42  21.657 -11.006  -9.040
  286    HB2  CYS  42           1HB      CYS  42  20.075  -9.473 -10.305
  287    HB3  CYS  42           2HB      CYS  42  20.351 -10.492 -11.712
  288    HG   CYS  42           HG       CYS  42  19.117 -11.704  -8.762
  289    H    SER  43           H        SER  43  23.333 -11.002 -12.048
  290    HA   SER  43           HA       SER  43  22.831 -13.497 -13.094
  291    HB2  SER  43           1HB      SER  43  24.252 -12.318 -14.455
  292    HB3  SER  43           2HB      SER  43  25.187 -11.677 -13.104
  293    HG   SER  43           HG       SER  43  25.788 -13.722 -14.657
  294    H    VAL  44           H        VAL  44  24.702 -12.646 -10.273
  295    HA   VAL  44           HA       VAL  44  25.340 -15.495  -9.862
  296    HB   VAL  44           HB       VAL  44  27.343 -14.103 -10.026
  297   HG11  VAL  44          1HG1      VAL  44  27.286 -12.013  -9.276
  298   HG12  VAL  44          2HG1      VAL  44  25.787 -12.318  -8.395
  299   HG13  VAL  44          3HG1      VAL  44  27.343 -12.651  -7.633
  300   HG21  VAL  44          3HG2      VAL  44  27.107 -16.067  -8.399
  301   HG22  VAL  44          1HG2      VAL  44  28.459 -14.961  -8.155
  302   HG23  VAL  44          2HG2      VAL  44  27.027 -14.842  -7.133
  303    H    ARG  45           H        ARG  45  23.615 -12.787  -8.680
  304    HA   ARG  45           HA       ARG  45  23.191 -14.076  -6.074
  305    HB2  ARG  45           1HB      ARG  45  22.490 -11.271  -6.963
  306    HB3  ARG  45           2HB      ARG  45  22.285 -11.921  -5.342
  307    HG2  ARG  45           1HG      ARG  45  24.912 -11.557  -6.769
  308    HG3  ARG  45           2HG      ARG  45  24.263 -10.506  -5.509
  309    HD2  ARG  45           1HD      ARG  45  24.133 -12.755  -4.155
  310    HD3  ARG  45           2HD      ARG  45  25.368 -13.266  -5.304
  311    HE   ARG  45           HE       ARG  45  26.066 -10.764  -4.214
  312   HH11  ARG  45          1HH1      ARG  45  25.831 -14.127  -3.344
  313   HH12  ARG  45          2HH1      ARG  45  27.072 -14.036  -2.138
  314   HH21  ARG  45          1HH2      ARG  45  27.700 -10.632  -2.629
  315   HH22  ARG  45          2HH2      ARG  45  28.134 -12.047  -1.731
  316    H    GLU  46           H        GLU  46  21.345 -15.102  -5.680
  317    HA   GLU  46           HA       GLU  46  19.393 -15.608  -7.565
  318    HB2  GLU  46           1HB      GLU  46  19.893 -16.643  -5.178
  319    HB3  GLU  46           2HB      GLU  46  18.602 -15.556  -4.689
  320    HG2  GLU  46           1HG      GLU  46  17.543 -17.587  -5.118
  321    HG3  GLU  46           2HG      GLU  46  17.224 -16.605  -6.547
  322    H    LYS  47           H        LYS  47  17.182 -14.940  -7.735
  323    HA   LYS  47           HA       LYS  47  16.886 -12.082  -7.461
  324    HB2  LYS  47           1HB      LYS  47  16.113 -13.533  -9.439
  325    HB3  LYS  47           2HB      LYS  47  14.759 -13.988  -8.414
  326    HG2  LYS  47           1HG      LYS  47  13.923 -11.792  -8.361
  327    HG3  LYS  47           2HG      LYS  47  15.424 -11.121  -9.004
  328    HD2  LYS  47           1HD      LYS  47  15.014 -12.064 -11.154
  329    HD3  LYS  47           2HD      LYS  47  13.668 -13.028 -10.542
  330    HE2  LYS  47           1HE      LYS  47  12.552 -11.286 -11.547
  331    HE3  LYS  47           2HE      LYS  47  12.679 -10.699  -9.890
  332    HZ1  LYS  47           3HZ      LYS  47  14.107  -9.803 -12.291
  333    HZ2  LYS  47           1HZ      LYS  47  14.876  -9.661 -10.791
  334    HZ3  LYS  47           2HZ      LYS  47  13.396  -8.889 -11.058
  335    H    VAL  48           H        VAL  48  16.058 -14.842  -5.642
  336    HA   VAL  48           HA       VAL  48  13.722 -13.804  -4.362
  337    HB   VAL  48           HB       VAL  48  14.270 -16.240  -4.505
  338   HG11  VAL  48          1HG1      VAL  48  16.730 -15.641  -3.723
  339   HG12  VAL  48          2HG1      VAL  48  16.041 -15.981  -2.135
  340   HG13  VAL  48          3HG1      VAL  48  16.006 -17.215  -3.395
  341   HG21  VAL  48          3HG2      VAL  48  12.965 -14.841  -2.530
  342   HG22  VAL  48          1HG2      VAL  48  12.901 -16.587  -2.772
  343   HG23  VAL  48          2HG2      VAL  48  14.043 -15.898  -1.619
  344    H    ASP  49           H        ASP  49  16.935 -12.961  -4.160
  345    HA   ASP  49           HA       ASP  49  17.317 -12.554  -1.403
  346    HB2  ASP  49           1HB      ASP  49  18.988 -12.399  -3.418
  347    HB3  ASP  49           2HB      ASP  49  18.513 -10.703  -3.433
  348    H    PHE  50           H        PHE  50  15.501 -10.807  -3.771
  349    HA   PHE  50           HA       PHE  50  15.397  -8.255  -2.730
  350    HB2  PHE  50           1HB      PHE  50  13.543  -9.937  -4.327
  351    HB3  PHE  50           2HB      PHE  50  12.856  -8.504  -3.569
  352    HD1  PHE  50           HD2      PHE  50  14.100  -6.277  -3.976
  353    HD2  PHE  50           HD1      PHE  50  14.624  -9.764  -6.361
  354    HE1  PHE  50           HE2      PHE  50  14.976  -4.888  -5.808
  355    HE2  PHE  50           HE1      PHE  50  15.502  -8.380  -8.196
  356    HZ   PHE  50           HZ       PHE  50  15.678  -5.939  -7.922
  357    H    GLU  51           H        GLU  51  14.409  -7.267  -1.052
  358    HA   GLU  51           HA       GLU  51  12.605  -8.863   0.632
  359    HB2  GLU  51           1HB      GLU  51  14.989  -7.250   1.538
  360    HB3  GLU  51           2HB      GLU  51  13.715  -7.772   2.630
  361    HG2  GLU  51           1HG      GLU  51  15.080  -9.798   0.931
  362    HG3  GLU  51           2HG      GLU  51  15.906  -9.167   2.355
  363    H    ARG  52           H        ARG  52  10.904  -7.779   1.509
  364    HA   ARG  52           HA       ARG  52  10.088  -5.358   0.333
  365    HB2  ARG  52           1HB      ARG  52   8.244  -5.414   1.980
  366    HB3  ARG  52           2HB      ARG  52   8.468  -6.957   1.166
  367    HG2  ARG  52           1HG      ARG  52   9.830  -7.665   3.180
  368    HG3  ARG  52           2HG      ARG  52   9.214  -6.216   3.977
  369    HD2  ARG  52           1HD      ARG  52   6.927  -6.985   3.627
  370    HD3  ARG  52           2HD      ARG  52   7.527  -8.418   2.793
  371    HE   ARG  52           HE       ARG  52   7.398  -7.994   5.623
  372   HH11  ARG  52          1HH1      ARG  52   9.079  -9.672   3.078
  373   HH12  ARG  52          2HH1      ARG  52   9.615 -10.961   4.104
  374   HH21  ARG  52          1HH2      ARG  52   8.097  -9.686   6.984
  375   HH22  ARG  52          2HH2      ARG  52   9.055 -10.968   6.325
  376    H    MET  53           H        MET  53  10.066  -3.263   1.053
  377    HA   MET  53           HA       MET  53  11.802  -2.695   3.357
  378    HB2  MET  53           1HB      MET  53  12.101  -0.460   2.341
  379    HB3  MET  53           2HB      MET  53  12.626  -1.760   1.279
  380    HG2  MET  53           1HG      MET  53  10.947  -1.406  -0.220
  381    HG3  MET  53           2HG      MET  53   9.848  -0.758   0.995
  382    HE1  MET  53           3HE      MET  53  12.838   1.334  -1.634
  383    HE2  MET  53           1HE      MET  53  12.478  -0.385  -1.472
  384    HE3  MET  53           2HE      MET  53  11.307   0.693  -2.231
  385    H    GLY  54           H        GLY  54   9.345  -3.413   4.139
  386    HA2  GLY  54           1HA      GLY  54   8.429  -1.543   5.842
  387    HA3  GLY  54           2HA      GLY  54   7.612  -1.099   4.351
  388    H    GLY  55           H        GLY  55   5.796  -2.157   3.778
  389    HA2  GLY  55           1HA      GLY  55   4.234  -3.890   3.711
  390    HA3  GLY  55           2HA      GLY  55   5.211  -4.784   4.865
  391    H    LYS  56           H        LYS  56   3.752  -5.295   6.401
  392    HA   LYS  56           HA       LYS  56   2.162  -3.106   7.561
  393    HB2  LYS  56           1HB      LYS  56   0.918  -5.068   6.634
  394    HB3  LYS  56           2HB      LYS  56   1.708  -6.082   7.834
  395    HG2  LYS  56           1HG      LYS  56  -0.454  -5.567   8.654
  396    HG3  LYS  56           2HG      LYS  56   0.700  -4.627   9.602
  397    HD2  LYS  56           1HD      LYS  56   0.186  -2.636   8.387
  398    HD3  LYS  56           2HD      LYS  56  -0.775  -3.535   7.211
  399    HE2  LYS  56           1HE      LYS  56  -1.455  -3.439  10.139
  400    HE3  LYS  56           2HE      LYS  56  -2.059  -2.253   8.983
  401    HZ1  LYS  56           3HZ      LYS  56  -2.531  -5.184   8.909
  402    HZ2  LYS  56           1HZ      LYS  56  -3.037  -4.098   7.715
  403    HZ3  LYS  56           2HZ      LYS  56  -3.670  -3.989   9.280
  Start of MODEL    3
    1    H1   MET   1           H        MET   1   1.541  -0.692   1.613
    2    HA   MET   1           HA       MET   1   1.428  -2.305  -0.725
    3    HB2  MET   1           1HB      MET   1   2.836   0.276  -0.067
    4    HB3  MET   1           2HB      MET   1   2.992  -0.497  -1.638
    5    HG2  MET   1           1HG      MET   1   1.283   0.918  -2.091
    6    HG3  MET   1           2HG      MET   1   0.358  -0.470  -1.521
    7    HE1  MET   1           3HE      MET   1  -1.588   1.913  -1.244
    8    HE2  MET   1           1HE      MET   1  -0.944   3.295  -0.357
    9    HE3  MET   1           2HE      MET   1  -0.131   2.728  -1.816
   10    H    THR   2           H        THR   2   3.293  -2.994  -1.997
   11    HA   THR   2           HA       THR   2   5.292  -4.243  -0.284
   12    HB   THR   2           HB       THR   2   4.697  -4.634  -3.223
   13    HG1  THR   2           HG1      THR   2   4.233  -6.360  -1.002
   14   HG21  THR   2          3HG2      THR   2   6.938  -5.230  -3.056
   15   HG22  THR   2          1HG2      THR   2   6.113  -6.759  -2.751
   16   HG23  THR   2          2HG2      THR   2   6.761  -5.823  -1.404
   17    H    ALA   3           H        ALA   3   7.496  -3.960  -0.490
   18    HA   ALA   3           HA       ALA   3   8.538  -2.126  -2.486
   19    HB1  ALA   3           1HB      ALA   3   9.500  -1.349   0.148
   20    HB2  ALA   3           2HB      ALA   3   8.917  -0.352  -1.186
   21    HB3  ALA   3           3HB      ALA   3   7.769  -1.078  -0.060
   22    H    TYR   4           H        TYR   4  10.265  -3.125  -3.266
   23    HA   TYR   4           HA       TYR   4  11.902  -4.753  -1.438
   24    HB2  TYR   4           1HB      TYR   4  11.291  -5.022  -4.370
   25    HB3  TYR   4           2HB      TYR   4  12.706  -5.795  -3.664
   26    HD1  TYR   4           HD1      TYR   4  12.411  -7.543  -1.918
   27    HD2  TYR   4           HD2      TYR   4   9.106  -5.909  -4.041
   28    HE1  TYR   4           HE1      TYR   4  11.024  -9.447  -1.211
   29    HE2  TYR   4           HE2      TYR   4   7.709  -7.808  -3.339
   30    HH   TYR   4           HH       TYR   4   8.755 -10.588  -2.337
   31    H    ARG   5           H        ARG   5  13.962  -4.204  -1.103
   32    HA   ARG   5           HA       ARG   5  15.283  -2.394  -2.997
   33    HB2  ARG   5           1HB      ARG   5  14.291  -1.204  -0.943
   34    HB3  ARG   5           2HB      ARG   5  15.553  -2.013  -0.025
   35    HG2  ARG   5           1HG      ARG   5  16.267  -0.412  -2.440
   36    HG3  ARG   5           2HG      ARG   5  15.934   0.395  -0.906
   37    HD2  ARG   5           1HD      ARG   5  17.641  -1.038   0.169
   38    HD3  ARG   5           2HD      ARG   5  18.011  -1.733  -1.409
   39    HE   ARG   5           HE       ARG   5  19.203   0.153  -1.920
   40   HH11  ARG   5          1HH1      ARG   5  17.187   0.792   0.846
   41   HH12  ARG   5          2HH1      ARG   5  17.893   2.341   1.166
   42   HH21  ARG   5          1HH2      ARG   5  20.140   2.192  -1.508
   43   HH22  ARG   5          2HH2      ARG   5  19.572   3.137  -0.174
   44    H    CYS   6           H        CYS   6  16.786  -3.775  -3.763
   45    HA   CYS   6           HA       CYS   6  18.875  -4.625  -1.953
   46    HB2  CYS   6           1HB      CYS   6  16.940  -6.443  -2.253
   47    HB3  CYS   6           2HB      CYS   6  17.863  -6.806  -3.706
   48    HG   CYS   6           HG       CYS   6  18.766  -7.198  -0.459
   49    HA   PRO   7           HA       PRO   7  20.456  -3.219  -6.020
   50    HB2  PRO   7           1HB      PRO   7  22.658  -2.018  -4.980
   51    HB3  PRO   7           2HB      PRO   7  21.081  -1.223  -5.068
   52    HG2  PRO   7           1HG      PRO   7  22.386  -2.590  -2.746
   53    HG3  PRO   7           2HG      PRO   7  21.490  -1.060  -2.784
   54    HD2  PRO   7           1HD      PRO   7  20.382  -3.376  -1.925
   55    HD3  PRO   7           2HD      PRO   7  19.441  -2.114  -2.746
   56    H    VAL   8           H        VAL   8  21.630  -5.251  -3.521
   57    HA   VAL   8           HA       VAL   8  24.169  -5.943  -4.436
   58    HB   VAL   8           HB       VAL   8  22.149  -7.728  -3.071
   59   HG11  VAL   8          1HG1      VAL   8  24.984  -8.095  -3.844
   60   HG12  VAL   8          2HG1      VAL   8  24.500  -8.682  -2.252
   61   HG13  VAL   8          3HG1      VAL   8  23.685  -9.278  -3.698
   62   HG21  VAL   8          3HG2      VAL   8  23.621  -7.122  -1.056
   63   HG22  VAL   8          1HG2      VAL   8  24.183  -5.776  -2.047
   64   HG23  VAL   8          2HG2      VAL   8  22.474  -5.913  -1.634
   65    H    CYS   9           H        CYS   9  21.057  -6.700  -5.715
   66    HA   CYS   9           HA       CYS   9  22.284  -8.608  -7.595
   67    HB2  CYS   9           1HB      CYS   9  19.322  -8.454  -7.176
   68    HB3  CYS   9           2HB      CYS   9  20.303  -9.818  -7.698
   69    HG   CYS   9           HG       CYS   9  19.176 -10.383  -5.190
   70    H    ASP  10           H        ASP  10  19.660  -6.203  -7.384
   71    HA   ASP  10           HA       ASP  10  20.497  -5.056  -9.912
   72    HB2  ASP  10           1HB      ASP  10  18.311  -5.277 -10.978
   73    HB3  ASP  10           2HB      ASP  10  18.973  -6.866 -10.603
   74    H    TYR  11           H        TYR  11  19.297  -3.057 -10.420
   75    HA   TYR  11           HA       TYR  11  19.272  -1.236  -8.395
   76    HB2  TYR  11           1HB      TYR  11  17.676  -1.300 -10.951
   77    HB3  TYR  11           2HB      TYR  11  17.641   0.083  -9.862
   78    HD1  TYR  11           HD2      TYR  11  20.147   0.827  -9.113
   79    HD2  TYR  11           HD1      TYR  11  19.105  -1.131 -12.744
   80    HE1  TYR  11           HE2      TYR  11  22.183   1.714 -10.169
   81    HE2  TYR  11           HE1      TYR  11  21.139  -0.251 -13.810
   82    HH   TYR  11           HH       TYR  11  22.951   2.233 -12.542
   83    H    THR  12           H        THR  12  17.562  -0.120  -7.266
   84    HA   THR  12           HA       THR  12  15.364  -1.936  -6.539
   85    HB   THR  12           HB       THR  12  15.303  -0.960  -4.385
   86    HG1  THR  12           HG1      THR  12  16.961   1.065  -5.502
   87   HG21  THR  12          3HG2      THR  12  17.282  -1.714  -3.545
   88   HG22  THR  12          1HG2      THR  12  18.247  -0.827  -4.725
   89   HG23  THR  12          2HG2      THR  12  17.451  -2.330  -5.189
   90    H    TYR  13           H        TYR  13  13.320  -1.358  -6.921
   91    HA   TYR  13           HA       TYR  13  12.605   1.449  -7.195
   92    HB2  TYR  13           1HB      TYR  13  11.340   0.829  -9.358
   93    HB3  TYR  13           2HB      TYR  13  13.077   1.095  -9.461
   94    HD1  TYR  13           HD2      TYR  13  14.611  -0.837  -9.695
   95    HD2  TYR  13           HD1      TYR  13  10.385  -1.312  -9.817
   96    HE1  TYR  13           HE2      TYR  13  14.897  -3.060 -10.707
   97    HE2  TYR  13           HE1      TYR  13  10.659  -3.538 -10.828
   98    HH   TYR  13           HH       TYR  13  13.364  -5.268 -10.759
   99    H    ASP  14           H        ASP  14  11.052   1.554  -5.703
  100    HA   ASP  14           HA       ASP  14   9.343  -0.621  -5.035
  101    HB2  ASP  14           1HB      ASP  14   9.854   0.989  -3.333
  102    HB3  ASP  14           2HB      ASP  14   9.259   2.315  -4.329
  103    H    GLU  15           H        GLU  15   7.417  -1.192  -5.831
  104    HA   GLU  15           HA       GLU  15   6.457  -0.193  -8.253
  105    HB2  GLU  15           1HB      GLU  15   4.395  -1.499  -7.741
  106    HB3  GLU  15           2HB      GLU  15   5.882  -2.418  -7.554
  107    HG2  GLU  15           1HG      GLU  15   4.658  -3.030  -5.697
  108    HG3  GLU  15           2HG      GLU  15   5.715  -1.766  -5.070
  109    H    GLY  16           H        GLY  16   5.824   0.787  -4.973
  110    HA2  GLY  16           1HA      GLY  16   3.534   2.414  -5.724
  111    HA3  GLY  16           2HA      GLY  16   4.217   2.253  -4.113
  112    H    LYS  17           H        LYS  17   6.615   2.840  -6.393
  113    HA   LYS  17           HA       LYS  17   6.659   5.690  -5.653
  114    HB2  LYS  17           1HB      LYS  17   8.556   4.076  -4.949
  115    HB3  LYS  17           2HB      LYS  17   9.046   4.149  -6.637
  116    HG2  LYS  17           1HG      LYS  17  10.337   5.817  -5.803
  117    HG3  LYS  17           2HG      LYS  17   8.892   6.751  -6.196
  118    HD2  LYS  17           1HD      LYS  17   8.248   5.995  -3.713
  119    HD3  LYS  17           2HD      LYS  17  10.006   5.983  -3.560
  120    HE2  LYS  17           1HE      LYS  17  10.051   8.297  -4.443
  121    HE3  LYS  17           2HE      LYS  17   8.288   8.293  -4.460
  122    HZ1  LYS  17           3HZ      LYS  17  10.024   8.010  -2.068
  123    HZ2  LYS  17           1HZ      LYS  17   8.336   7.898  -2.053
  124    HZ3  LYS  17           2HZ      LYS  17   9.082   9.356  -2.473
  125    H    GLY  18           H        GLY  18   7.367   3.436  -8.309
  126    HA2  GLY  18           1HA      GLY  18   6.687   3.808 -10.549
  127    HA3  GLY  18           2HA      GLY  18   6.563   5.526 -10.198
  128    H    ASP  19           H        ASP  19   8.609   2.962 -11.256
  129    HA   ASP  19           HA       ASP  19  10.825   4.872 -11.606
  130    HB2  ASP  19           1HB      ASP  19  10.745   2.017 -10.853
  131    HB3  ASP  19           2HB      ASP  19  11.995   2.455 -12.014
  132    HA   PRO  20           HA       PRO  20   9.149   3.932 -15.828
  133    HB2  PRO  20           1HB      PRO  20   9.288   6.498 -16.705
  134    HB3  PRO  20           2HB      PRO  20   7.894   5.857 -15.828
  135    HG2  PRO  20           1HG      PRO  20  10.178   7.503 -14.810
  136    HG3  PRO  20           2HG      PRO  20   8.447   7.650 -14.455
  137    HD2  PRO  20           1HD      PRO  20  10.185   6.448 -12.762
  138    HD3  PRO  20           2HD      PRO  20   8.490   5.939 -12.910
  139    H    ARG  21           H        ARG  21  12.018   5.115 -14.466
  140    HA   ARG  21           HA       ARG  21  13.480   5.729 -16.817
  141    HB2  ARG  21           1HB      ARG  21  14.149   5.195 -13.963
  142    HB3  ARG  21           2HB      ARG  21  15.448   5.086 -15.144
  143    HG2  ARG  21           1HG      ARG  21  15.534   7.280 -14.347
  144    HG3  ARG  21           2HG      ARG  21  14.731   7.401 -15.913
  145    HD2  ARG  21           1HD      ARG  21  12.638   7.753 -14.946
  146    HD3  ARG  21           2HD      ARG  21  13.148   7.109 -13.386
  147    HE   ARG  21           HE       ARG  21  13.408   9.804 -14.303
  148   HH11  ARG  21          1HH1      ARG  21  14.817   7.376 -12.244
  149   HH12  ARG  21          2HH1      ARG  21  15.554   8.524 -11.175
  150   HH21  ARG  21          1HH2      ARG  21  14.373  11.325 -12.903
  151   HH22  ARG  21          2HH2      ARG  21  15.299  10.770 -11.551
  152    H    GLU  22           H        GLU  22  12.615   2.771 -15.258
  153    HA   GLU  22           HA       GLU  22  14.511   1.273 -16.930
  154    HB2  GLU  22           1HB      GLU  22  12.931   0.424 -14.497
  155    HB3  GLU  22           2HB      GLU  22  13.949  -0.653 -15.444
  156    HG2  GLU  22           1HG      GLU  22  14.992   1.839 -14.134
  157    HG3  GLU  22           2HG      GLU  22  14.957   0.271 -13.329
  158    H    GLY  23           H        GLY  23  11.919   2.511 -17.776
  159    HA2  GLY  23           1HA      GLY  23  10.341   1.934 -19.357
  160    HA3  GLY  23           2HA      GLY  23  10.993   0.302 -19.347
  161    H    PHE  24           H        PHE  24  10.039   1.681 -16.334
  162    HA   PHE  24           HA       PHE  24   7.441   0.329 -16.442
  163    HB2  PHE  24           1HB      PHE  24   9.373  -0.029 -14.145
  164    HB3  PHE  24           2HB      PHE  24   7.809  -0.810 -14.350
  165    HD1  PHE  24           HD1      PHE  24   7.609  -2.126 -16.680
  166    HD2  PHE  24           HD2      PHE  24  11.227  -1.286 -14.602
  167    HE1  PHE  24           HE1      PHE  24   8.700  -4.012 -17.824
  168    HE2  PHE  24           HE2      PHE  24  12.324  -3.169 -15.743
  169    HZ   PHE  24           HZ       PHE  24  11.060  -4.535 -17.357
  170    HA   PRO  25           HA       PRO  25   7.028   4.526 -14.615
  171    HB2  PRO  25           1HB      PRO  25   4.606   5.004 -15.743
  172    HB3  PRO  25           2HB      PRO  25   6.132   5.293 -16.586
  173    HG2  PRO  25           1HG      PRO  25   4.263   2.964 -16.795
  174    HG3  PRO  25           2HG      PRO  25   5.109   3.839 -18.085
  175    HD2  PRO  25           1HD      PRO  25   5.978   1.461 -17.126
  176    HD3  PRO  25           2HD      PRO  25   7.086   2.711 -17.726
  177    H    ALA  26           H        ALA  26   4.894   5.432 -13.548
  178    HA   ALA  26           HA       ALA  26   4.325   3.933 -11.305
  179    HB1  ALA  26           1HB      ALA  26   3.633   6.024 -10.882
  180    HB2  ALA  26           2HB      ALA  26   3.200   6.329 -12.565
  181    HB3  ALA  26           3HB      ALA  26   2.084   5.460 -11.510
  182    H    GLY  27           H        GLY  27   2.985   2.301 -10.814
  183    HA2  GLY  27           1HA      GLY  27   0.787   1.262 -11.080
  184    HA3  GLY  27           2HA      GLY  27   0.933   1.562 -12.806
  185    H    THR  28           H        THR  28   3.616   0.709 -13.124
  186    HA   THR  28           HA       THR  28   3.204  -2.074 -13.457
  187    HB   THR  28           HB       THR  28   5.767  -0.478 -13.635
  188    HG1  THR  28           HG1      THR  28   4.248  -1.466 -15.807
  189   HG21  THR  28          3HG2      THR  28   6.552  -2.643 -13.474
  190   HG22  THR  28          1HG2      THR  28   6.300  -2.500 -15.213
  191   HG23  THR  28          2HG2      THR  28   5.109  -3.335 -14.216
  192    H    ARG  29           H        ARG  29   3.096  -3.429 -11.783
  193    HA   ARG  29           HA       ARG  29   4.627  -2.964  -9.371
  194    HB2  ARG  29           1HB      ARG  29   2.291  -4.491 -10.119
  195    HB3  ARG  29           2HB      ARG  29   3.425  -5.497  -9.228
  196    HG2  ARG  29           1HG      ARG  29   3.104  -4.385  -7.295
  197    HG3  ARG  29           2HG      ARG  29   2.908  -2.826  -8.098
  198    HD2  ARG  29           1HD      ARG  29   0.718  -4.383  -8.894
  199    HD3  ARG  29           2HD      ARG  29   0.906  -4.667  -7.164
  200    HE   ARG  29           HE       ARG  29   1.041  -1.893  -7.823
  201   HH11  ARG  29          1HH1      ARG  29  -1.143  -4.548  -7.274
  202   HH12  ARG  29          2HH1      ARG  29  -2.461  -3.533  -6.788
  203   HH21  ARG  29          1HH2      ARG  29  -0.686  -0.547  -7.184
  204   HH22  ARG  29          2HH2      ARG  29  -2.200  -1.258  -6.738
  205    H    TRP  30           H        TRP  30   6.124  -4.450  -8.473
  206    HA   TRP  30           HA       TRP  30   8.111  -5.352 -10.160
  207    HB2  TRP  30           1HB      TRP  30   8.875  -6.742  -8.207
  208    HB3  TRP  30           2HB      TRP  30   8.578  -5.048  -7.829
  209    HD1  TRP  30           HD1      TRP  30   6.461  -4.488  -6.275
  210    HE1  TRP  30           HE1      TRP  30   5.111  -5.944  -4.637
  211    HE3  TRP  30           HE3      TRP  30   8.008  -9.106  -7.830
  212    HZ2  TRP  30           HZ2      TRP  30   4.750  -8.687  -4.078
  213    HZ3  TRP  30           HZ3      TRP  30   7.113 -11.095  -6.691
  214    HH2  TRP  30           HH2      TRP  30   5.519 -10.888  -4.854
  215    H    ASP  31           H        ASP  31   5.192  -6.967  -9.141
  216    HA   ASP  31           HA       ASP  31   5.867  -9.607  -9.799
  217    HB2  ASP  31           1HB      ASP  31   3.870  -9.084  -8.510
  218    HB3  ASP  31           2HB      ASP  31   3.179  -8.224  -9.883
  219    H    GLN  32           H        GLN  32   4.655  -6.950 -11.765
  220    HA   GLN  32           HA       GLN  32   4.090  -8.431 -14.092
  221    HB2  GLN  32           1HB      GLN  32   4.967  -5.545 -13.916
  222    HB3  GLN  32           2HB      GLN  32   4.111  -6.298 -15.254
  223    HG2  GLN  32           1HG      GLN  32   3.094  -5.631 -12.518
  224    HG3  GLN  32           2HG      GLN  32   2.480  -5.110 -14.086
  225   HE21  GLN  32          2HE2      GLN  32   2.493  -7.593 -11.697
  226   HE22  GLN  32          1HE2      GLN  32   1.265  -8.580 -12.405
  227    H    ILE  33           H        ILE  33   7.056  -7.268 -12.730
  228    HA   ILE  33           HA       ILE  33   8.728  -7.108 -14.917
  229    HB   ILE  33           HB       ILE  33   9.436  -8.279 -12.225
  230   HG12  ILE  33          1HG1      ILE  33   8.431  -6.064 -12.002
  231   HG13  ILE  33          2HG1      ILE  33  10.157  -5.984 -11.668
  232   HG21  ILE  33          1HG2      ILE  33  11.207  -6.978 -14.288
  233   HG22  ILE  33          2HG2      ILE  33  11.712  -7.652 -12.739
  234   HG23  ILE  33          3HG2      ILE  33  11.091  -8.714 -14.003
  235   HD11  ILE  33          3HD1      ILE  33   8.614  -4.551 -13.598
  236   HD12  ILE  33          1HD1      ILE  33  10.301  -4.338 -13.133
  237   HD13  ILE  33          2HD1      ILE  33   9.875  -5.481 -14.407
  238    HA   PRO  34           HA       PRO  34   8.727 -11.203 -16.589
  239    HB2  PRO  34           1HB      PRO  34  10.872 -10.909 -18.228
  240    HB3  PRO  34           2HB      PRO  34   9.287 -10.212 -18.585
  241    HG2  PRO  34           1HG      PRO  34  11.709  -8.906 -17.407
  242    HG3  PRO  34           2HG      PRO  34  10.598  -8.292 -18.645
  243    HD2  PRO  34           1HD      PRO  34  10.456  -7.527 -16.051
  244    HD3  PRO  34           2HD      PRO  34   9.022  -7.649 -17.090
  245    H    ASP  35           H        ASP  35   9.500 -13.026 -15.742
  246    HA   ASP  35           HA       ASP  35  11.681 -13.039 -13.921
  247    HB2  ASP  35           1HB      ASP  35  10.319 -15.410 -15.214
  248    HB3  ASP  35           2HB      ASP  35  11.283 -15.427 -13.740
  249    H    ASP  36           H        ASP  36  11.521 -13.232 -17.294
  250    HA   ASP  36           HA       ASP  36  13.849 -14.875 -17.686
  251    HB2  ASP  36           1HB      ASP  36  12.635 -13.002 -19.714
  252    HB3  ASP  36           2HB      ASP  36  13.561 -14.472 -20.007
  253    H    TRP  37           H        TRP  37  13.266 -11.599 -16.942
  254    HA   TRP  37           HA       TRP  37  15.320 -10.234 -18.176
  255    HB2  TRP  37           1HB      TRP  37  13.451  -9.580 -16.324
  256    HB3  TRP  37           2HB      TRP  37  14.903  -9.562 -15.327
  257    HD1  TRP  37           HD1      TRP  37  16.248  -7.379 -15.357
  258    HE1  TRP  37           HE1      TRP  37  16.294  -5.270 -16.832
  259    HE3  TRP  37           HE3      TRP  37  12.999  -8.873 -19.010
  260    HZ2  TRP  37           HZ2      TRP  37  15.108  -4.360 -19.227
  261    HZ3  TRP  37           HZ3      TRP  37  12.508  -7.324 -20.858
  262    HH2  TRP  37           HH2      TRP  37  13.542  -5.114 -20.962
  263    H    CYS  38           H        CYS  38  17.479 -10.145 -17.985
  264    HA   CYS  38           HA       CYS  38  18.721 -11.722 -15.828
  265    HB2  CYS  38           1HB      CYS  38  20.632 -12.040 -17.438
  266    HB3  CYS  38           2HB      CYS  38  19.133 -12.836 -17.904
  267    HG   CYS  38           HG       CYS  38  20.414  -9.961 -19.243
  268    H    CYS  39           H        CYS  39  20.000 -10.654 -14.472
  269    HA   CYS  39           HA       CYS  39  20.925  -7.972 -15.258
  270    HB2  CYS  39           1HB      CYS  39  19.708  -9.020 -12.814
  271    HB3  CYS  39           2HB      CYS  39  21.175  -8.098 -12.510
  272    HG   CYS  39           HG       CYS  39  20.087  -5.787 -12.698
  273    HA   PRO  40           HA       PRO  40  25.136  -9.099 -14.787
  274    HB2  PRO  40           1HB      PRO  40  26.203  -6.926 -13.557
  275    HB3  PRO  40           2HB      PRO  40  25.680  -6.914 -15.246
  276    HG2  PRO  40           1HG      PRO  40  24.252  -5.911 -12.813
  277    HG3  PRO  40           2HG      PRO  40  24.401  -5.160 -14.413
  278    HD2  PRO  40           1HD      PRO  40  22.182  -6.502 -13.635
  279    HD3  PRO  40           2HD      PRO  40  22.735  -6.468 -15.321
  280    H    ASP  41           H        ASP  41  23.954  -7.532 -11.805
  281    HA   ASP  41           HA       ASP  41  25.765  -9.051 -10.160
  282    HB2  ASP  41           1HB      ASP  41  23.886  -6.824  -9.791
  283    HB3  ASP  41           2HB      ASP  41  23.964  -7.930  -8.422
  284    H    CYS  42           H        CYS  42  22.221  -8.891 -10.497
  285    HA   CYS  42           HA       CYS  42  21.579 -10.949  -8.743
  286    HB2  CYS  42           1HB      CYS  42  19.908  -9.424  -9.689
  287    HB3  CYS  42           2HB      CYS  42  20.143 -10.139 -11.279
  288    HG   CYS  42           HG       CYS  42  18.824 -12.409 -10.865
  289    H    SER  43           H        SER  43  22.981 -11.082 -11.884
  290    HA   SER  43           HA       SER  43  22.217 -13.540 -12.854
  291    HB2  SER  43           1HB      SER  43  23.614 -12.630 -14.386
  292    HB3  SER  43           2HB      SER  43  24.573 -11.802 -13.159
  293    HG   SER  43           HG       SER  43  25.412 -13.771 -14.481
  294    H    VAL  44           H        VAL  44  24.452 -12.808 -10.257
  295    HA   VAL  44           HA       VAL  44  24.844 -15.698  -9.827
  296    HB   VAL  44           HB       VAL  44  26.875 -15.068  -8.531
  297   HG11  VAL  44          1HG1      VAL  44  27.064 -15.810 -10.840
  298   HG12  VAL  44          2HG1      VAL  44  26.824 -14.156 -11.407
  299   HG13  VAL  44          3HG1      VAL  44  28.270 -14.573 -10.487
  300   HG21  VAL  44          3HG2      VAL  44  26.370 -12.325  -9.685
  301   HG22  VAL  44          1HG2      VAL  44  26.229 -12.772  -7.985
  302   HG23  VAL  44          2HG2      VAL  44  27.801 -12.823  -8.782
  303    H    ARG  45           H        ARG  45  22.654 -13.854  -8.901
  304    HA   ARG  45           HA       ARG  45  22.736 -14.674  -6.104
  305    HB2  ARG  45           1HB      ARG  45  22.373 -11.830  -7.035
  306    HB3  ARG  45           2HB      ARG  45  21.823 -12.384  -5.459
  307    HG2  ARG  45           1HG      ARG  45  24.662 -12.768  -6.327
  308    HG3  ARG  45           2HG      ARG  45  24.112 -11.245  -5.626
  309    HD2  ARG  45           1HD      ARG  45  24.823 -12.342  -3.743
  310    HD3  ARG  45           2HD      ARG  45  23.125 -12.817  -3.774
  311    HE   ARG  45           HE       ARG  45  24.713 -14.684  -5.194
  312   HH11  ARG  45          1HH1      ARG  45  23.906 -13.650  -1.969
  313   HH12  ARG  45          2HH1      ARG  45  24.217 -15.197  -1.255
  314   HH21  ARG  45          1HH2      ARG  45  25.126 -16.726  -4.265
  315   HH22  ARG  45          2HH2      ARG  45  24.912 -16.946  -2.561
  316    H    GLU  46           H        GLU  46  20.909 -15.704  -5.670
  317    HA   GLU  46           HA       GLU  46  18.753 -15.935  -7.402
  318    HB2  GLU  46           1HB      GLU  46  19.066 -16.461  -4.462
  319    HB3  GLU  46           2HB      GLU  46  17.512 -16.690  -5.252
  320    HG2  GLU  46           1HG      GLU  46  18.404 -18.798  -5.355
  321    HG3  GLU  46           2HG      GLU  46  18.868 -18.140  -6.923
  322    H    LYS  47           H        LYS  47  16.827 -14.910  -7.653
  323    HA   LYS  47           HA       LYS  47  16.610 -12.204  -6.937
  324    HB2  LYS  47           1HB      LYS  47  15.383 -13.768  -8.760
  325    HB3  LYS  47           2HB      LYS  47  14.111 -13.672  -7.550
  326    HG2  LYS  47           1HG      LYS  47  13.779 -11.435  -7.872
  327    HG3  LYS  47           2HG      LYS  47  15.436 -11.154  -8.411
  328    HD2  LYS  47           1HD      LYS  47  14.992 -12.038 -10.555
  329    HD3  LYS  47           2HD      LYS  47  13.463 -12.748 -10.030
  330    HE2  LYS  47           1HE      LYS  47  13.209 -10.688 -11.406
  331    HE3  LYS  47           2HE      LYS  47  12.459 -10.586  -9.814
  332    HZ1  LYS  47           3HZ      LYS  47  13.897  -9.007  -9.141
  333    HZ2  LYS  47           1HZ      LYS  47  14.047  -8.706 -10.799
  334    HZ3  LYS  47           2HZ      LYS  47  15.204  -9.647 -10.002
  335    H    VAL  48           H        VAL  48  15.675 -15.099  -5.296
  336    HA   VAL  48           HA       VAL  48  13.673 -14.063  -3.607
  337    HB   VAL  48           HB       VAL  48  14.137 -16.490  -3.920
  338   HG11  VAL  48          1HG1      VAL  48  16.168 -16.599  -1.828
  339   HG12  VAL  48          2HG1      VAL  48  16.075 -17.461  -3.365
  340   HG13  VAL  48          3HG1      VAL  48  16.728 -15.823  -3.310
  341   HG21  VAL  48          3HG2      VAL  48  13.341 -17.084  -1.831
  342   HG22  VAL  48          1HG2      VAL  48  14.345 -15.897  -0.997
  343   HG23  VAL  48          2HG2      VAL  48  12.929 -15.371  -1.907
  344    H    ASP  49           H        ASP  49  17.022 -13.509  -3.702
  345    HA   ASP  49           HA       ASP  49  17.604 -13.100  -0.982
  346    HB2  ASP  49           1HB      ASP  49  19.247 -13.243  -2.920
  347    HB3  ASP  49           2HB      ASP  49  18.844 -11.563  -3.263
  348    H    PHE  50           H        PHE  50  15.766 -11.260  -3.221
  349    HA   PHE  50           HA       PHE  50  16.052  -8.698  -2.053
  350    HB2  PHE  50           1HB      PHE  50  14.203  -9.975  -3.990
  351    HB3  PHE  50           2HB      PHE  50  13.612  -8.531  -3.174
  352    HD1  PHE  50           HD2      PHE  50  16.075  -9.868  -5.520
  353    HD2  PHE  50           HD1      PHE  50  14.613  -6.374  -3.577
  354    HE1  PHE  50           HE2      PHE  50  17.328  -8.466  -7.106
  355    HE2  PHE  50           HE1      PHE  50  15.863  -4.967  -5.162
  356    HZ   PHE  50           HZ       PHE  50  17.223  -6.012  -6.929
  357    H    GLU  51           H        GLU  51  15.139  -7.800  -0.310
  358    HA   GLU  51           HA       GLU  51  13.037  -9.330   1.077
  359    HB2  GLU  51           1HB      GLU  51  15.011  -7.478   2.406
  360    HB3  GLU  51           2HB      GLU  51  13.924  -8.625   3.176
  361    HG2  GLU  51           1HG      GLU  51  15.195 -10.460   2.062
  362    HG3  GLU  51           2HG      GLU  51  16.351  -9.248   1.514
  363    H    ARG  52           H        ARG  52  11.611  -7.999   2.473
  364    HA   ARG  52           HA       ARG  52  10.895  -5.535   1.063
  365    HB2  ARG  52           1HB      ARG  52   9.142  -7.229   1.292
  366    HB3  ARG  52           2HB      ARG  52   9.324  -7.195   3.041
  367    HG2  ARG  52           1HG      ARG  52   8.310  -5.133   3.242
  368    HG3  ARG  52           2HG      ARG  52   8.649  -4.689   1.568
  369    HD2  ARG  52           1HD      ARG  52   6.601  -5.351   1.025
  370    HD3  ARG  52           2HD      ARG  52   7.058  -6.998   1.457
  371    HE   ARG  52           HE       ARG  52   5.416  -5.190   2.985
  372   HH11  ARG  52          1HH1      ARG  52   7.450  -8.013   3.080
  373   HH12  ARG  52          2HH1      ARG  52   6.730  -8.644   4.524
  374   HH21  ARG  52          1HH2      ARG  52   4.460  -6.010   4.887
  375   HH22  ARG  52          2HH2      ARG  52   5.029  -7.504   5.550
  376    H    MET  53           H        MET  53  10.718  -3.567   2.067
  377    HA   MET  53           HA       MET  53  12.161  -3.293   4.568
  378    HB2  MET  53           1HB      MET  53  11.301  -1.473   2.384
  379    HB3  MET  53           2HB      MET  53  11.480  -0.767   3.984
  380    HG2  MET  53           1HG      MET  53  13.645  -2.407   2.716
  381    HG3  MET  53           2HG      MET  53  13.485  -0.675   2.432
  382    HE1  MET  53           3HE      MET  53  15.182  -3.144   3.842
  383    HE2  MET  53           1HE      MET  53  16.212  -2.336   5.024
  384    HE3  MET  53           2HE      MET  53  14.807  -3.255   5.562
  385    H    GLY  54           H        GLY  54   9.091  -1.925   3.350
  386    HA2  GLY  54           1HA      GLY  54   7.005  -2.103   4.467
  387    HA3  GLY  54           2HA      GLY  54   7.862  -2.522   5.943
  388    H    GLY  55           H        GLY  55   7.402   0.180   3.672
  389    HA2  GLY  55           1HA      GLY  55   7.876   2.040   5.902
  390    HA3  GLY  55           2HA      GLY  55   7.950   2.454   4.196
  391    H    LYS  56           H        LYS  56   5.914   2.484   2.996
  392    HA   LYS  56           HA       LYS  56   3.854   3.765   4.554
  393    HB2  LYS  56           1HB      LYS  56   4.723   4.266   2.100
  394    HB3  LYS  56           2HB      LYS  56   3.478   3.101   1.669
  395    HG2  LYS  56           1HG      LYS  56   2.501   5.245   1.504
  396    HG3  LYS  56           2HG      LYS  56   1.854   4.505   2.970
  397    HD2  LYS  56           1HD      LYS  56   3.409   5.774   4.331
  398    HD3  LYS  56           2HD      LYS  56   4.156   6.456   2.884
  399    HE2  LYS  56           1HE      LYS  56   2.046   7.548   2.310
  400    HE3  LYS  56           2HE      LYS  56   1.290   6.853   3.743
  401    HZ1  LYS  56           3HZ      LYS  56   2.378   9.274   3.691
  402    HZ2  LYS  56           1HZ      LYS  56   3.720   8.378   4.200
  403    HZ3  LYS  56           2HZ      LYS  56   2.285   8.333   5.094
  Start of MODEL    4
    1    H1   MET   1           H        MET   1   2.231  -0.335   2.192
    2    HA   MET   1           HA       MET   1   1.257  -1.218  -0.443
    3    HB2  MET   1           1HB      MET   1   3.089   1.095   0.200
    4    HB3  MET   1           2HB      MET   1   2.875   0.448  -1.421
    5    HG2  MET   1           1HG      MET   1   1.388   2.165  -1.476
    6    HG3  MET   1           2HG      MET   1   0.339   0.868  -0.910
    7    HE1  MET   1           3HE      MET   1   0.825   4.062  -0.943
    8    HE2  MET   1           1HE      MET   1  -0.095   4.632   0.450
    9    HE3  MET   1           2HE      MET   1   1.668   4.641   0.494
   10    H    THR   2           H        THR   2   2.923  -2.061  -1.876
   11    HA   THR   2           HA       THR   2   4.878  -3.622  -0.379
   12    HB   THR   2           HB       THR   2   4.026  -3.789  -3.276
   13    HG1  THR   2           HG1      THR   2   3.516  -5.543  -1.087
   14   HG21  THR   2          3HG2      THR   2   6.108  -4.725  -3.419
   15   HG22  THR   2          1HG2      THR   2   5.203  -6.133  -2.865
   16   HG23  THR   2          2HG2      THR   2   6.141  -5.180  -1.715
   17    H    ALA   3           H        ALA   3   7.078  -3.586  -0.743
   18    HA   ALA   3           HA       ALA   3   8.210  -1.849  -2.761
   19    HB1  ALA   3           1HB      ALA   3   7.611  -0.467  -0.648
   20    HB2  ALA   3           2HB      ALA   3   9.033  -1.245   0.049
   21    HB3  ALA   3           3HB      ALA   3   9.191  -0.257  -1.403
   22    H    TYR   4           H        TYR   4   9.771  -3.051  -3.603
   23    HA   TYR   4           HA       TYR   4  11.327  -4.801  -1.818
   24    HB2  TYR   4           1HB      TYR   4  10.545  -5.068  -4.711
   25    HB3  TYR   4           2HB      TYR   4  11.898  -5.976  -4.045
   26    HD1  TYR   4           HD1      TYR   4  11.514  -7.704  -2.338
   27    HD2  TYR   4           HD2      TYR   4   8.275  -5.636  -4.164
   28    HE1  TYR   4           HE1      TYR   4   9.960  -9.426  -1.519
   29    HE2  TYR   4           HE2      TYR   4   6.712  -7.351  -3.349
   30    HH   TYR   4           HH       TYR   4   7.369 -10.198  -2.535
   31    H    ARG   5           H        ARG   5  13.350  -4.214  -1.443
   32    HA   ARG   5           HA       ARG   5  14.796  -2.703  -3.513
   33    HB2  ARG   5           1HB      ARG   5  14.242  -1.068  -1.879
   34    HB3  ARG   5           2HB      ARG   5  14.655  -2.149  -0.554
   35    HG2  ARG   5           1HG      ARG   5  16.818  -1.595  -0.620
   36    HG3  ARG   5           2HG      ARG   5  16.871  -1.626  -2.384
   37    HD2  ARG   5           1HD      ARG   5  17.082   0.600  -2.211
   38    HD3  ARG   5           2HD      ARG   5  15.343   0.579  -1.919
   39    HE   ARG   5           HE       ARG   5  16.798   0.217   0.494
   40   HH11  ARG   5          1HH1      ARG   5  15.822   2.627  -1.821
   41   HH12  ARG   5          2HH1      ARG   5  15.867   3.930  -0.679
   42   HH21  ARG   5          1HH2      ARG   5  16.861   1.923   2.007
   43   HH22  ARG   5          2HH2      ARG   5  16.459   3.528   1.498
   44    H    CYS   6           H        CYS   6  16.485  -3.834  -4.183
   45    HA   CYS   6           HA       CYS   6  18.264  -5.086  -2.273
   46    HB2  CYS   6           1HB      CYS   6  16.324  -6.625  -3.754
   47    HB3  CYS   6           2HB      CYS   6  17.955  -7.084  -4.230
   48    HG   CYS   6           HG       CYS   6  17.278  -6.887  -0.917
   49    HA   PRO   7           HA       PRO   7  20.470  -3.123  -5.779
   50    HB2  PRO   7           1HB      PRO   7  22.537  -2.245  -4.254
   51    HB3  PRO   7           2HB      PRO   7  21.020  -1.354  -4.420
   52    HG2  PRO   7           1HG      PRO   7  21.923  -3.161  -2.211
   53    HG3  PRO   7           2HG      PRO   7  21.097  -1.595  -2.109
   54    HD2  PRO   7           1HD      PRO   7  19.793  -3.951  -1.823
   55    HD3  PRO   7           2HD      PRO   7  19.028  -2.517  -2.535
   56    H    VAL   8           H        VAL   8  21.304  -5.522  -3.429
   57    HA   VAL   8           HA       VAL   8  23.888  -6.206  -4.270
   58    HB   VAL   8           HB       VAL   8  21.784  -8.061  -3.148
   59   HG11  VAL   8          1HG1      VAL   8  24.113  -9.007  -2.216
   60   HG12  VAL   8          2HG1      VAL   8  23.382  -9.557  -3.725
   61   HG13  VAL   8          3HG1      VAL   8  24.662  -8.344  -3.755
   62   HG21  VAL   8          3HG2      VAL   8  21.903  -6.683  -1.377
   63   HG22  VAL   8          1HG2      VAL   8  23.460  -7.462  -1.089
   64   HG23  VAL   8          2HG2      VAL   8  23.389  -5.921  -1.944
   65    H    CYS   9           H        CYS   9  20.853  -6.654  -5.786
   66    HA   CYS   9           HA       CYS   9  22.070  -8.518  -7.718
   67    HB2  CYS   9           1HB      CYS   9  19.108  -8.274  -7.537
   68    HB3  CYS   9           2HB      CYS   9  20.098  -9.674  -7.930
   69    HG   CYS   9           HG       CYS   9  20.882 -10.099  -5.249
   70    H    ASP  10           H        ASP  10  19.491  -6.063  -7.495
   71    HA   ASP  10           HA       ASP  10  20.545  -4.701  -9.821
   72    HB2  ASP  10           1HB      ASP  10  18.545  -4.867 -11.163
   73    HB3  ASP  10           2HB      ASP  10  19.094  -6.494 -10.770
   74    H    TYR  11           H        TYR  11  19.382  -2.670 -10.262
   75    HA   TYR  11           HA       TYR  11  19.100  -1.063  -8.069
   76    HB2  TYR  11           1HB      TYR  11  18.136  -0.889 -10.879
   77    HB3  TYR  11           2HB      TYR  11  17.468   0.257  -9.722
   78    HD1  TYR  11           HD2      TYR  11  20.849  -1.149 -10.509
   79    HD2  TYR  11           HD1      TYR  11  18.503   2.309  -9.707
   80    HE1  TYR  11           HE2      TYR  11  22.850   0.259 -10.757
   81    HE2  TYR  11           HE1      TYR  11  20.497   3.726  -9.954
   82    HH   TYR  11           HH       TYR  11  22.646   3.788 -10.587
   83    H    THR  12           H        THR  12  17.244  -0.049  -7.077
   84    HA   THR  12           HA       THR  12  14.983  -1.916  -6.834
   85    HB   THR  12           HB       THR  12  16.032  -1.676  -4.716
   86    HG1  THR  12           HG1      THR  12  13.603  -1.205  -4.988
   87   HG21  THR  12          3HG2      THR  12  15.841   1.011  -3.994
   88   HG22  THR  12          1HG2      THR  12  16.512   1.027  -5.624
   89   HG23  THR  12          2HG2      THR  12  17.316   0.113  -4.348
   90    H    TYR  13           H        TYR  13  12.897  -1.214  -7.047
   91    HA   TYR  13           HA       TYR  13  12.356   1.620  -7.423
   92    HB2  TYR  13           1HB      TYR  13  11.041   0.982  -9.561
   93    HB3  TYR  13           2HB      TYR  13  12.787   1.172  -9.675
   94    HD1  TYR  13           HD1      TYR  13  14.239  -0.818  -9.870
   95    HD2  TYR  13           HD2      TYR  13   9.997  -1.143  -9.917
   96    HE1  TYR  13           HE1      TYR  13  14.429  -3.086 -10.803
   97    HE2  TYR  13           HE2      TYR  13  10.175  -3.412 -10.848
   98    HH   TYR  13           HH       TYR  13  11.910  -5.266 -10.862
   99    H    ASP  14           H        ASP  14  10.845   1.843  -5.894
  100    HA   ASP  14           HA       ASP  14   8.987  -0.192  -5.186
  101    HB2  ASP  14           1HB      ASP  14   9.573   1.348  -3.479
  102    HB3  ASP  14           2HB      ASP  14   9.201   2.736  -4.498
  103    H    GLU  15           H        GLU  15   6.765  -0.304  -5.551
  104    HA   GLU  15           HA       GLU  15   5.863   0.289  -8.109
  105    HB2  GLU  15           1HB      GLU  15   4.820  -0.955  -5.775
  106    HB3  GLU  15           2HB      GLU  15   3.617   0.192  -6.348
  107    HG2  GLU  15           1HG      GLU  15   4.817  -1.478  -8.437
  108    HG3  GLU  15           2HG      GLU  15   3.872  -2.351  -7.233
  109    H    GLY  16           H        GLY  16   5.155   1.994  -5.063
  110    HA2  GLY  16           1HA      GLY  16   3.588   4.024  -6.297
  111    HA3  GLY  16           2HA      GLY  16   4.257   4.076  -4.673
  112    H    LYS  17           H        LYS  17   7.006   3.710  -5.578
  113    HA   LYS  17           HA       LYS  17   7.749   6.399  -5.861
  114    HB2  LYS  17           1HB      LYS  17   9.236   4.686  -4.924
  115    HB3  LYS  17           2HB      LYS  17   9.345   3.911  -6.500
  116    HG2  LYS  17           1HG      LYS  17  11.236   5.111  -6.655
  117    HG3  LYS  17           2HG      LYS  17  10.135   6.398  -7.150
  118    HD2  LYS  17           1HD      LYS  17  10.084   7.284  -4.913
  119    HD3  LYS  17           2HD      LYS  17  11.027   5.920  -4.308
  120    HE2  LYS  17           1HE      LYS  17  12.548   7.710  -4.528
  121    HE3  LYS  17           2HE      LYS  17  12.852   6.648  -5.902
  122    HZ1  LYS  17           3HZ      LYS  17  11.815   8.120  -7.359
  123    HZ2  LYS  17           1HZ      LYS  17  12.712   9.132  -6.343
  124    HZ3  LYS  17           2HZ      LYS  17  11.043   8.975  -6.120
  125    H    GLY  18           H        GLY  18   7.121   3.894  -8.227
  126    HA2  GLY  18           1HA      GLY  18   6.883   3.991 -10.508
  127    HA3  GLY  18           2HA      GLY  18   6.697   5.728 -10.321
  128    H    ASP  19           H        ASP  19   8.808   3.162 -11.205
  129    HA   ASP  19           HA       ASP  19  10.922   5.123 -11.815
  130    HB2  ASP  19           1HB      ASP  19  11.194   2.186 -11.146
  131    HB3  ASP  19           2HB      ASP  19  12.519   3.214 -11.683
  132    HA   PRO  20           HA       PRO  20   9.282   3.486 -15.825
  133    HB2  PRO  20           1HB      PRO  20   9.315   5.894 -17.079
  134    HB3  PRO  20           2HB      PRO  20   7.952   5.339 -16.099
  135    HG2  PRO  20           1HG      PRO  20  10.176   7.206 -15.369
  136    HG3  PRO  20           2HG      PRO  20   8.443   7.339 -15.018
  137    HD2  PRO  20           1HD      PRO  20  10.238   6.472 -13.185
  138    HD3  PRO  20           2HD      PRO  20   8.564   5.883 -13.235
  139    H    ARG  21           H        ARG  21  12.112   4.961 -14.689
  140    HA   ARG  21           HA       ARG  21  13.521   5.217 -17.154
  141    HB2  ARG  21           1HB      ARG  21  15.430   5.706 -15.846
  142    HB3  ARG  21           2HB      ARG  21  14.067   6.380 -14.962
  143    HG2  ARG  21           1HG      ARG  21  14.130   4.037 -13.757
  144    HG3  ARG  21           2HG      ARG  21  15.810   4.071 -14.296
  145    HD2  ARG  21           1HD      ARG  21  15.248   6.619 -13.238
  146    HD3  ARG  21           2HD      ARG  21  14.581   5.446 -12.104
  147    HE   ARG  21           HE       ARG  21  16.711   4.887 -11.509
  148   HH11  ARG  21          1HH1      ARG  21  16.798   6.492 -14.598
  149   HH12  ARG  21          2HH1      ARG  21  18.528   6.542 -14.669
  150   HH21  ARG  21          1HH2      ARG  21  18.989   4.947 -11.592
  151   HH22  ARG  21          2HH2      ARG  21  19.774   5.662 -12.959
  152    H    GLU  22           H        GLU  22  12.984   2.627 -14.886
  153    HA   GLU  22           HA       GLU  22  14.964   0.933 -16.210
  154    HB2  GLU  22           1HB      GLU  22  13.432   0.778 -13.651
  155    HB3  GLU  22           2HB      GLU  22  14.005  -0.716 -14.380
  156    HG2  GLU  22           1HG      GLU  22  15.766  -0.243 -13.029
  157    HG3  GLU  22           2HG      GLU  22  16.279   0.599 -14.490
  158    H    GLY  23           H        GLY  23  12.382   1.830 -17.440
  159    HA2  GLY  23           1HA      GLY  23  10.941   0.876 -18.968
  160    HA3  GLY  23           2HA      GLY  23  11.691  -0.677 -18.631
  161    H    PHE  24           H        PHE  24  10.510   1.058 -15.920
  162    HA   PHE  24           HA       PHE  24   7.984  -0.432 -15.951
  163    HB2  PHE  24           1HB      PHE  24   9.888  -0.348 -13.602
  164    HB3  PHE  24           2HB      PHE  24   8.303  -1.113 -13.618
  165    HD1  PHE  24           HD2      PHE  24   8.098  -2.718 -15.867
  166    HD2  PHE  24           HD1      PHE  24  11.615  -1.839 -13.637
  167    HE1  PHE  24           HE2      PHE  24   9.118  -4.814 -16.656
  168    HE2  PHE  24           HE1      PHE  24  12.641  -3.933 -14.423
  169    HZ   PHE  24           HZ       PHE  24  11.392  -5.424 -15.933
  170    HA   PRO  25           HA       PRO  25   7.248   3.965 -14.834
  171    HB2  PRO  25           1HB      PRO  25   4.873   4.115 -16.141
  172    HB3  PRO  25           2HB      PRO  25   6.429   4.362 -16.943
  173    HG2  PRO  25           1HG      PRO  25   4.699   1.919 -16.874
  174    HG3  PRO  25           2HG      PRO  25   5.571   2.634 -18.242
  175    HD2  PRO  25           1HD      PRO  25   6.506   0.490 -16.877
  176    HD3  PRO  25           2HD      PRO  25   7.581   1.697 -17.612
  177    H    ALA  26           H        ALA  26   5.162   4.927 -13.889
  178    HA   ALA  26           HA       ALA  26   4.486   3.644 -11.543
  179    HB1  ALA  26           1HB      ALA  26   3.083   5.397 -11.126
  180    HB2  ALA  26           2HB      ALA  26   4.054   6.094 -12.423
  181    HB3  ALA  26           3HB      ALA  26   2.457   5.434 -12.775
  182    H    GLY  27           H        GLY  27   3.227   1.972 -11.042
  183    HA2  GLY  27           1HA      GLY  27   1.017   0.936 -11.217
  184    HA3  GLY  27           2HA      GLY  27   1.109   1.203 -12.952
  185    H    THR  28           H        THR  28   3.984   0.375 -12.938
  186    HA   THR  28           HA       THR  28   3.698  -2.258 -13.739
  187    HB   THR  28           HB       THR  28   6.223  -1.073 -12.574
  188    HG1  THR  28           HG1      THR  28   5.473  -1.063 -15.311
  189   HG21  THR  28          3HG2      THR  28   6.365  -2.893 -14.867
  190   HG22  THR  28          1HG2      THR  28   5.755  -3.639 -13.391
  191   HG23  THR  28          2HG2      THR  28   7.333  -2.850 -13.394
  192    H    ARG  29           H        ARG  29   3.378  -4.105 -12.692
  193    HA   ARG  29           HA       ARG  29   3.386  -4.163  -9.811
  194    HB2  ARG  29           1HB      ARG  29   2.693  -6.185 -11.934
  195    HB3  ARG  29           2HB      ARG  29   2.726  -6.603 -10.226
  196    HG2  ARG  29           1HG      ARG  29   1.135  -4.554  -9.981
  197    HG3  ARG  29           2HG      ARG  29   0.854  -4.817 -11.703
  198    HD2  ARG  29           1HD      ARG  29   0.446  -6.809  -9.477
  199    HD3  ARG  29           2HD      ARG  29  -0.811  -6.003 -10.415
  200    HE   ARG  29           HE       ARG  29   0.761  -8.279 -11.210
  201   HH11  ARG  29          1HH1      ARG  29  -1.167  -5.593 -12.301
  202   HH12  ARG  29          2HH1      ARG  29  -1.563  -6.326 -13.820
  203   HH21  ARG  29          1HH2      ARG  29   0.247  -9.254 -13.207
  204   HH22  ARG  29          2HH2      ARG  29  -0.759  -8.409 -14.334
  205    H    TRP  30           H        TRP  30   5.035  -4.737  -8.569
  206    HA   TRP  30           HA       TRP  30   7.573  -5.349  -9.484
  207    HB2  TRP  30           1HB      TRP  30   7.944  -6.233  -7.114
  208    HB3  TRP  30           2HB      TRP  30   7.384  -4.570  -7.262
  209    HD1  TRP  30           HD1      TRP  30   5.019  -3.981  -6.265
  210    HE1  TRP  30           HE1      TRP  30   3.355  -5.277  -4.790
  211    HE3  TRP  30           HE3      TRP  30   7.038  -8.659  -6.683
  212    HZ2  TRP  30           HZ2      TRP  30   2.953  -7.931  -3.917
  213    HZ3  TRP  30           HZ3      TRP  30   5.954 -10.522  -5.496
  214    HH2  TRP  30           HH2      TRP  30   3.954 -10.163  -4.142
  215    H    ASP  31           H        ASP  31   4.863  -7.452  -8.899
  216    HA   ASP  31           HA       ASP  31   6.431  -9.874  -9.014
  217    HB2  ASP  31           1HB      ASP  31   4.421 -11.035  -8.635
  218    HB3  ASP  31           2HB      ASP  31   4.232  -9.537  -7.729
  219    H    GLN  32           H        GLN  32   4.606  -7.876 -11.207
  220    HA   GLN  32           HA       GLN  32   4.305  -9.754 -13.300
  221    HB2  GLN  32           1HB      GLN  32   2.974  -7.709 -13.197
  222    HB3  GLN  32           2HB      GLN  32   4.424  -6.735 -13.402
  223    HG2  GLN  32           1HG      GLN  32   2.952  -7.087 -15.440
  224    HG3  GLN  32           2HG      GLN  32   4.682  -7.371 -15.630
  225   HE21  GLN  32          2HE2      GLN  32   1.832  -9.210 -14.570
  226   HE22  GLN  32          1HE2      GLN  32   2.180 -10.616 -15.511
  227    H    ILE  33           H        ILE  33   7.018  -8.085 -12.114
  228    HA   ILE  33           HA       ILE  33   8.580  -7.594 -14.330
  229    HB   ILE  33           HB       ILE  33   9.539  -8.730 -11.701
  230   HG12  ILE  33          1HG1      ILE  33   8.188  -6.691 -11.422
  231   HG13  ILE  33          2HG1      ILE  33   9.881  -6.398 -11.038
  232   HG21  ILE  33          1HG2      ILE  33  11.675  -7.738 -12.244
  233   HG22  ILE  33          2HG2      ILE  33  11.192  -8.847 -13.526
  234   HG23  ILE  33          3HG2      ILE  33  11.028  -7.107 -13.758
  235   HD11  ILE  33          3HD1      ILE  33   9.968  -4.763 -12.519
  236   HD12  ILE  33          1HD1      ILE  33   9.418  -5.841 -13.802
  237   HD13  ILE  33          2HD1      ILE  33   8.242  -4.979 -12.810
  238    HA   PRO  34           HA       PRO  34   9.169 -11.578 -16.160
  239    HB2  PRO  34           1HB      PRO  34  11.188 -10.892 -17.839
  240    HB3  PRO  34           2HB      PRO  34   9.503 -10.443 -18.129
  241    HG2  PRO  34           1HG      PRO  34  11.726  -8.811 -16.963
  242    HG3  PRO  34           2HG      PRO  34  10.493  -8.339 -18.147
  243    HD2  PRO  34           1HD      PRO  34  10.315  -7.695 -15.523
  244    HD3  PRO  34           2HD      PRO  34   8.886  -8.007 -16.529
  245    H    ASP  35           H        ASP  35  10.172 -13.233 -15.222
  246    HA   ASP  35           HA       ASP  35  12.470 -12.927 -13.580
  247    HB2  ASP  35           1HB      ASP  35  12.345 -15.314 -13.250
  248    HB3  ASP  35           2HB      ASP  35  10.708 -14.663 -13.239
  249    H    ASP  36           H        ASP  36  12.107 -13.197 -16.912
  250    HA   ASP  36           HA       ASP  36  14.533 -14.643 -17.460
  251    HB2  ASP  36           1HB      ASP  36  13.050 -12.889 -19.412
  252    HB3  ASP  36           2HB      ASP  36  14.048 -14.300 -19.752
  253    H    TRP  37           H        TRP  37  13.776 -11.460 -16.587
  254    HA   TRP  37           HA       TRP  37  15.559  -9.885 -17.980
  255    HB2  TRP  37           1HB      TRP  37  13.848  -9.391 -15.986
  256    HB3  TRP  37           2HB      TRP  37  15.340  -9.410 -15.049
  257    HD1  TRP  37           HD1      TRP  37  16.787  -7.266 -15.101
  258    HE1  TRP  37           HE1      TRP  37  16.660  -5.024 -16.358
  259    HE3  TRP  37           HE3      TRP  37  13.052  -8.397 -18.404
  260    HZ2  TRP  37           HZ2      TRP  37  15.173  -3.885 -18.470
  261    HZ3  TRP  37           HZ3      TRP  37  12.336  -6.676 -20.009
  262    HH2  TRP  37           HH2      TRP  37  13.375  -4.467 -20.040
  263    H    CYS  38           H        CYS  38  17.709  -9.668 -18.063
  264    HA   CYS  38           HA       CYS  38  19.314 -11.289 -16.207
  265    HB2  CYS  38           1HB      CYS  38  19.815 -10.366 -19.033
  266    HB3  CYS  38           2HB      CYS  38  21.104 -10.995 -18.014
  267    HG   CYS  38           HG       CYS  38  20.209 -12.968 -19.835
  268    H    CYS  39           H        CYS  39  20.682 -10.331 -14.842
  269    HA   CYS  39           HA       CYS  39  21.387  -7.513 -15.313
  270    HB2  CYS  39           1HB      CYS  39  19.994  -8.714 -13.037
  271    HB3  CYS  39           2HB      CYS  39  21.398  -7.765 -12.565
  272    HG   CYS  39           HG       CYS  39  20.363  -5.429 -12.917
  273    HA   PRO  40           HA       PRO  40  25.570  -8.567 -14.530
  274    HB2  PRO  40           1HB      PRO  40  26.468  -6.426 -13.123
  275    HB3  PRO  40           2HB      PRO  40  26.093  -6.352 -14.849
  276    HG2  PRO  40           1HG      PRO  40  24.435  -5.489 -12.511
  277    HG3  PRO  40           2HG      PRO  40  24.701  -4.665 -14.059
  278    HD2  PRO  40           1HD      PRO  40  22.459  -6.091 -13.533
  279    HD3  PRO  40           2HD      PRO  40  23.155  -5.971 -15.162
  280    H    ASP  41           H        ASP  41  24.092  -7.160 -11.601
  281    HA   ASP  41           HA       ASP  41  25.790  -8.730  -9.875
  282    HB2  ASP  41           1HB      ASP  41  23.948  -6.485  -9.586
  283    HB3  ASP  41           2HB      ASP  41  23.788  -7.662  -8.285
  284    H    CYS  42           H        CYS  42  22.293  -8.577 -10.533
  285    HA   CYS  42           HA       CYS  42  21.508 -10.690  -8.902
  286    HB2  CYS  42           1HB      CYS  42  20.010  -9.041 -10.098
  287    HB3  CYS  42           2HB      CYS  42  20.245  -9.997 -11.557
  288    HG   CYS  42           HG       CYS  42  17.852 -10.906 -10.841
  289    H    SER  43           H        SER  43  23.193 -10.713 -11.902
  290    HA   SER  43           HA       SER  43  22.535 -13.138 -13.023
  291    HB2  SER  43           1HB      SER  43  24.061 -12.148 -14.379
  292    HB3  SER  43           2HB      SER  43  24.919 -11.400 -13.032
  293    HG   SER  43           HG       SER  43  25.347 -13.831 -14.281
  294    H    VAL  44           H        VAL  44  24.692 -12.496 -10.305
  295    HA   VAL  44           HA       VAL  44  25.067 -15.388  -9.938
  296    HB   VAL  44           HB       VAL  44  26.873 -14.753  -8.351
  297   HG11  VAL  44          1HG1      VAL  44  28.385 -13.741 -10.174
  298   HG12  VAL  44          2HG1      VAL  44  27.655 -15.320 -10.470
  299   HG13  VAL  44          3HG1      VAL  44  26.968 -13.875 -11.215
  300   HG21  VAL  44          3HG2      VAL  44  26.449 -11.953  -9.387
  301   HG22  VAL  44          1HG2      VAL  44  25.943 -12.516  -7.794
  302   HG23  VAL  44          2HG2      VAL  44  27.655 -12.484  -8.215
  303    H    ARG  45           H        ARG  45  22.622 -13.901  -9.234
  304    HA   ARG  45           HA       ARG  45  22.473 -14.763  -6.447
  305    HB2  ARG  45           1HB      ARG  45  21.408 -12.076  -7.325
  306    HB3  ARG  45           2HB      ARG  45  21.417 -12.738  -5.695
  307    HG2  ARG  45           1HG      ARG  45  23.919 -12.140  -7.252
  308    HG3  ARG  45           2HG      ARG  45  23.148 -10.990  -6.157
  309    HD2  ARG  45           1HD      ARG  45  23.625 -12.266  -4.278
  310    HD3  ARG  45           2HD      ARG  45  23.837 -13.744  -5.216
  311    HE   ARG  45           HE       ARG  45  25.785 -11.707  -5.791
  312   HH11  ARG  45          1HH1      ARG  45  24.961 -14.397  -3.740
  313   HH12  ARG  45          2HH1      ARG  45  26.604 -14.737  -3.306
  314   HH21  ARG  45          1HH2      ARG  45  27.951 -12.145  -5.227
  315   HH22  ARG  45          2HH2      ARG  45  28.304 -13.455  -4.152
  316    H    GLU  46           H        GLU  46  20.164 -14.798  -5.675
  317    HA   GLU  46           HA       GLU  46  18.487 -15.839  -7.833
  318    HB2  GLU  46           1HB      GLU  46  18.130 -16.048  -4.838
  319    HB3  GLU  46           2HB      GLU  46  17.159 -16.867  -6.053
  320    HG2  GLU  46           1HG      GLU  46  18.840 -18.346  -6.597
  321    HG3  GLU  46           2HG      GLU  46  20.110 -17.290  -5.984
  322    H    LYS  47           H        LYS  47  16.378 -15.152  -8.189
  323    HA   LYS  47           HA       LYS  47  15.878 -12.400  -7.802
  324    HB2  LYS  47           1HB      LYS  47  14.366 -14.705  -8.931
  325    HB3  LYS  47           2HB      LYS  47  13.456 -13.259  -8.513
  326    HG2  LYS  47           1HG      LYS  47  15.890 -13.195 -10.273
  327    HG3  LYS  47           2HG      LYS  47  14.256 -13.430 -10.897
  328    HD2  LYS  47           1HD      LYS  47  14.936 -11.104  -9.126
  329    HD3  LYS  47           2HD      LYS  47  15.210 -11.044 -10.868
  330    HE2  LYS  47           1HE      LYS  47  13.099 -10.198 -10.813
  331    HE3  LYS  47           2HE      LYS  47  12.702 -11.914 -10.903
  332    HZ1  LYS  47           3HZ      LYS  47  12.082 -10.066  -8.866
  333    HZ2  LYS  47           1HZ      LYS  47  13.039 -11.302  -8.217
  334    HZ3  LYS  47           2HZ      LYS  47  11.597 -11.680  -9.016
  335    H    VAL  48           H        VAL  48  15.128 -15.206  -5.927
  336    HA   VAL  48           HA       VAL  48  12.969 -14.103  -4.433
  337    HB   VAL  48           HB       VAL  48  13.427 -16.548  -4.625
  338   HG11  VAL  48          1HG1      VAL  48  15.913 -16.275  -4.274
  339   HG12  VAL  48          2HG1      VAL  48  15.562 -16.099  -2.554
  340   HG13  VAL  48          3HG1      VAL  48  15.152 -17.597  -3.390
  341   HG21  VAL  48          3HG2      VAL  48  12.202 -15.238  -2.661
  342   HG22  VAL  48          1HG2      VAL  48  12.388 -16.992  -2.650
  343   HG23  VAL  48          2HG2      VAL  48  13.490 -15.982  -1.714
  344    H    ASP  49           H        ASP  49  16.247 -13.417  -4.469
  345    HA   ASP  49           HA       ASP  49  16.818 -12.996  -1.748
  346    HB2  ASP  49           1HB      ASP  49  18.483 -13.040  -3.643
  347    HB3  ASP  49           2HB      ASP  49  17.946 -11.415  -4.062
  348    H    PHE  50           H        PHE  50  14.909 -11.218  -3.995
  349    HA   PHE  50           HA       PHE  50  15.035  -8.644  -2.928
  350    HB2  PHE  50           1HB      PHE  50  13.085 -10.163  -4.570
  351    HB3  PHE  50           2HB      PHE  50  12.480  -8.717  -3.768
  352    HD1  PHE  50           HD1      PHE  50  13.809  -6.547  -4.120
  353    HD2  PHE  50           HD2      PHE  50  14.215  -9.994  -6.584
  354    HE1  PHE  50           HE1      PHE  50  14.765  -5.152  -5.908
  355    HE2  PHE  50           HE2      PHE  50  15.172  -8.606  -8.375
  356    HZ   PHE  50           HZ       PHE  50  15.449  -6.182  -8.039
  357    H    GLU  51           H        GLU  51  14.287  -7.729  -1.122
  358    HA   GLU  51           HA       GLU  51  12.414  -9.284   0.540
  359    HB2  GLU  51           1HB      GLU  51  14.505  -7.373   1.581
  360    HB3  GLU  51           2HB      GLU  51  13.511  -8.483   2.513
  361    HG2  GLU  51           1HG      GLU  51  14.681 -10.311   1.086
  362    HG3  GLU  51           2HG      GLU  51  15.881  -9.053   0.796
  363    H    ARG  52           H        ARG  52  10.852  -8.134   1.725
  364    HA   ARG  52           HA       ARG  52  10.020  -5.670   0.455
  365    HB2  ARG  52           1HB      ARG  52   7.961  -5.934   1.689
  366    HB3  ARG  52           2HB      ARG  52   8.404  -7.480   0.977
  367    HG2  ARG  52           1HG      ARG  52   9.300  -8.207   3.142
  368    HG3  ARG  52           2HG      ARG  52   8.808  -6.666   3.847
  369    HD2  ARG  52           1HD      ARG  52   6.461  -7.209   3.103
  370    HD3  ARG  52           2HD      ARG  52   7.046  -8.826   2.714
  371    HE   ARG  52           HE       ARG  52   7.773  -8.246   5.348
  372   HH11  ARG  52          1HH1      ARG  52   4.901  -8.790   3.457
  373   HH12  ARG  52          2HH1      ARG  52   3.990  -9.429   4.784
  374   HH21  ARG  52          1HH2      ARG  52   6.583  -9.085   7.104
  375   HH22  ARG  52          2HH2      ARG  52   4.947  -9.595   6.859
  376    H    MET  53           H        MET  53   9.899  -3.669   1.389
  377    HA   MET  53           HA       MET  53  11.609  -3.219   3.672
  378    HB2  MET  53           1HB      MET  53  10.146  -1.429   1.752
  379    HB3  MET  53           2HB      MET  53  10.882  -0.777   3.210
  380    HG2  MET  53           1HG      MET  53  12.489  -2.462   1.342
  381    HG3  MET  53           2HG      MET  53  12.199  -0.761   0.985
  382    HE1  MET  53           3HE      MET  53  15.560  -2.333   3.326
  383    HE2  MET  53           1HE      MET  53  14.105  -3.329   3.289
  384    HE3  MET  53           2HE      MET  53  14.826  -2.767   1.782
  385    H    GLY  54           H        GLY  54  10.722  -1.362   5.211
  386    HA2  GLY  54           1HA      GLY  54   8.000  -1.258   5.867
  387    HA3  GLY  54           2HA      GLY  54   8.730  -2.553   6.804
  388    H    GLY  55           H        GLY  55   9.070   0.897   6.034
  389    HA2  GLY  55           1HA      GLY  55  10.862   1.478   8.150
  390    HA3  GLY  55           2HA      GLY  55   9.884   2.649   7.277
  391    H    LYS  56           H        LYS  56   7.860   3.240   8.081
  392    HA   LYS  56           HA       LYS  56   7.200   2.229  10.764
  393    HB2  LYS  56           1HB      LYS  56   8.365   4.599  10.528
  394    HB3  LYS  56           2HB      LYS  56   6.729   5.108  10.133
  395    HG2  LYS  56           1HG      LYS  56   5.913   4.538  12.241
  396    HG3  LYS  56           2HG      LYS  56   7.306   3.516  12.604
  397    HD2  LYS  56           1HD      LYS  56   8.735   5.512  12.676
  398    HD3  LYS  56           2HD      LYS  56   7.328   6.523  12.342
  399    HE2  LYS  56           1HE      LYS  56   6.300   5.464  14.430
  400    HE3  LYS  56           2HE      LYS  56   7.927   4.892  14.792
  401    HZ1  LYS  56           3HZ      LYS  56   8.538   7.371  14.433
  402    HZ2  LYS  56           1HZ      LYS  56   7.861   6.882  15.905
  403    HZ3  LYS  56           2HZ      LYS  56   6.898   7.645  14.743
  Start of MODEL    5
    1    H1   MET   1           H        MET   1   2.013  -1.015   1.448
    2    HA   MET   1           HA       MET   1   1.623  -2.107  -1.261
    3    HB2  MET   1           1HB      MET   1   3.254  -0.255  -1.926
    4    HB3  MET   1           2HB      MET   1   1.625   0.235  -1.479
    5    HG2  MET   1           1HG      MET   1   2.445   0.805   0.771
    6    HG3  MET   1           2HG      MET   1   4.077   0.383   0.258
    7    HE1  MET   1           3HE      MET   1   3.988   4.046   0.929
    8    HE2  MET   1           1HE      MET   1   4.533   2.425   1.361
    9    HE3  MET   1           2HE      MET   1   5.391   3.342   0.123
   10    H    THR   2           H        THR   2   3.549  -2.783  -2.408
   11    HA   THR   2           HA       THR   2   5.427  -4.108  -0.616
   12    HB   THR   2           HB       THR   2   5.034  -4.387  -3.602
   13    HG1  THR   2           HG1      THR   2   4.370  -6.590  -2.637
   14   HG21  THR   2          3HG2      THR   2   6.367  -6.579  -3.019
   15   HG22  THR   2          1HG2      THR   2   6.985  -5.594  -1.694
   16   HG23  THR   2          2HG2      THR   2   7.217  -5.073  -3.363
   17    H    ALA   3           H        ALA   3   7.642  -3.838  -0.674
   18    HA   ALA   3           HA       ALA   3   8.784  -1.876  -2.503
   19    HB1  ALA   3           1HB      ALA   3   9.389  -0.309  -0.977
   20    HB2  ALA   3           2HB      ALA   3   7.931  -0.899  -0.177
   21    HB3  ALA   3           3HB      ALA   3   9.516  -1.476   0.340
   22    H    TYR   4           H        TYR   4  10.494  -2.855  -3.346
   23    HA   TYR   4           HA       TYR   4  12.109  -4.610  -1.614
   24    HB2  TYR   4           1HB      TYR   4  11.387  -4.807  -4.524
   25    HB3  TYR   4           2HB      TYR   4  12.832  -5.598  -3.904
   26    HD1  TYR   4           HD1      TYR   4  12.558  -7.280  -2.014
   27    HD2  TYR   4           HD2      TYR   4   9.278  -5.808  -4.289
   28    HE1  TYR   4           HE1      TYR   4  11.201  -9.199  -1.289
   29    HE2  TYR   4           HE2      TYR   4   7.912  -7.722  -3.569
   30    HH   TYR   4           HH       TYR   4   7.880  -9.648  -2.460
   31    H    ARG   5           H        ARG   5  14.062  -3.873  -1.150
   32    HA   ARG   5           HA       ARG   5  15.435  -2.160  -3.110
   33    HB2  ARG   5           1HB      ARG   5  14.424  -0.992  -1.015
   34    HB3  ARG   5           2HB      ARG   5  15.768  -1.735  -0.158
   35    HG2  ARG   5           1HG      ARG   5  16.280  -0.128  -2.621
   36    HG3  ARG   5           2HG      ARG   5  15.996   0.677  -1.076
   37    HD2  ARG   5           1HD      ARG   5  17.839  -0.550  -0.075
   38    HD3  ARG   5           2HD      ARG   5  18.096  -1.428  -1.582
   39    HE   ARG   5           HE       ARG   5  18.290   1.258  -2.201
   40   HH11  ARG   5          1HH1      ARG   5  19.938  -1.022  -0.150
   41   HH12  ARG   5          2HH1      ARG   5  21.466  -0.212  -0.256
   42   HH21  ARG   5          1HH2      ARG   5  20.296   2.334  -2.348
   43   HH22  ARG   5          2HH2      ARG   5  21.668   1.698  -1.506
   44    H    CYS   6           H        CYS   6  16.944  -3.542  -3.856
   45    HA   CYS   6           HA       CYS   6  19.014  -4.392  -2.023
   46    HB2  CYS   6           1HB      CYS   6  17.098  -6.209  -2.308
   47    HB3  CYS   6           2HB      CYS   6  17.977  -6.559  -3.792
   48    HG   CYS   6           HG       CYS   6  18.843  -8.424  -1.978
   49    HA   PRO   7           HA       PRO   7  20.649  -2.986  -6.067
   50    HB2  PRO   7           1HB      PRO   7  22.848  -1.806  -4.999
   51    HB3  PRO   7           2HB      PRO   7  21.279  -0.999  -5.099
   52    HG2  PRO   7           1HG      PRO   7  22.550  -2.386  -2.771
   53    HG3  PRO   7           2HG      PRO   7  21.666  -0.849  -2.811
   54    HD2  PRO   7           1HD      PRO   7  20.532  -3.162  -1.974
   55    HD3  PRO   7           2HD      PRO   7  19.609  -1.889  -2.798
   56    H    VAL   8           H        VAL   8  21.656  -5.147  -3.659
   57    HA   VAL   8           HA       VAL   8  24.239  -5.824  -4.588
   58    HB   VAL   8           HB       VAL   8  22.289  -7.611  -3.130
   59   HG11  VAL   8          1HG1      VAL   8  25.125  -7.842  -3.904
   60   HG12  VAL   8          2HG1      VAL   8  24.728  -8.331  -2.255
   61   HG13  VAL   8          3HG1      VAL   8  23.918  -9.096  -3.622
   62   HG21  VAL   8          3HG2      VAL   8  22.442  -5.844  -1.671
   63   HG22  VAL   8          1HG2      VAL   8  23.831  -6.806  -1.163
   64   HG23  VAL   8          2HG2      VAL   8  24.064  -5.402  -2.205
   65    H    CYS   9           H        CYS   9  21.102  -6.494  -5.789
   66    HA   CYS   9           HA       CYS   9  22.214  -8.525  -7.613
   67    HB2  CYS   9           1HB      CYS   9  19.271  -8.283  -7.124
   68    HB3  CYS   9           2HB      CYS   9  20.208  -9.690  -7.609
   69    HG   CYS   9           HG       CYS   9  21.407  -9.916  -5.013
   70    H    ASP  10           H        ASP  10  19.618  -6.085  -7.426
   71    HA   ASP  10           HA       ASP  10  20.430  -5.003  -9.989
   72    HB2  ASP  10           1HB      ASP  10  18.228  -5.251 -11.027
   73    HB3  ASP  10           2HB      ASP  10  18.910  -6.827 -10.634
   74    H    TYR  11           H        TYR  11  19.222  -3.020 -10.537
   75    HA   TYR  11           HA       TYR  11  19.204  -1.151  -8.555
   76    HB2  TYR  11           1HB      TYR  11  17.617  -1.286 -11.112
   77    HB3  TYR  11           2HB      TYR  11  17.544   0.116 -10.050
   78    HD1  TYR  11           HD2      TYR  11  20.213   0.613  -9.203
   79    HD2  TYR  11           HD1      TYR  11  18.873  -0.807 -12.984
   80    HE1  TYR  11           HE2      TYR  11  22.241   1.521 -10.256
   81    HE2  TYR  11           HE1      TYR  11  20.898   0.097 -14.047
   82    HH   TYR  11           HH       TYR  11  23.401   0.647 -13.069
   83    H    THR  12           H        THR  12  17.489  -0.004  -7.458
   84    HA   THR  12           HA       THR  12  15.310  -1.813  -6.661
   85    HB   THR  12           HB       THR  12  15.256  -0.781  -4.541
   86    HG1  THR  12           HG1      THR  12  15.525   1.317  -4.541
   87   HG21  THR  12          3HG2      THR  12  17.470  -2.076  -5.358
   88   HG22  THR  12          1HG2      THR  12  17.242  -1.492  -3.710
   89   HG23  THR  12          2HG2      THR  12  18.184  -0.543  -4.859
   90    H    TYR  13           H        TYR  13  13.231  -1.230  -6.915
   91    HA   TYR  13           HA       TYR  13  12.533   1.553  -7.404
   92    HB2  TYR  13           1HB      TYR  13  11.861  -0.628  -9.390
   93    HB3  TYR  13           2HB      TYR  13  11.323   1.045  -9.474
   94    HD1  TYR  13           HD2      TYR  13  13.260   2.833  -9.488
   95    HD2  TYR  13           HD1      TYR  13  13.747  -1.252 -10.575
   96    HE1  TYR  13           HE2      TYR  13  15.275   3.420 -10.770
   97    HE2  TYR  13           HE1      TYR  13  15.764  -0.676 -11.859
   98    HH   TYR  13           HH       TYR  13  17.174   2.516 -11.730
   99    H    ASP  14           H        ASP  14  11.048   1.839  -5.874
  100    HA   ASP  14           HA       ASP  14   9.369  -0.234  -4.887
  101    HB2  ASP  14           1HB      ASP  14  10.049   1.650  -3.477
  102    HB3  ASP  14           2HB      ASP  14   9.176   2.764  -4.526
  103    H    GLU  15           H        GLU  15   7.089  -0.411  -5.042
  104    HA   GLU  15           HA       GLU  15   6.035  -0.273  -7.599
  105    HB2  GLU  15           1HB      GLU  15   5.199  -1.280  -5.174
  106    HB3  GLU  15           2HB      GLU  15   4.010  -0.026  -5.501
  107    HG2  GLU  15           1HG      GLU  15   4.643  -1.828  -7.745
  108    HG3  GLU  15           2HG      GLU  15   3.796  -2.548  -6.377
  109    H    GLY  16           H        GLY  16   5.791   2.051  -4.948
  110    HA2  GLY  16           1HA      GLY  16   4.118   3.823  -6.541
  111    HA3  GLY  16           2HA      GLY  16   4.634   4.087  -4.882
  112    H    LYS  17           H        LYS  17   7.175   3.161  -6.915
  113    HA   LYS  17           HA       LYS  17   8.285   5.845  -6.795
  114    HB2  LYS  17           1HB      LYS  17   9.453   3.482  -6.370
  115    HB3  LYS  17           2HB      LYS  17   9.753   3.607  -8.099
  116    HG2  LYS  17           1HG      LYS  17  11.652   4.548  -7.210
  117    HG3  LYS  17           2HG      LYS  17  10.651   5.970  -7.514
  118    HD2  LYS  17           1HD      LYS  17  10.078   6.175  -5.232
  119    HD3  LYS  17           2HD      LYS  17  10.683   4.560  -4.857
  120    HE2  LYS  17           1HE      LYS  17  12.953   5.538  -5.708
  121    HE3  LYS  17           2HE      LYS  17  12.191   7.088  -5.358
  122    HZ1  LYS  17           3HZ      LYS  17  13.562   5.805  -3.549
  123    HZ2  LYS  17           1HZ      LYS  17  12.091   5.006  -3.303
  124    HZ3  LYS  17           2HZ      LYS  17  12.179   6.687  -3.132
  125    H    GLY  18           H        GLY  18   7.594   3.385  -9.274
  126    HA2  GLY  18           1HA      GLY  18   6.710   3.839 -11.409
  127    HA3  GLY  18           2HA      GLY  18   7.138   5.531 -11.202
  128    H    ASP  19           H        ASP  19   9.057   6.269 -11.970
  129    HA   ASP  19           HA       ASP  19  10.992   6.321 -13.164
  130    HB2  ASP  19           1HB      ASP  19  11.497   3.433 -12.525
  131    HB3  ASP  19           2HB      ASP  19  12.651   4.756 -12.673
  132    HA   PRO  20           HA       PRO  20   8.797   4.163 -16.640
  133    HB2  PRO  20           1HB      PRO  20   8.614   6.372 -18.207
  134    HB3  PRO  20           2HB      PRO  20   7.410   5.963 -16.979
  135    HG2  PRO  20           1HG      PRO  20   9.680   7.908 -16.830
  136    HG3  PRO  20           2HG      PRO  20   8.010   8.092 -16.263
  137    HD2  PRO  20           1HD      PRO  20  10.056   7.485 -14.596
  138    HD3  PRO  20           2HD      PRO  20   8.402   6.898 -14.330
  139    H    ARG  21           H        ARG  21  11.670   6.020 -16.245
  140    HA   ARG  21           HA       ARG  21  12.724   5.823 -18.859
  141    HB2  ARG  21           1HB      ARG  21  13.816   6.424 -16.156
  142    HB3  ARG  21           2HB      ARG  21  14.962   5.968 -17.410
  143    HG2  ARG  21           1HG      ARG  21  14.713   8.389 -17.240
  144    HG3  ARG  21           2HG      ARG  21  14.188   7.788 -18.814
  145    HD2  ARG  21           1HD      ARG  21  12.190   8.110 -16.620
  146    HD3  ARG  21           2HD      ARG  21  12.740   9.532 -17.505
  147    HE   ARG  21           HE       ARG  21  10.952   7.516 -18.441
  148   HH11  ARG  21          1HH1      ARG  21  13.404   9.776 -19.444
  149   HH12  ARG  21          2HH1      ARG  21  12.801   9.911 -21.063
  150   HH21  ARG  21          1HH2      ARG  21  10.149   7.686 -20.569
  151   HH22  ARG  21          2HH2      ARG  21  10.949   8.722 -21.702
  152    H    GLU  22           H        GLU  22  12.446   3.559 -16.272
  153    HA   GLU  22           HA       GLU  22  14.409   1.753 -17.467
  154    HB2  GLU  22           1HB      GLU  22  12.757   1.327 -14.974
  155    HB3  GLU  22           2HB      GLU  22  14.172   0.414 -15.479
  156    HG2  GLU  22           1HG      GLU  22  14.260   3.348 -14.844
  157    HG3  GLU  22           2HG      GLU  22  14.531   2.089 -13.640
  158    H    GLY  23           H        GLY  23  11.793   2.432 -18.720
  159    HA2  GLY  23           1HA      GLY  23  10.257   1.302 -20.004
  160    HA3  GLY  23           2HA      GLY  23  11.115  -0.179 -19.606
  161    H    PHE  24           H        PHE  24  10.029   1.706 -16.956
  162    HA   PHE  24           HA       PHE  24   7.565   0.147 -16.701
  163    HB2  PHE  24           1HB      PHE  24   9.651   0.335 -14.517
  164    HB3  PHE  24           2HB      PHE  24   8.090  -0.469 -14.392
  165    HD1  PHE  24           HD1      PHE  24   7.727  -2.185 -16.492
  166    HD2  PHE  24           HD2      PHE  24  11.438  -1.068 -14.733
  167    HE1  PHE  24           HE1      PHE  24   8.738  -4.276 -17.305
  168    HE2  PHE  24           HE2      PHE  24  12.455  -3.156 -15.543
  169    HZ   PHE  24           HZ       PHE  24  11.106  -4.763 -16.832
  170    HA   PRO  25           HA       PRO  25   6.860   4.567 -15.658
  171    HB2  PRO  25           1HB      PRO  25   4.380   4.647 -16.761
  172    HB3  PRO  25           2HB      PRO  25   5.858   4.887 -17.701
  173    HG2  PRO  25           1HG      PRO  25   4.178   2.427 -17.410
  174    HG3  PRO  25           2HG      PRO  25   4.920   3.109 -18.869
  175    HD2  PRO  25           1HD      PRO  25   6.001   1.021 -17.525
  176    HD3  PRO  25           2HD      PRO  25   6.990   2.218 -18.385
  177    H    ALA  26           H        ALA  26   4.615   5.470 -14.750
  178    HA   ALA  26           HA       ALA  26   4.240   4.370 -12.232
  179    HB1  ALA  26           1HB      ALA  26   3.363   6.625 -13.557
  180    HB2  ALA  26           2HB      ALA  26   1.873   5.754 -13.189
  181    HB3  ALA  26           3HB      ALA  26   2.988   6.182 -11.891
  182    H    GLY  27           H        GLY  27   2.891   2.879 -11.358
  183    HA2  GLY  27           1HA      GLY  27   0.831   1.621 -11.372
  184    HA3  GLY  27           2HA      GLY  27   0.887   1.640 -13.128
  185    H    THR  28           H        THR  28   3.697   0.957 -13.294
  186    HA   THR  28           HA       THR  28   3.561  -1.787 -13.536
  187    HB   THR  28           HB       THR  28   6.079  -0.225 -12.934
  188    HG1  THR  28           HG1      THR  28   6.093  -0.392 -15.401
  189   HG21  THR  28          3HG2      THR  28   7.199  -2.115 -13.316
  190   HG22  THR  28          1HG2      THR  28   6.332  -2.380 -14.827
  191   HG23  THR  28          2HG2      THR  28   5.659  -2.973 -13.309
  192    H    ARG  29           H        ARG  29   3.811  -3.498 -12.216
  193    HA   ARG  29           HA       ARG  29   4.431  -2.940  -9.392
  194    HB2  ARG  29           1HB      ARG  29   3.194  -5.165  -9.028
  195    HB3  ARG  29           2HB      ARG  29   2.234  -3.748  -9.436
  196    HG2  ARG  29           1HG      ARG  29   3.156  -5.464 -11.669
  197    HG3  ARG  29           2HG      ARG  29   1.883  -6.090 -10.619
  198    HD2  ARG  29           1HD      ARG  29   1.647  -3.310 -11.658
  199    HD3  ARG  29           2HD      ARG  29   1.318  -4.652 -12.753
  200    HE   ARG  29           HE       ARG  29  -0.310  -3.768 -10.556
  201   HH11  ARG  29          1HH1      ARG  29   0.512  -6.456 -12.610
  202   HH12  ARG  29          2HH1      ARG  29  -0.999  -7.269 -12.371
  203   HH21  ARG  29          1HH2      ARG  29  -2.303  -4.828 -10.234
  204   HH22  ARG  29          2HH2      ARG  29  -2.600  -6.341 -11.020
  205    H    TRP  30           H        TRP  30   5.549  -4.643  -8.205
  206    HA   TRP  30           HA       TRP  30   7.865  -5.526  -9.564
  207    HB2  TRP  30           1HB      TRP  30   8.432  -6.651  -7.450
  208    HB3  TRP  30           2HB      TRP  30   7.885  -5.000  -7.176
  209    HD1  TRP  30           HD1      TRP  30   5.437  -4.695  -6.052
  210    HE1  TRP  30           HE1      TRP  30   4.069  -6.271  -4.547
  211    HE3  TRP  30           HE3      TRP  30   7.904  -9.071  -7.004
  212    HZ2  TRP  30           HZ2      TRP  30   4.039  -9.007  -3.854
  213    HZ3  TRP  30           HZ3      TRP  30   7.142 -11.122  -5.878
  214    HH2  TRP  30           HH2      TRP  30   5.250 -11.089  -4.336
  215    H    ASP  31           H        ASP  31   4.755  -6.836  -9.350
  216    HA   ASP  31           HA       ASP  31   5.570  -9.600  -9.654
  217    HB2  ASP  31           1HB      ASP  31   3.548  -9.172  -8.400
  218    HB3  ASP  31           2HB      ASP  31   2.856  -8.270  -9.746
  219    H    GLN  32           H        GLN  32   4.716  -6.910 -11.659
  220    HA   GLN  32           HA       GLN  32   4.061  -8.411 -13.996
  221    HB2  GLN  32           1HB      GLN  32   3.335  -6.056 -13.571
  222    HB3  GLN  32           2HB      GLN  32   4.998  -5.543 -13.824
  223    HG2  GLN  32           1HG      GLN  32   4.112  -5.156 -15.890
  224    HG3  GLN  32           2HG      GLN  32   4.723  -6.796 -16.100
  225   HE21  GLN  32          2HE2      GLN  32   3.172  -8.552 -15.796
  226   HE22  GLN  32          1HE2      GLN  32   1.527  -8.296 -16.257
  227    H    ILE  33           H        ILE  33   7.003  -7.345 -12.529
  228    HA   ILE  33           HA       ILE  33   8.755  -7.189 -14.652
  229    HB   ILE  33           HB       ILE  33   9.334  -8.439 -11.963
  230   HG12  ILE  33          1HG1      ILE  33   8.370  -6.188 -11.760
  231   HG13  ILE  33          2HG1      ILE  33  10.070  -6.193 -11.302
  232   HG21  ILE  33          1HG2      ILE  33  11.039  -8.883 -13.690
  233   HG22  ILE  33          2HG2      ILE  33  11.211  -7.145 -13.936
  234   HG23  ILE  33          3HG2      ILE  33  11.644  -7.863 -12.385
  235   HD11  ILE  33          3HD1      ILE  33   9.852  -5.611 -14.084
  236   HD12  ILE  33          1HD1      ILE  33   8.780  -4.547 -13.174
  237   HD13  ILE  33          2HD1      ILE  33  10.498  -4.613 -12.782
  238    HA   PRO  34           HA       PRO  34   8.694 -11.246 -16.414
  239    HB2  PRO  34           1HB      PRO  34  10.900 -10.980 -17.973
  240    HB3  PRO  34           2HB      PRO  34   9.349 -10.230 -18.367
  241    HG2  PRO  34           1HG      PRO  34  11.766  -9.019 -17.080
  242    HG3  PRO  34           2HG      PRO  34  10.714  -8.348 -18.340
  243    HD2  PRO  34           1HD      PRO  34  10.507  -7.634 -15.737
  244    HD3  PRO  34           2HD      PRO  34   9.106  -7.692 -16.825
  245    H    ASP  35           H        ASP  35   9.416 -13.127 -15.644
  246    HA   ASP  35           HA       ASP  35  11.538 -13.231 -13.740
  247    HB2  ASP  35           1HB      ASP  35  11.006 -15.545 -13.502
  248    HB3  ASP  35           2HB      ASP  35   9.480 -14.695 -13.736
  249    H    ASP  36           H        ASP  36  11.396 -13.477 -17.135
  250    HA   ASP  36           HA       ASP  36  13.720 -15.140 -17.461
  251    HB2  ASP  36           1HB      ASP  36  12.153 -13.426 -19.394
  252    HB3  ASP  36           2HB      ASP  36  13.541 -14.403 -19.866
  253    H    TRP  37           H        TRP  37  13.160 -11.857 -16.779
  254    HA   TRP  37           HA       TRP  37  15.207 -10.515 -18.050
  255    HB2  TRP  37           1HB      TRP  37  13.358  -9.833 -16.185
  256    HB3  TRP  37           2HB      TRP  37  14.823  -9.801 -15.208
  257    HD1  TRP  37           HD1      TRP  37  16.074  -7.572 -15.227
  258    HE1  TRP  37           HE1      TRP  37  16.138  -5.504 -16.758
  259    HE3  TRP  37           HE3      TRP  37  13.004  -9.233 -18.963
  260    HZ2  TRP  37           HZ2      TRP  37  15.033  -4.686 -19.223
  261    HZ3  TRP  37           HZ3      TRP  37  12.559  -7.746 -20.872
  262    HH2  TRP  37           HH2      TRP  37  13.553  -5.520 -20.997
  263    H    CYS  38           H        CYS  38  17.371 -10.347 -17.822
  264    HA   CYS  38           HA       CYS  38  18.628 -11.906 -15.661
  265    HB2  CYS  38           1HB      CYS  38  18.876 -12.986 -17.878
  266    HB3  CYS  38           2HB      CYS  38  19.668 -11.534 -18.477
  267    HG   CYS  38           HG       CYS  38  20.935 -13.278 -15.832
  268    H    CYS  39           H        CYS  39  19.847 -10.750 -14.331
  269    HA   CYS  39           HA       CYS  39  20.814  -8.125 -15.244
  270    HB2  CYS  39           1HB      CYS  39  19.609  -9.067 -12.750
  271    HB3  CYS  39           2HB      CYS  39  21.083  -8.141 -12.495
  272    HG   CYS  39           HG       CYS  39  18.388  -7.015 -14.280
  273    HA   PRO  40           HA       PRO  40  25.023  -9.252 -14.753
  274    HB2  PRO  40           1HB      PRO  40  26.107  -7.042 -13.608
  275    HB3  PRO  40           2HB      PRO  40  25.574  -7.088 -15.293
  276    HG2  PRO  40           1HG      PRO  40  24.166  -5.990 -12.890
  277    HG3  PRO  40           2HG      PRO  40  24.309  -5.298 -14.517
  278    HD2  PRO  40           1HD      PRO  40  22.088  -6.600 -13.678
  279    HD3  PRO  40           2HD      PRO  40  22.631  -6.630 -15.368
  280    H    ASP  41           H        ASP  41  23.864  -7.574 -11.823
  281    HA   ASP  41           HA       ASP  41  25.678  -9.042 -10.134
  282    HB2  ASP  41           1HB      ASP  41  23.813  -6.793  -9.835
  283    HB3  ASP  41           2HB      ASP  41  23.892  -7.849  -8.428
  284    H    CYS  42           H        CYS  42  22.132  -8.874 -10.454
  285    HA   CYS  42           HA       CYS  42  21.492 -10.865  -8.624
  286    HB2  CYS  42           1HB      CYS  42  19.815  -9.375  -9.599
  287    HB3  CYS  42           2HB      CYS  42  20.047 -10.121 -11.176
  288    HG   CYS  42           HG       CYS  42  18.436 -12.112 -10.854
  289    H    SER  43           H        SER  43  22.873 -11.117 -11.765
  290    HA   SER  43           HA       SER  43  22.090 -13.603 -12.645
  291    HB2  SER  43           1HB      SER  43  23.471 -12.630 -14.188
  292    HB3  SER  43           2HB      SER  43  24.546 -11.960 -12.960
  293    HG   SER  43           HG       SER  43  24.413 -14.690 -13.734
  294    H    VAL  44           H        VAL  44  24.299 -12.795 -10.059
  295    HA   VAL  44           HA       VAL  44  24.683 -15.671  -9.536
  296    HB   VAL  44           HB       VAL  44  26.743 -15.064  -8.324
  297   HG11  VAL  44          1HG1      VAL  44  27.277 -13.789 -10.907
  298   HG12  VAL  44          2HG1      VAL  44  27.960 -15.254 -10.199
  299   HG13  VAL  44          3HG1      VAL  44  26.397 -15.313 -11.016
  300   HG21  VAL  44          3HG2      VAL  44  27.679 -12.818  -8.541
  301   HG22  VAL  44          1HG2      VAL  44  26.230 -12.291  -9.397
  302   HG23  VAL  44          2HG2      VAL  44  26.126 -12.779  -7.705
  303    H    ARG  45           H        ARG  45  22.499 -13.826  -8.669
  304    HA   ARG  45           HA       ARG  45  22.634 -14.485  -5.829
  305    HB2  ARG  45           1HB      ARG  45  22.092 -11.714  -6.902
  306    HB3  ARG  45           2HB      ARG  45  21.714 -12.213  -5.258
  307    HG2  ARG  45           1HG      ARG  45  24.487 -12.503  -6.342
  308    HG3  ARG  45           2HG      ARG  45  23.914 -10.959  -5.707
  309    HD2  ARG  45           1HD      ARG  45  24.906 -11.947  -3.856
  310    HD3  ARG  45           2HD      ARG  45  23.199 -12.334  -3.644
  311    HE   ARG  45           HE       ARG  45  24.677 -14.359  -5.049
  312   HH11  ARG  45          1HH1      ARG  45  23.739 -13.149  -1.923
  313   HH12  ARG  45          2HH1      ARG  45  23.934 -14.676  -1.128
  314   HH21  ARG  45          1HH2      ARG  45  24.938 -16.375  -4.015
  315   HH22  ARG  45          2HH2      ARG  45  24.617 -16.510  -2.319
  316    H    GLU  46           H        GLU  46  20.726 -15.164  -5.020
  317    HA   GLU  46           HA       GLU  46  18.598 -15.770  -6.765
  318    HB2  GLU  46           1HB      GLU  46  18.554 -15.687  -3.743
  319    HB3  GLU  46           2HB      GLU  46  17.415 -16.538  -4.778
  320    HG2  GLU  46           1HG      GLU  46  20.324 -17.155  -4.349
  321    HG3  GLU  46           2HG      GLU  46  18.930 -18.139  -3.905
  322    H    LYS  47           H        LYS  47  16.628 -14.836  -7.105
  323    HA   LYS  47           HA       LYS  47  16.402 -12.043  -6.790
  324    HB2  LYS  47           1HB      LYS  47  15.219 -13.804  -8.419
  325    HB3  LYS  47           2HB      LYS  47  13.943 -13.662  -7.217
  326    HG2  LYS  47           1HG      LYS  47  13.414 -11.557  -7.826
  327    HG3  LYS  47           2HG      LYS  47  15.084 -11.128  -8.202
  328    HD2  LYS  47           1HD      LYS  47  14.911 -11.801 -10.359
  329    HD3  LYS  47           2HD      LYS  47  13.820 -13.132  -9.967
  330    HE2  LYS  47           1HE      LYS  47  13.065 -10.212 -10.050
  331    HE3  LYS  47           2HE      LYS  47  12.726 -11.390 -11.317
  332    HZ1  LYS  47           3HZ      LYS  47  11.609 -12.653  -9.335
  333    HZ2  LYS  47           1HZ      LYS  47  10.777 -11.436 -10.166
  334    HZ3  LYS  47           2HZ      LYS  47  11.498 -11.100  -8.673
  335    H    VAL  48           H        VAL  48  15.172 -14.754  -4.928
  336    HA   VAL  48           HA       VAL  48  13.432 -13.188  -3.285
  337    HB   VAL  48           HB       VAL  48  13.140 -15.637  -3.663
  338   HG11  VAL  48          1HG1      VAL  48  14.644 -17.186  -3.042
  339   HG12  VAL  48          2HG1      VAL  48  15.783 -15.837  -3.063
  340   HG13  VAL  48          3HG1      VAL  48  15.042 -16.345  -1.544
  341   HG21  VAL  48          3HG2      VAL  48  13.364 -15.575  -0.760
  342   HG22  VAL  48          1HG2      VAL  48  12.601 -14.131  -1.425
  343   HG23  VAL  48          2HG2      VAL  48  11.935 -15.725  -1.782
  344    H    ASP  49           H        ASP  49  16.758 -13.463  -3.437
  345    HA   ASP  49           HA       ASP  49  17.511 -13.464  -0.727
  346    HB2  ASP  49           1HB      ASP  49  19.036 -13.808  -2.704
  347    HB3  ASP  49           2HB      ASP  49  18.967 -12.069  -2.978
  348    H    PHE  50           H        PHE  50  15.993 -11.080  -2.642
  349    HA   PHE  50           HA       PHE  50  16.901  -8.700  -1.547
  350    HB2  PHE  50           1HB      PHE  50  14.280  -9.557  -2.721
  351    HB3  PHE  50           2HB      PHE  50  14.431  -7.957  -2.002
  352    HD1  PHE  50           HD1      PHE  50  16.603 -10.062  -4.192
  353    HD2  PHE  50           HD2      PHE  50  14.661  -6.324  -3.586
  354    HE1  PHE  50           HE1      PHE  50  17.581  -9.219  -6.286
  355    HE2  PHE  50           HE2      PHE  50  15.634  -5.475  -5.680
  356    HZ   PHE  50           HZ       PHE  50  17.096  -6.923  -7.033
  357    H    GLU  51           H        GLU  51  15.485  -7.240  -0.119
  358    HA   GLU  51           HA       GLU  51  14.431  -8.776   2.160
  359    HB2  GLU  51           1HB      GLU  51  15.408  -6.933   3.618
  360    HB3  GLU  51           2HB      GLU  51  16.551  -8.071   2.919
  361    HG2  GLU  51           1HG      GLU  51  17.023  -6.427   1.130
  362    HG3  GLU  51           2HG      GLU  51  15.968  -5.281   1.956
  363    H    ARG  52           H        ARG  52  12.317  -8.369   2.172
  364    HA   ARG  52           HA       ARG  52  11.071  -6.117   1.063
  365    HB2  ARG  52           1HB      ARG  52   9.065  -6.866   2.344
  366    HB3  ARG  52           2HB      ARG  52   9.819  -8.140   1.395
  367    HG2  ARG  52           1HG      ARG  52  10.867  -9.044   3.379
  368    HG3  ARG  52           2HG      ARG  52  10.212  -7.725   4.351
  369    HD2  ARG  52           1HD      ARG  52   7.918  -8.513   3.564
  370    HD3  ARG  52           2HD      ARG  52   8.737  -9.971   3.006
  371    HE   ARG  52           HE       ARG  52   9.304  -9.340   5.744
  372   HH11  ARG  52          1HH1      ARG  52   7.041 -10.878   3.590
  373   HH12  ARG  52          2HH1      ARG  52   6.418 -11.949   4.801
  374   HH21  ARG  52          1HH2      ARG  52   8.491 -10.745   7.346
  375   HH22  ARG  52          2HH2      ARG  52   7.242 -11.873   6.937
  376    H    MET  53           H        MET  53  10.314  -4.216   1.915
  377    HA   MET  53           HA       MET  53  11.335  -3.525   4.588
  378    HB2  MET  53           1HB      MET  53  10.955  -1.929   2.080
  379    HB3  MET  53           2HB      MET  53  10.949  -1.119   3.641
  380    HG2  MET  53           1HG      MET  53  13.182  -2.888   2.682
  381    HG3  MET  53           2HG      MET  53  13.148  -1.139   2.470
  382    HE1  MET  53           3HE      MET  53  14.592   0.343   5.125
  383    HE2  MET  53           1HE      MET  53  13.332   0.471   3.897
  384    HE3  MET  53           2HE      MET  53  12.894   0.382   5.603
  385    H    GLY  54           H        GLY  54   9.941  -3.002   6.156
  386    HA2  GLY  54           1HA      GLY  54   7.777  -1.551   6.361
  387    HA3  GLY  54           2HA      GLY  54   7.093  -2.896   5.461
  388    H    GLY  55           H        GLY  55   6.932  -1.720   8.350
  389    HA2  GLY  55           1HA      GLY  55   7.652  -4.051   9.930
  390    HA3  GLY  55           2HA      GLY  55   6.963  -2.551  10.534
  391    H    LYS  56           H        LYS  56   4.629  -2.178   9.683
  392    HA   LYS  56           HA       LYS  56   3.014  -4.225  10.740
  393    HB2  LYS  56           1HB      LYS  56   1.118  -2.890   9.935
  394    HB3  LYS  56           2HB      LYS  56   2.317  -1.885  10.741
  395    HG2  LYS  56           1HG      LYS  56   2.001  -0.571   8.944
  396    HG3  LYS  56           2HG      LYS  56   3.177  -1.664   8.210
  397    HD2  LYS  56           1HD      LYS  56   1.553  -1.766   6.616
  398    HD3  LYS  56           2HD      LYS  56   0.976  -3.054   7.677
  399    HE2  LYS  56           1HE      LYS  56  -0.945  -1.821   7.344
  400    HE3  LYS  56           2HE      LYS  56  -0.333  -1.132   8.846
  401    HZ1  LYS  56           3HZ      LYS  56   0.007   0.837   7.884
  402    HZ2  LYS  56           1HZ      LYS  56  -1.004   0.281   6.646
  403    HZ3  LYS  56           2HZ      LYS  56   0.675   0.163   6.483
  Start of MODEL    6
    1    H1   MET   1           H        MET   1   1.491  -1.950   1.301
    2    HA   MET   1           HA       MET   1   1.022  -2.896  -1.437
    3    HB2  MET   1           1HB      MET   1   2.349  -0.308  -0.633
    4    HB3  MET   1           2HB      MET   1   2.548  -1.030  -2.224
    5    HG2  MET   1           1HG      MET   1   0.026  -0.971  -2.415
    6    HG3  MET   1           2HG      MET   1   0.042   0.049  -0.977
    7    HE1  MET   1           3HE      MET   1  -0.440  -0.001  -4.425
    8    HE2  MET   1           1HE      MET   1   0.369   1.371  -5.182
    9    HE3  MET   1           2HE      MET   1   1.271  -0.106  -4.844
   10    H    THR   2           H        THR   2   3.000  -3.501  -2.572
   11    HA   THR   2           HA       THR   2   4.898  -4.730  -0.733
   12    HB   THR   2           HB       THR   2   4.546  -5.069  -3.718
   13    HG1  THR   2           HG1      THR   2   3.649  -6.468  -1.440
   14   HG21  THR   2          3HG2      THR   2   6.811  -5.556  -3.310
   15   HG22  THR   2          1HG2      THR   2   6.005  -7.123  -3.267
   16   HG23  THR   2          2HG2      THR   2   6.456  -6.322  -1.762
   17    H    ALA   3           H        ALA   3   7.100  -4.374  -0.756
   18    HA   ALA   3           HA       ALA   3   8.233  -2.457  -2.623
   19    HB1  ALA   3           1HB      ALA   3   8.225  -1.939   0.349
   20    HB2  ALA   3           2HB      ALA   3   9.117  -1.007  -0.855
   21    HB3  ALA   3           3HB      ALA   3   7.354  -1.014  -0.875
   22    H    TYR   4           H        TYR   4  10.040  -3.384  -3.302
   23    HA   TYR   4           HA       TYR   4  11.612  -4.980  -1.389
   24    HB2  TYR   4           1HB      TYR   4  11.091  -5.318  -4.324
   25    HB3  TYR   4           2HB      TYR   4  12.551  -5.987  -3.606
   26    HD1  TYR   4           HD2      TYR   4  12.414  -7.812  -1.979
   27    HD2  TYR   4           HD1      TYR   4   8.921  -6.263  -3.851
   28    HE1  TYR   4           HE2      TYR   4  11.154  -9.797  -1.257
   29    HE2  TYR   4           HE1      TYR   4   7.651  -8.244  -3.134
   30    HH   TYR   4           HH       TYR   4   7.991 -10.495  -2.433
   31    H    ARG   5           H        ARG   5  13.726  -4.520  -1.094
   32    HA   ARG   5           HA       ARG   5  15.028  -2.609  -2.893
   33    HB2  ARG   5           1HB      ARG   5  14.165  -1.235  -1.100
   34    HB3  ARG   5           2HB      ARG   5  14.837  -2.322   0.109
   35    HG2  ARG   5           1HG      ARG   5  16.630  -1.024   0.163
   36    HG3  ARG   5           2HG      ARG   5  17.005  -1.571  -1.472
   37    HD2  ARG   5           1HD      ARG   5  16.306   0.357  -2.420
   38    HD3  ARG   5           2HD      ARG   5  14.993   0.572  -1.264
   39    HE   ARG   5           HE       ARG   5  17.662   1.628  -1.076
   40   HH11  ARG   5          1HH1      ARG   5  14.801   0.722   0.689
   41   HH12  ARG   5          2HH1      ARG   5  15.139   1.766   2.029
   42   HH21  ARG   5          1HH2      ARG   5  18.118   3.007   0.683
   43   HH22  ARG   5          2HH2      ARG   5  17.026   3.066   2.024
   44    H    CYS   6           H        CYS   6  16.579  -3.922  -3.670
   45    HA   CYS   6           HA       CYS   6  18.635  -4.815  -1.841
   46    HB2  CYS   6           1HB      CYS   6  16.739  -6.648  -2.290
   47    HB3  CYS   6           2HB      CYS   6  17.721  -6.930  -3.722
   48    HG   CYS   6           HG       CYS   6  18.210  -7.955  -0.645
   49    HA   PRO   7           HA       PRO   7  20.307  -3.192  -5.789
   50    HB2  PRO   7           1HB      PRO   7  22.457  -2.008  -4.628
   51    HB3  PRO   7           2HB      PRO   7  20.870  -1.235  -4.725
   52    HG2  PRO   7           1HG      PRO   7  22.132  -2.690  -2.433
   53    HG3  PRO   7           2HG      PRO   7  21.212  -1.175  -2.425
   54    HD2  PRO   7           1HD      PRO   7  20.119  -3.547  -1.710
   55    HD3  PRO   7           2HD      PRO   7  19.181  -2.262  -2.497
   56    H    VAL   8           H        VAL   8  21.443  -5.324  -3.356
   57    HA   VAL   8           HA       VAL   8  24.017  -5.929  -4.272
   58    HB   VAL   8           HB       VAL   8  22.045  -7.802  -2.955
   59   HG11  VAL   8          1HG1      VAL   8  23.663  -9.265  -3.594
   60   HG12  VAL   8          2HG1      VAL   8  24.914  -8.022  -3.671
   61   HG13  VAL   8          3HG1      VAL   8  24.411  -8.674  -2.110
   62   HG21  VAL   8          3HG2      VAL   8  22.222  -6.186  -1.358
   63   HG22  VAL   8          1HG2      VAL   8  23.667  -7.119  -0.967
   64   HG23  VAL   8          2HG2      VAL   8  23.802  -5.643  -1.923
   65    H    CYS   9           H        CYS   9  20.944  -6.636  -5.620
   66    HA   CYS   9           HA       CYS   9  22.192  -8.516  -7.515
   67    HB2  CYS   9           1HB      CYS   9  19.228  -8.425  -7.140
   68    HB3  CYS   9           2HB      CYS   9  20.253  -9.772  -7.623
   69    HG   CYS   9           HG       CYS   9  21.372  -9.850  -4.908
   70    H    ASP  10           H        ASP  10  19.484  -6.205  -7.283
   71    HA   ASP  10           HA       ASP  10  20.330  -4.954  -9.761
   72    HB2  ASP  10           1HB      ASP  10  18.171  -5.219 -10.870
   73    HB3  ASP  10           2HB      ASP  10  18.877  -6.795 -10.523
   74    H    TYR  11           H        TYR  11  19.078  -2.982 -10.234
   75    HA   TYR  11           HA       TYR  11  18.950  -1.229  -8.145
   76    HB2  TYR  11           1HB      TYR  11  17.539  -1.267 -10.796
   77    HB3  TYR  11           2HB      TYR  11  17.250   0.039  -9.652
   78    HD1  TYR  11           HD2      TYR  11  19.428   1.190  -8.712
   79    HD2  TYR  11           HD1      TYR  11  19.255  -1.042 -12.331
   80    HE1  TYR  11           HE2      TYR  11  21.446   2.344  -9.514
   81    HE2  TYR  11           HE1      TYR  11  21.274   0.105 -13.142
   82    HH   TYR  11           HH       TYR  11  23.355   1.711 -11.262
   83    H    THR  12           H        THR  12  17.161  -0.184  -7.058
   84    HA   THR  12           HA       THR  12  15.006  -2.091  -6.444
   85    HB   THR  12           HB       THR  12  14.845  -1.182  -4.277
   86    HG1  THR  12           HG1      THR  12  16.496   0.953  -5.199
   87   HG21  THR  12          3HG2      THR  12  16.818  -1.883  -3.418
   88   HG22  THR  12          1HG2      THR  12  17.767  -0.813  -4.447
   89   HG23  THR  12          2HG2      THR  12  17.149  -2.334  -5.090
   90    H    TYR  13           H        TYR  13  12.917  -1.546  -6.723
   91    HA   TYR  13           HA       TYR  13  12.164   1.237  -7.115
   92    HB2  TYR  13           1HB      TYR  13  11.663  -0.879  -9.218
   93    HB3  TYR  13           2HB      TYR  13  10.997   0.750  -9.239
   94    HD1  TYR  13           HD1      TYR  13  12.843   2.664  -9.025
   95    HD2  TYR  13           HD2      TYR  13  13.564  -1.275 -10.462
   96    HE1  TYR  13           HE1      TYR  13  14.838   3.470 -10.215
   97    HE2  TYR  13           HE2      TYR  13  15.562  -0.480 -11.656
   98    HH   TYR  13           HH       TYR  13  16.721   1.325 -12.306
   99    H    ASP  14           H        ASP  14  10.618   1.426  -5.632
  100    HA   ASP  14           HA       ASP  14   8.967  -0.730  -4.782
  101    HB2  ASP  14           1HB      ASP  14   9.532   1.091  -3.262
  102    HB3  ASP  14           2HB      ASP  14   8.711   2.247  -4.308
  103    H    GLU  15           H        GLU  15   6.672  -0.906  -4.980
  104    HA   GLU  15           HA       GLU  15   5.693  -0.759  -7.562
  105    HB2  GLU  15           1HB      GLU  15   4.279  -0.908  -4.906
  106    HB3  GLU  15           2HB      GLU  15   3.402  -0.940  -6.430
  107    HG2  GLU  15           1HG      GLU  15   4.725  -2.924  -7.095
  108    HG3  GLU  15           2HG      GLU  15   5.468  -2.918  -5.497
  109    H    GLY  16           H        GLY  16   5.306   1.547  -4.902
  110    HA2  GLY  16           1HA      GLY  16   3.733   3.333  -6.579
  111    HA3  GLY  16           2HA      GLY  16   4.143   3.580  -4.888
  112    H    LYS  17           H        LYS  17   6.810   2.681  -6.767
  113    HA   LYS  17           HA       LYS  17   7.918   5.353  -6.530
  114    HB2  LYS  17           1HB      LYS  17   9.043   2.952  -6.143
  115    HB3  LYS  17           2HB      LYS  17   9.450   3.170  -7.840
  116    HG2  LYS  17           1HG      LYS  17  11.290   4.013  -6.693
  117    HG3  LYS  17           2HG      LYS  17  10.368   5.450  -7.144
  118    HD2  LYS  17           1HD      LYS  17   9.405   5.556  -4.912
  119    HD3  LYS  17           2HD      LYS  17  10.258   4.079  -4.456
  120    HE2  LYS  17           1HE      LYS  17  12.402   5.236  -4.877
  121    HE3  LYS  17           2HE      LYS  17  11.509   6.714  -5.229
  122    HZ1  LYS  17           3HZ      LYS  17  10.507   6.268  -2.886
  123    HZ2  LYS  17           1HZ      LYS  17  12.024   7.002  -3.033
  124    HZ3  LYS  17           2HZ      LYS  17  11.913   5.357  -2.658
  125    H    GLY  18           H        GLY  18   7.338   2.976  -9.117
  126    HA2  GLY  18           1HA      GLY  18   6.552   3.510 -11.274
  127    HA3  GLY  18           2HA      GLY  18   6.996   5.188 -10.996
  128    H    ASP  19           H        ASP  19   9.092   5.876 -11.417
  129    HA   ASP  19           HA       ASP  19  11.078   5.931 -12.523
  130    HB2  ASP  19           1HB      ASP  19  11.024   3.217 -11.313
  131    HB3  ASP  19           2HB      ASP  19  12.235   3.514 -12.557
  132    HA   PRO  20           HA       PRO  20   9.004   4.253 -16.322
  133    HB2  PRO  20           1HB      PRO  20   9.062   6.605 -17.675
  134    HB3  PRO  20           2HB      PRO  20   7.755   6.164 -16.570
  135    HG2  PRO  20           1HG      PRO  20  10.123   7.932 -16.093
  136    HG3  PRO  20           2HG      PRO  20   8.432   8.173 -15.615
  137    HD2  PRO  20           1HD      PRO  20  10.320   7.280 -13.891
  138    HD3  PRO  20           2HD      PRO  20   8.619   6.782 -13.787
  139    H    ARG  21           H        ARG  21  11.957   5.838 -15.557
  140    HA   ARG  21           HA       ARG  21  13.184   5.865 -18.093
  141    HB2  ARG  21           1HB      ARG  21  14.134   5.986 -15.271
  142    HB3  ARG  21           2HB      ARG  21  15.318   5.633 -16.523
  143    HG2  ARG  21           1HG      ARG  21  15.320   7.985 -16.103
  144    HG3  ARG  21           2HG      ARG  21  14.618   7.702 -17.697
  145    HD2  ARG  21           1HD      ARG  21  12.460   8.186 -16.966
  146    HD3  ARG  21           2HD      ARG  21  12.876   7.930 -15.271
  147    HE   ARG  21           HE       ARG  21  13.181  10.353 -16.785
  148   HH11  ARG  21          1HH1      ARG  21  14.315   8.531 -14.044
  149   HH12  ARG  21          2HH1      ARG  21  14.900   9.923 -13.195
  150   HH21  ARG  21          1HH2      ARG  21  13.947  12.194 -15.678
  151   HH22  ARG  21          2HH2      ARG  21  14.690  12.006 -14.125
  152    H    GLU  22           H        GLU  22  12.543   3.322 -15.851
  153    HA   GLU  22           HA       GLU  22  14.426   1.513 -17.165
  154    HB2  GLU  22           1HB      GLU  22  12.830   1.415 -14.637
  155    HB3  GLU  22           2HB      GLU  22  13.363  -0.091 -15.370
  156    HG2  GLU  22           1HG      GLU  22  14.840   0.938 -13.573
  157    HG3  GLU  22           2HG      GLU  22  15.615   0.413 -15.066
  158    H    GLY  23           H        GLY  23  11.964   2.579 -18.460
  159    HA2  GLY  23           1HA      GLY  23  10.430   1.765 -19.966
  160    HA3  GLY  23           2HA      GLY  23  11.134   0.174 -19.719
  161    H    PHE  24           H        PHE  24  10.086   1.718 -16.869
  162    HA   PHE  24           HA       PHE  24   7.481   0.372 -16.969
  163    HB2  PHE  24           1HB      PHE  24   9.436   0.154 -14.670
  164    HB3  PHE  24           2HB      PHE  24   7.812  -0.524 -14.710
  165    HD1  PHE  24           HD2      PHE  24   7.547  -1.821 -17.210
  166    HD2  PHE  24           HD1      PHE  24  11.005  -1.510 -14.749
  167    HE1  PHE  24           HE2      PHE  24   8.435  -3.890 -18.202
  168    HE2  PHE  24           HE1      PHE  24  11.899  -3.577 -15.738
  169    HZ   PHE  24           HZ       PHE  24  10.613  -4.771 -17.466
  170    HA   PRO  25           HA       PRO  25   6.998   4.686 -15.459
  171    HB2  PRO  25           1HB      PRO  25   4.607   5.068 -16.687
  172    HB3  PRO  25           2HB      PRO  25   6.156   5.305 -17.505
  173    HG2  PRO  25           1HG      PRO  25   4.303   2.955 -17.600
  174    HG3  PRO  25           2HG      PRO  25   5.182   3.741 -18.924
  175    HD2  PRO  25           1HD      PRO  25   6.034   1.443 -17.773
  176    HD3  PRO  25           2HD      PRO  25   7.154   2.654 -18.429
  177    H    ALA  26           H        ALA  26   4.789   5.647 -14.558
  178    HA   ALA  26           HA       ALA  26   4.175   4.330 -12.212
  179    HB1  ALA  26           1HB      ALA  26   3.509   6.492 -12.079
  180    HB2  ALA  26           2HB      ALA  26   2.934   6.535 -13.746
  181    HB3  ALA  26           3HB      ALA  26   1.950   5.778 -12.494
  182    H    GLY  27           H        GLY  27   2.845   2.719 -11.627
  183    HA2  GLY  27           1HA      GLY  27   0.686   1.606 -11.872
  184    HA3  GLY  27           2HA      GLY  27   0.871   1.776 -13.611
  185    H    THR  28           H        THR  28   3.863   1.039 -12.594
  186    HA   THR  28           HA       THR  28   3.538  -1.759 -13.327
  187    HB   THR  28           HB       THR  28   6.064  -0.172 -12.829
  188    HG1  THR  28           HG1      THR  28   4.602   0.305 -14.731
  189   HG21  THR  28          3HG2      THR  28   6.764  -2.252 -14.426
  190   HG22  THR  28          1HG2      THR  28   5.537  -3.008 -13.410
  191   HG23  THR  28          2HG2      THR  28   6.945  -2.244 -12.672
  192    H    ARG  29           H        ARG  29   4.110  -3.495 -12.050
  193    HA   ARG  29           HA       ARG  29   4.713  -2.891  -9.230
  194    HB2  ARG  29           1HB      ARG  29   3.389  -5.057  -8.775
  195    HB3  ARG  29           2HB      ARG  29   2.487  -3.591  -9.137
  196    HG2  ARG  29           1HG      ARG  29   3.179  -5.310 -11.435
  197    HG3  ARG  29           2HG      ARG  29   1.989  -5.944 -10.295
  198    HD2  ARG  29           1HD      ARG  29   1.467  -3.173 -10.903
  199    HD3  ARG  29           2HD      ARG  29   1.549  -4.136 -12.378
  200    HE   ARG  29           HE       ARG  29  -0.046  -5.589 -10.711
  201   HH11  ARG  29          1HH1      ARG  29  -0.090  -2.326 -11.924
  202   HH12  ARG  29          2HH1      ARG  29  -1.817  -2.196 -11.885
  203   HH21  ARG  29          1HH2      ARG  29  -2.320  -5.431 -10.656
  204   HH22  ARG  29          2HH2      ARG  29  -3.085  -3.963 -11.162
  205    H    TRP  30           H        TRP  30   5.628  -4.819  -8.057
  206    HA   TRP  30           HA       TRP  30   7.953  -5.713  -9.381
  207    HB2  TRP  30           1HB      TRP  30   8.373  -7.032  -7.365
  208    HB3  TRP  30           2HB      TRP  30   7.825  -5.413  -6.940
  209    HD1  TRP  30           HD1      TRP  30   5.214  -5.222  -6.081
  210    HE1  TRP  30           HE1      TRP  30   3.787  -6.925  -4.783
  211    HE3  TRP  30           HE3      TRP  30   7.942  -9.445  -7.013
  212    HZ2  TRP  30           HZ2      TRP  30   3.814  -9.692  -4.226
  213    HZ3  TRP  30           HZ3      TRP  30   7.173 -11.579  -6.061
  214    HH2  TRP  30           HH2      TRP  30   5.152 -11.698  -4.696
  215    H    ASP  31           H        ASP  31   4.769  -6.872  -9.424
  216    HA   ASP  31           HA       ASP  31   5.445  -9.634  -9.953
  217    HB2  ASP  31           1HB      ASP  31   3.302  -8.783  -8.818
  218    HB3  ASP  31           2HB      ASP  31   2.762  -8.354 -10.438
  219    H    GLN  32           H        GLN  32   4.664  -6.748 -11.771
  220    HA   GLN  32           HA       GLN  32   4.160  -7.982 -14.260
  221    HB2  GLN  32           1HB      GLN  32   4.948  -5.214 -13.417
  222    HB3  GLN  32           2HB      GLN  32   4.905  -5.638 -15.123
  223    HG2  GLN  32           1HG      GLN  32   2.565  -6.046 -13.288
  224    HG3  GLN  32           2HG      GLN  32   2.836  -4.551 -14.182
  225   HE21  GLN  32          2HE2      GLN  32   1.753  -7.793 -14.317
  226   HE22  GLN  32          1HE2      GLN  32   1.286  -7.807 -15.981
  227    H    ILE  33           H        ILE  33   7.084  -7.174 -12.571
  228    HA   ILE  33           HA       ILE  33   8.945  -7.024 -14.600
  229    HB   ILE  33           HB       ILE  33   9.326  -8.416 -11.946
  230   HG12  ILE  33          1HG1      ILE  33   8.473  -6.138 -11.666
  231   HG13  ILE  33          2HG1      ILE  33  10.157  -6.236 -11.161
  232   HG21  ILE  33          1HG2      ILE  33  11.088  -8.872 -13.613
  233   HG22  ILE  33          2HG2      ILE  33  11.361  -7.137 -13.765
  234   HG23  ILE  33          3HG2      ILE  33  11.679  -7.948 -12.232
  235   HD11  ILE  33          3HD1      ILE  33  10.856  -5.234 -13.260
  236   HD12  ILE  33          1HD1      ILE  33   9.178  -5.166 -13.798
  237   HD13  ILE  33          2HD1      ILE  33   9.702  -4.201 -12.417
  238    HA   PRO  34           HA       PRO  34   8.761 -10.994 -16.542
  239    HB2  PRO  34           1HB      PRO  34  11.055 -10.783 -17.979
  240    HB3  PRO  34           2HB      PRO  34   9.568  -9.933 -18.414
  241    HG2  PRO  34           1HG      PRO  34  11.976  -8.912 -16.958
  242    HG3  PRO  34           2HG      PRO  34  11.027  -8.131 -18.237
  243    HD2  PRO  34           1HD      PRO  34  10.725  -7.518 -15.617
  244    HD3  PRO  34           2HD      PRO  34   9.380  -7.453 -16.774
  245    H    ASP  35           H        ASP  35   9.304 -12.919 -15.746
  246    HA   ASP  35           HA       ASP  35  11.236 -13.265 -13.727
  247    HB2  ASP  35           1HB      ASP  35   9.790 -15.270 -15.466
  248    HB3  ASP  35           2HB      ASP  35  10.829 -15.722 -14.117
  249    H    ASP  36           H        ASP  36  11.534 -13.118 -17.108
  250    HA   ASP  36           HA       ASP  36  14.036 -14.629 -17.141
  251    HB2  ASP  36           1HB      ASP  36  12.133 -14.686 -18.958
  252    HB3  ASP  36           2HB      ASP  36  12.930 -13.230 -19.546
  253    H    TRP  37           H        TRP  37  13.677 -11.993 -15.789
  254    HA   TRP  37           HA       TRP  37  15.137 -10.085 -17.364
  255    HB2  TRP  37           1HB      TRP  37  13.469  -9.387 -15.678
  256    HB3  TRP  37           2HB      TRP  37  14.490 -10.058 -14.408
  257    HD1  TRP  37           HD1      TRP  37  16.174  -8.130 -17.217
  258    HE1  TRP  37           HE1      TRP  37  17.077  -5.908 -16.284
  259    HE3  TRP  37           HE3      TRP  37  14.026  -8.265 -12.580
  260    HZ2  TRP  37           HZ2      TRP  37  16.902  -4.410 -13.898
  261    HZ3  TRP  37           HZ3      TRP  37  14.444  -6.398 -11.032
  262    HH2  TRP  37           HH2      TRP  37  15.853  -4.512 -11.679
  263    H    CYS  38           H        CYS  38  17.249 -10.188 -17.705
  264    HA   CYS  38           HA       CYS  38  18.942 -11.612 -15.783
  265    HB2  CYS  38           1HB      CYS  38  19.667 -10.657 -18.558
  266    HB3  CYS  38           2HB      CYS  38  20.578 -11.773 -17.549
  267    HG   CYS  38           HG       CYS  38  17.980 -12.357 -19.569
  268    H    CYS  39           H        CYS  39  20.343 -10.579 -14.512
  269    HA   CYS  39           HA       CYS  39  20.995  -7.777 -15.139
  270    HB2  CYS  39           1HB      CYS  39  19.769  -8.921 -12.741
  271    HB3  CYS  39           2HB      CYS  39  21.183  -7.936 -12.390
  272    HG   CYS  39           HG       CYS  39  20.215  -5.610 -13.439
  273    HA   PRO  40           HA       PRO  40  25.238  -8.735 -14.581
  274    HB2  PRO  40           1HB      PRO  40  26.181  -6.541 -13.290
  275    HB3  PRO  40           2HB      PRO  40  25.699  -6.521 -14.991
  276    HG2  PRO  40           1HG      PRO  40  24.171  -5.621 -12.579
  277    HG3  PRO  40           2HG      PRO  40  24.327  -4.837 -14.162
  278    HD2  PRO  40           1HD      PRO  40  22.149  -6.284 -13.461
  279    HD3  PRO  40           2HD      PRO  40  22.741  -6.198 -15.133
  280    H    ASP  41           H        ASP  41  23.930  -7.261 -11.604
  281    HA   ASP  41           HA       ASP  41  25.758  -8.739  -9.941
  282    HB2  ASP  41           1HB      ASP  41  23.790  -6.588  -9.582
  283    HB3  ASP  41           2HB      ASP  41  23.876  -7.713  -8.228
  284    H    CYS  42           H        CYS  42  22.220  -8.709 -10.365
  285    HA   CYS  42           HA       CYS  42  21.615 -10.814  -8.654
  286    HB2  CYS  42           1HB      CYS  42  19.938  -9.302  -9.675
  287    HB3  CYS  42           2HB      CYS  42  20.195 -10.091 -11.226
  288    HG   CYS  42           HG       CYS  42  18.063 -10.870  -8.929
  289    H    SER  43           H        SER  43  23.100 -10.848 -11.758
  290    HA   SER  43           HA       SER  43  22.454 -13.317 -12.785
  291    HB2  SER  43           1HB      SER  43  24.556 -11.393 -13.154
  292    HB3  SER  43           2HB      SER  43  25.241 -13.018 -13.179
  293    HG   SER  43           HG       SER  43  23.362 -13.446 -14.672
  294    H    VAL  44           H        VAL  44  24.546 -12.548 -10.091
  295    HA   VAL  44           HA       VAL  44  25.045 -15.428  -9.701
  296    HB   VAL  44           HB       VAL  44  26.996 -14.690  -8.286
  297   HG11  VAL  44          1HG1      VAL  44  26.889 -15.284 -10.889
  298   HG12  VAL  44          2HG1      VAL  44  27.536 -13.646 -11.001
  299   HG13  VAL  44          3HG1      VAL  44  28.392 -14.871 -10.063
  300   HG21  VAL  44          3HG2      VAL  44  26.962 -12.083  -9.718
  301   HG22  VAL  44          1HG2      VAL  44  25.958 -12.263  -8.279
  302   HG23  VAL  44          2HG2      VAL  44  27.700 -12.517  -8.176
  303    H    ARG  45           H        ARG  45  22.720 -13.826  -8.830
  304    HA   ARG  45           HA       ARG  45  22.792 -14.607  -6.027
  305    HB2  ARG  45           1HB      ARG  45  22.546 -11.802  -6.997
  306    HB3  ARG  45           2HB      ARG  45  21.540 -12.288  -5.639
  307    HG2  ARG  45           1HG      ARG  45  24.486 -12.806  -5.621
  308    HG3  ARG  45           2HG      ARG  45  23.835 -11.229  -5.171
  309    HD2  ARG  45           1HD      ARG  45  23.774 -12.157  -3.113
  310    HD3  ARG  45           2HD      ARG  45  22.248 -12.818  -3.698
  311    HE   ARG  45           HE       ARG  45  23.186 -14.904  -3.675
  312   HH11  ARG  45          1HH1      ARG  45  25.714 -12.517  -3.500
  313   HH12  ARG  45          2HH1      ARG  45  26.968 -13.677  -3.207
  314   HH21  ARG  45          1HH2      ARG  45  24.828 -16.440  -3.290
  315   HH22  ARG  45          2HH2      ARG  45  26.463 -15.908  -3.089
  316    H    GLU  46           H        GLU  46  20.976 -15.636  -5.511
  317    HA   GLU  46           HA       GLU  46  18.886 -16.011  -7.361
  318    HB2  GLU  46           1HB      GLU  46  19.146 -16.630  -4.424
  319    HB3  GLU  46           2HB      GLU  46  17.693 -17.019  -5.333
  320    HG2  GLU  46           1HG      GLU  46  19.092 -18.362  -6.883
  321    HG3  GLU  46           2HG      GLU  46  20.469 -18.064  -5.824
  322    H    LYS  47           H        LYS  47  16.851 -15.163  -7.519
  323    HA   LYS  47           HA       LYS  47  16.430 -12.503  -6.798
  324    HB2  LYS  47           1HB      LYS  47  15.214 -14.169  -8.507
  325    HB3  LYS  47           2HB      LYS  47  14.047 -14.235  -7.193
  326    HG2  LYS  47           1HG      LYS  47  13.449 -12.034  -7.427
  327    HG3  LYS  47           2HG      LYS  47  14.993 -11.579  -8.152
  328    HD2  LYS  47           1HD      LYS  47  14.371 -12.811 -10.193
  329    HD3  LYS  47           2HD      LYS  47  12.810 -13.199  -9.466
  330    HE2  LYS  47           1HE      LYS  47  12.759 -11.262 -11.036
  331    HE3  LYS  47           2HE      LYS  47  12.186 -10.892  -9.410
  332    HZ1  LYS  47           3HZ      LYS  47  13.960  -9.568  -8.984
  333    HZ2  LYS  47           1HZ      LYS  47  13.902  -9.358 -10.662
  334    HZ3  LYS  47           2HZ      LYS  47  15.015 -10.436  -9.982
  335    H    VAL  48           H        VAL  48  15.844 -15.433  -5.046
  336    HA   VAL  48           HA       VAL  48  13.907 -14.546  -3.221
  337    HB   VAL  48           HB       VAL  48  14.623 -16.920  -3.511
  338   HG11  VAL  48          1HG1      VAL  48  16.704 -17.614  -3.117
  339   HG12  VAL  48          2HG1      VAL  48  17.157 -15.911  -3.013
  340   HG13  VAL  48          3HG1      VAL  48  16.752 -16.808  -1.549
  341   HG21  VAL  48          3HG2      VAL  48  13.934 -17.501  -1.408
  342   HG22  VAL  48          1HG2      VAL  48  14.965 -16.306  -0.621
  343   HG23  VAL  48          2HG2      VAL  48  13.474 -15.799  -1.413
  344    H    ASP  49           H        ASP  49  17.210 -13.727  -3.553
  345    HA   ASP  49           HA       ASP  49  17.879 -13.115  -0.891
  346    HB2  ASP  49           1HB      ASP  49  19.467 -13.270  -2.850
  347    HB3  ASP  49           2HB      ASP  49  18.898 -11.679  -3.345
  348    H    PHE  50           H        PHE  50  15.788 -11.569  -3.117
  349    HA   PHE  50           HA       PHE  50  15.948  -8.929  -2.044
  350    HB2  PHE  50           1HB      PHE  50  14.258 -10.354  -4.012
  351    HB3  PHE  50           2HB      PHE  50  13.510  -8.973  -3.217
  352    HD1  PHE  50           HD1      PHE  50  14.400  -6.727  -3.528
  353    HD2  PHE  50           HD2      PHE  50  16.074 -10.076  -5.552
  354    HE1  PHE  50           HE1      PHE  50  15.559  -5.207  -5.077
  355    HE2  PHE  50           HE2      PHE  50  17.237  -8.561  -7.103
  356    HZ   PHE  50           HZ       PHE  50  16.981  -6.123  -6.866
  357    H    GLU  51           H        GLU  51  14.881  -8.019  -0.386
  358    HA   GLU  51           HA       GLU  51  12.848  -9.651   0.989
  359    HB2  GLU  51           1HB      GLU  51  14.802  -7.751   2.295
  360    HB3  GLU  51           2HB      GLU  51  13.635  -8.781   3.111
  361    HG2  GLU  51           1HG      GLU  51  14.854 -10.744   2.073
  362    HG3  GLU  51           2HG      GLU  51  16.118  -9.595   1.637
  363    H    ARG  52           H        ARG  52  11.153  -8.522   2.048
  364    HA   ARG  52           HA       ARG  52  10.358  -6.128   0.650
  365    HB2  ARG  52           1HB      ARG  52   8.660  -7.775   1.051
  366    HB3  ARG  52           2HB      ARG  52   9.014  -7.800   2.773
  367    HG2  ARG  52           1HG      ARG  52   8.161  -5.554   3.020
  368    HG3  ARG  52           2HG      ARG  52   7.894  -5.439   1.279
  369    HD2  ARG  52           1HD      ARG  52   6.559  -7.415   3.126
  370    HD3  ARG  52           2HD      ARG  52   5.825  -5.930   2.521
  371    HE   ARG  52           HE       ARG  52   6.640  -7.340   0.296
  372   HH11  ARG  52          1HH1      ARG  52   4.474  -7.845   2.974
  373   HH12  ARG  52          2HH1      ARG  52   3.398  -8.867   2.080
  374   HH21  ARG  52          1HH2      ARG  52   5.231  -8.685  -0.892
  375   HH22  ARG  52          2HH2      ARG  52   3.830  -9.345  -0.119
  376    H    MET  53           H        MET  53  10.908  -4.156   1.278
  377    HA   MET  53           HA       MET  53  12.160  -3.590   3.744
  378    HB2  MET  53           1HB      MET  53  11.916  -1.209   3.060
  379    HB3  MET  53           2HB      MET  53  12.631  -2.226   1.815
  380    HG2  MET  53           1HG      MET  53  11.153  -1.280   0.450
  381    HG3  MET  53           2HG      MET  53   9.979  -2.360   1.199
  382    HE1  MET  53           3HE      MET  53  10.669   0.615  -0.090
  383    HE2  MET  53           1HE      MET  53   8.991   1.128   0.091
  384    HE3  MET  53           2HE      MET  53  10.269   1.970   0.968
  385    H    GLY  54           H        GLY  54  11.428  -2.410   5.539
  386    HA2  GLY  54           1HA      GLY  54   8.524  -2.613   5.956
  387    HA3  GLY  54           2HA      GLY  54   9.736  -2.559   7.227
  388    H    GLY  55           H        GLY  55   9.203  -0.804   8.390
  389    HA2  GLY  55           1HA      GLY  55   9.774   1.775   7.429
  390    HA3  GLY  55           2HA      GLY  55   8.033   1.540   7.383
  391    H    LYS  56           H        LYS  56  10.688   0.814   9.654
  392    HA   LYS  56           HA       LYS  56   9.325   2.368  11.708
  393    HB2  LYS  56           1HB      LYS  56   9.513   0.522  13.353
  394    HB3  LYS  56           2HB      LYS  56   8.392   0.162  12.047
  395    HG2  LYS  56           1HG      LYS  56  10.032  -1.246  10.973
  396    HG3  LYS  56           2HG      LYS  56  11.236  -0.818  12.191
  397    HD2  LYS  56           1HD      LYS  56  10.428  -2.908  12.876
  398    HD3  LYS  56           2HD      LYS  56   9.572  -1.751  13.898
  399    HE2  LYS  56           1HE      LYS  56   7.587  -1.957  12.629
  400    HE3  LYS  56           2HE      LYS  56   8.421  -2.805  11.327
  401    HZ1  LYS  56           3HZ      LYS  56   7.373  -3.828  13.823
  402    HZ2  LYS  56           1HZ      LYS  56   8.903  -4.417  13.405
  403    HZ3  LYS  56           2HZ      LYS  56   7.601  -4.611  12.342
  Start of MODEL    7
    1    H1   MET   1           H        MET   1   2.173  -1.659   1.829
    2    HA   MET   1           HA       MET   1   1.504  -2.068  -0.978
    3    HB2  MET   1           1HB      MET   1   3.110   0.299   0.000
    4    HB3  MET   1           2HB      MET   1   2.937  -0.174  -1.685
    5    HG2  MET   1           1HG      MET   1   1.335   1.424  -1.582
    6    HG3  MET   1           2HG      MET   1   0.372   0.025  -1.114
    7    HE1  MET   1           3HE      MET   1   1.676   3.600   1.314
    8    HE2  MET   1           1HE      MET   1   2.120   3.129  -0.328
    9    HE3  MET   1           2HE      MET   1   0.497   3.734   0.008
   10    H    THR   2           H        THR   2   3.319  -2.711  -2.276
   11    HA   THR   2           HA       THR   2   5.313  -4.143  -0.706
   12    HB   THR   2           HB       THR   2   4.707  -4.254  -3.667
   13    HG1  THR   2           HG1      THR   2   3.880  -5.749  -1.425
   14   HG21  THR   2          3HG2      THR   2   6.030  -6.538  -3.141
   15   HG22  THR   2          1HG2      THR   2   6.830  -5.459  -2.000
   16   HG23  THR   2          2HG2      THR   2   6.821  -5.073  -3.721
   17    H    ALA   3           H        ALA   3   7.522  -3.889  -0.925
   18    HA   ALA   3           HA       ALA   3   8.578  -1.901  -2.757
   19    HB1  ALA   3           1HB      ALA   3   7.836  -1.034  -0.265
   20    HB2  ALA   3           2HB      ALA   3   9.553  -1.381  -0.057
   21    HB3  ALA   3           3HB      ALA   3   9.026  -0.258  -1.310
   22    H    TYR   4           H        TYR   4  10.280  -2.858  -3.637
   23    HA   TYR   4           HA       TYR   4  11.905  -4.663  -1.970
   24    HB2  TYR   4           1HB      TYR   4  11.291  -4.664  -4.917
   25    HB3  TYR   4           2HB      TYR   4  12.668  -5.546  -4.266
   26    HD1  TYR   4           HD1      TYR   4  12.269  -7.390  -2.616
   27    HD2  TYR   4           HD2      TYR   4   9.090  -5.524  -4.741
   28    HE1  TYR   4           HE1      TYR   4  10.805  -9.292  -2.083
   29    HE2  TYR   4           HE2      TYR   4   7.617  -7.421  -4.214
   30    HH   TYR   4           HH       TYR   4   7.511  -9.215  -2.376
   31    H    ARG   5           H        ARG   5  13.953  -4.136  -1.571
   32    HA   ARG   5           HA       ARG   5  15.344  -2.284  -3.363
   33    HB2  ARG   5           1HB      ARG   5  14.409  -0.902  -1.571
   34    HB3  ARG   5           2HB      ARG   5  15.160  -1.940  -0.366
   35    HG2  ARG   5           1HG      ARG   5  16.761  -0.369  -0.395
   36    HG3  ARG   5           2HG      ARG   5  17.323  -1.254  -1.814
   37    HD2  ARG   5           1HD      ARG   5  17.173   0.703  -2.885
   38    HD3  ARG   5           2HD      ARG   5  15.432   0.426  -2.869
   39    HE   ARG   5           HE       ARG   5  16.217   1.676  -0.469
   40   HH11  ARG   5          1HH1      ARG   5  15.825   2.334  -3.865
   41   HH12  ARG   5          2HH1      ARG   5  15.500   4.020  -3.634
   42   HH21  ARG   5          1HH2      ARG   5  15.790   3.894  -0.151
   43   HH22  ARG   5          2HH2      ARG   5  15.481   4.906  -1.521
   44    H    CYS   6           H        CYS   6  16.887  -3.645  -4.070
   45    HA   CYS   6           HA       CYS   6  18.871  -4.545  -2.165
   46    HB2  CYS   6           1HB      CYS   6  17.083  -6.375  -2.395
   47    HB3  CYS   6           2HB      CYS   6  17.699  -6.602  -4.027
   48    HG   CYS   6           HG       CYS   6  18.967  -7.615  -1.116
   49    HA   PRO   7           HA       PRO   7  20.700  -3.036  -6.085
   50    HB2  PRO   7           1HB      PRO   7  22.853  -1.902  -4.881
   51    HB3  PRO   7           2HB      PRO   7  21.294  -1.083  -5.030
   52    HG2  PRO   7           1HG      PRO   7  22.449  -2.545  -2.688
   53    HG3  PRO   7           2HG      PRO   7  21.575  -1.003  -2.723
   54    HD2  PRO   7           1HD      PRO   7  20.392  -3.331  -2.008
   55    HD3  PRO   7           2HD      PRO   7  19.515  -2.029  -2.836
   56    H    VAL   8           H        VAL   8  21.580  -5.275  -3.700
   57    HA   VAL   8           HA       VAL   8  24.198  -5.941  -4.582
   58    HB   VAL   8           HB       VAL   8  22.213  -7.672  -3.100
   59   HG11  VAL   8          1HG1      VAL   8  23.777  -9.215  -3.679
   60   HG12  VAL   8          2HG1      VAL   8  25.052  -8.011  -3.881
   61   HG13  VAL   8          3HG1      VAL   8  24.587  -8.544  -2.264
   62   HG21  VAL   8          3HG2      VAL   8  23.507  -5.306  -2.284
   63   HG22  VAL   8          1HG2      VAL   8  22.586  -6.437  -1.293
   64   HG23  VAL   8          2HG2      VAL   8  24.329  -6.639  -1.474
   65    H    CYS   9           H        CYS   9  21.067  -6.605  -5.802
   66    HA   CYS   9           HA       CYS   9  22.183  -8.652  -7.605
   67    HB2  CYS   9           1HB      CYS   9  19.236  -8.419  -7.204
   68    HB3  CYS   9           2HB      CYS   9  20.210  -9.840  -7.561
   69    HG   CYS   9           HG       CYS   9  21.168  -8.897  -4.635
   70    H    ASP  10           H        ASP  10  19.687  -6.116  -7.418
   71    HA   ASP  10           HA       ASP  10  20.493  -5.084  -9.992
   72    HB2  ASP  10           1HB      ASP  10  18.352  -5.346 -11.088
   73    HB3  ASP  10           2HB      ASP  10  18.931  -6.931 -10.580
   74    H    TYR  11           H        TYR  11  19.315  -3.090 -10.555
   75    HA   TYR  11           HA       TYR  11  19.292  -1.223  -8.564
   76    HB2  TYR  11           1HB      TYR  11  17.657  -1.279 -11.104
   77    HB3  TYR  11           2HB      TYR  11  17.802   0.138 -10.070
   78    HD1  TYR  11           HD1      TYR  11  20.207   0.989  -9.608
   79    HD2  TYR  11           HD2      TYR  11  19.204  -1.634 -12.804
   80    HE1  TYR  11           HE1      TYR  11  22.269   1.638 -10.781
   81    HE2  TYR  11           HE2      TYR  11  21.264  -0.993 -13.985
   82    HH   TYR  11           HH       TYR  11  23.279   0.039 -13.744
   83    H    THR  12           H        THR  12  17.565  -0.046  -7.511
   84    HA   THR  12           HA       THR  12  15.343  -1.824  -6.766
   85    HB   THR  12           HB       THR  12  15.243  -0.772  -4.652
   86    HG1  THR  12           HG1      THR  12  17.007   1.195  -5.728
   87   HG21  THR  12          3HG2      THR  12  17.469  -2.108  -5.429
   88   HG22  THR  12          1HG2      THR  12  17.165  -1.575  -3.776
   89   HG23  THR  12          2HG2      THR  12  18.178  -0.603  -4.843
   90    H    TYR  13           H        TYR  13  13.283  -1.222  -7.094
   91    HA   TYR  13           HA       TYR  13  12.626   1.570  -7.586
   92    HB2  TYR  13           1HB      TYR  13  12.015  -0.594  -9.611
   93    HB3  TYR  13           2HB      TYR  13  11.472   1.078  -9.698
   94    HD1  TYR  13           HD2      TYR  13  13.410   2.871  -9.617
   95    HD2  TYR  13           HD1      TYR  13  13.930  -1.196 -10.757
   96    HE1  TYR  13           HE2      TYR  13  15.463   3.478 -10.828
   97    HE2  TYR  13           HE1      TYR  13  15.985  -0.599 -11.970
   98    HH   TYR  13           HH       TYR  13  16.890   2.679 -12.549
   99    H    ASP  14           H        ASP  14  11.197   1.749  -5.957
  100    HA   ASP  14           HA       ASP  14   9.396  -0.313  -5.184
  101    HB2  ASP  14           1HB      ASP  14  10.140   1.355  -3.575
  102    HB3  ASP  14           2HB      ASP  14   9.410   2.641  -4.531
  103    H    GLU  15           H        GLU  15   7.170  -0.468  -5.477
  104    HA   GLU  15           HA       GLU  15   6.153   0.064  -7.987
  105    HB2  GLU  15           1HB      GLU  15   5.233  -1.174  -5.657
  106    HB3  GLU  15           2HB      GLU  15   4.044   0.075  -5.999
  107    HG2  GLU  15           1HG      GLU  15   4.861  -1.516  -8.322
  108    HG3  GLU  15           2HG      GLU  15   4.020  -2.413  -7.060
  109    H    GLY  16           H        GLY  16   5.381   1.835  -4.984
  110    HA2  GLY  16           1HA      GLY  16   3.813   3.827  -6.157
  111    HA3  GLY  16           2HA      GLY  16   4.687   3.995  -4.642
  112    H    LYS  17           H        LYS  17   7.223   3.385  -6.246
  113    HA   LYS  17           HA       LYS  17   7.916   6.121  -6.719
  114    HB2  LYS  17           1HB      LYS  17   9.433   4.234  -5.854
  115    HB3  LYS  17           2HB      LYS  17   9.569   3.741  -7.537
  116    HG2  LYS  17           1HG      LYS  17  11.438   5.068  -7.210
  117    HG3  LYS  17           2HG      LYS  17  10.289   6.171  -7.971
  118    HD2  LYS  17           1HD      LYS  17   9.638   6.867  -5.609
  119    HD3  LYS  17           2HD      LYS  17  11.085   6.007  -5.075
  120    HE2  LYS  17           1HE      LYS  17  11.122   8.167  -7.172
  121    HE3  LYS  17           2HE      LYS  17  11.355   8.486  -5.454
  122    HZ1  LYS  17           3HZ      LYS  17  13.370   8.036  -7.060
  123    HZ2  LYS  17           1HZ      LYS  17  13.016   6.423  -6.693
  124    HZ3  LYS  17           2HZ      LYS  17  13.391   7.510  -5.453
  125    H    GLY  18           H        GLY  18   7.520   3.259  -8.795
  126    HA2  GLY  18           1HA      GLY  18   6.590   3.310 -10.963
  127    HA3  GLY  18           2HA      GLY  18   6.888   5.040 -11.026
  128    H    ASP  19           H        ASP  19   9.017   5.789 -11.482
  129    HA   ASP  19           HA       ASP  19  10.993   5.789 -12.608
  130    HB2  ASP  19           1HB      ASP  19  11.593   4.150 -10.792
  131    HB3  ASP  19           2HB      ASP  19  11.173   2.855 -11.909
  132    HA   PRO  20           HA       PRO  20   8.813   3.942 -16.268
  133    HB2  PRO  20           1HB      PRO  20   8.822   6.234 -17.723
  134    HB3  PRO  20           2HB      PRO  20   7.549   5.838 -16.563
  135    HG2  PRO  20           1HG      PRO  20   9.923   7.631 -16.232
  136    HG3  PRO  20           2HG      PRO  20   8.246   7.888 -15.716
  137    HD2  PRO  20           1HD      PRO  20  10.186   7.076 -14.011
  138    HD3  PRO  20           2HD      PRO  20   8.491   6.578 -13.835
  139    H    ARG  21           H        ARG  21  11.781   5.566 -15.658
  140    HA   ARG  21           HA       ARG  21  12.957   5.556 -18.197
  141    HB2  ARG  21           1HB      ARG  21  13.967   5.594 -15.398
  142    HB3  ARG  21           2HB      ARG  21  15.115   5.201 -16.670
  143    HG2  ARG  21           1HG      ARG  21  15.383   7.461 -16.562
  144    HG3  ARG  21           2HG      ARG  21  14.119   7.358 -17.789
  145    HD2  ARG  21           1HD      ARG  21  12.441   7.653 -15.951
  146    HD3  ARG  21           2HD      ARG  21  13.788   7.974 -14.859
  147    HE   ARG  21           HE       ARG  21  14.001  10.062 -15.783
  148   HH11  ARG  21          1HH1      ARG  21  11.955   8.105 -17.808
  149   HH12  ARG  21          2HH1      ARG  21  11.473   9.426 -18.821
  150   HH21  ARG  21          1HH2      ARG  21  13.374  11.809 -17.108
  151   HH22  ARG  21          2HH2      ARG  21  12.281  11.532 -18.422
  152    H    GLU  22           H        GLU  22  12.395   2.992 -15.920
  153    HA   GLU  22           HA       GLU  22  14.109   1.154 -17.412
  154    HB2  GLU  22           1HB      GLU  22  12.752   1.068 -14.748
  155    HB3  GLU  22           2HB      GLU  22  13.189  -0.442 -15.535
  156    HG2  GLU  22           1HG      GLU  22  15.048   1.793 -14.761
  157    HG3  GLU  22           2HG      GLU  22  14.923   0.205 -14.006
  158    H    GLY  23           H        GLY  23  11.563   2.281 -18.467
  159    HA2  GLY  23           1HA      GLY  23   9.879   1.509 -19.829
  160    HA3  GLY  23           2HA      GLY  23  10.564  -0.099 -19.652
  161    H    PHE  24           H        PHE  24   9.764   1.541 -16.749
  162    HA   PHE  24           HA       PHE  24   7.177   0.161 -16.591
  163    HB2  PHE  24           1HB      PHE  24   9.287   0.112 -14.423
  164    HB3  PHE  24           2HB      PHE  24   7.685  -0.612 -14.325
  165    HD1  PHE  24           HD2      PHE  24   7.333  -2.009 -16.787
  166    HD2  PHE  24           HD1      PHE  24  10.871  -1.545 -14.467
  167    HE1  PHE  24           HE2      PHE  24   8.221  -4.102 -17.728
  168    HE2  PHE  24           HE1      PHE  24  11.765  -3.636 -15.405
  169    HZ   PHE  24           HZ       PHE  24  10.439  -4.918 -17.037
  170    HA   PRO  25           HA       PRO  25   6.713   4.544 -15.288
  171    HB2  PRO  25           1HB      PRO  25   4.233   4.816 -16.359
  172    HB3  PRO  25           2HB      PRO  25   5.715   5.034 -17.299
  173    HG2  PRO  25           1HG      PRO  25   3.910   2.651 -17.132
  174    HG3  PRO  25           2HG      PRO  25   4.676   3.377 -18.557
  175    HD2  PRO  25           1HD      PRO  25   5.655   1.162 -17.346
  176    HD3  PRO  25           2HD      PRO  25   6.699   2.353 -18.147
  177    H    ALA  26           H        ALA  26   4.657   5.537 -14.204
  178    HA   ALA  26           HA       ALA  26   4.200   4.272 -11.795
  179    HB1  ALA  26           1HB      ALA  26   3.773   6.637 -12.132
  180    HB2  ALA  26           2HB      ALA  26   2.416   6.260 -13.195
  181    HB3  ALA  26           3HB      ALA  26   2.338   5.841 -11.484
  182    H    GLY  27           H        GLY  27   2.952   2.643 -11.127
  183    HA2  GLY  27           1HA      GLY  27   0.746   1.587 -11.136
  184    HA3  GLY  27           2HA      GLY  27   0.736   1.786 -12.882
  185    H    THR  28           H        THR  28   3.398   0.923 -13.373
  186    HA   THR  28           HA       THR  28   3.040  -1.797 -13.747
  187    HB   THR  28           HB       THR  28   5.657  -0.302 -13.498
  188    HG1  THR  28           HG1      THR  28   4.447  -1.106 -15.916
  189   HG21  THR  28          3HG2      THR  28   6.003  -2.402 -15.261
  190   HG22  THR  28          1HG2      THR  28   5.050  -3.112 -13.958
  191   HG23  THR  28          2HG2      THR  28   6.592  -2.334 -13.600
  192    H    ARG  29           H        ARG  29   2.673  -3.241 -12.189
  193    HA   ARG  29           HA       ARG  29   3.755  -2.970  -9.547
  194    HB2  ARG  29           1HB      ARG  29   2.347  -5.352 -10.763
  195    HB3  ARG  29           2HB      ARG  29   2.572  -5.023  -9.050
  196    HG2  ARG  29           1HG      ARG  29   1.251  -2.850  -9.549
  197    HG3  ARG  29           2HG      ARG  29   0.732  -3.711 -11.000
  198    HD2  ARG  29           1HD      ARG  29   0.121  -5.623  -9.395
  199    HD3  ARG  29           2HD      ARG  29   0.255  -4.411  -8.122
  200    HE   ARG  29           HE       ARG  29  -1.759  -3.573  -8.784
  201   HH11  ARG  29          1HH1      ARG  29  -0.427  -5.459 -11.390
  202   HH12  ARG  29          2HH1      ARG  29  -1.840  -5.323 -12.384
  203   HH21  ARG  29          1HH2      ARG  29  -3.625  -3.387 -10.083
  204   HH22  ARG  29          2HH2      ARG  29  -3.658  -4.144 -11.640
  205    H    TRP  30           H        TRP  30   5.261  -4.301  -8.522
  206    HA   TRP  30           HA       TRP  30   7.539  -4.983  -9.927
  207    HB2  TRP  30           1HB      TRP  30   8.122  -6.372  -7.895
  208    HB3  TRP  30           2HB      TRP  30   7.684  -4.698  -7.564
  209    HD1  TRP  30           HD1      TRP  30   5.432  -4.257  -6.220
  210    HE1  TRP  30           HE1      TRP  30   3.922  -5.795  -4.812
  211    HE3  TRP  30           HE3      TRP  30   7.229  -8.788  -7.760
  212    HZ2  TRP  30           HZ2      TRP  30   3.544  -8.563  -4.408
  213    HZ3  TRP  30           HZ3      TRP  30   6.240 -10.833  -6.814
  214    HH2  TRP  30           HH2      TRP  30   4.436 -10.720  -5.172
  215    H    ASP  31           H        ASP  31   4.782  -7.011  -9.059
  216    HA   ASP  31           HA       ASP  31   5.803  -9.492  -9.812
  217    HB2  ASP  31           1HB      ASP  31   3.655  -9.122  -8.600
  218    HB3  ASP  31           2HB      ASP  31   2.940  -8.562 -10.110
  219    H    GLN  32           H        GLN  32   4.595  -6.855 -11.741
  220    HA   GLN  32           HA       GLN  32   4.122  -8.250 -14.140
  221    HB2  GLN  32           1HB      GLN  32   3.549  -5.797 -13.444
  222    HB3  GLN  32           2HB      GLN  32   5.130  -5.428 -14.121
  223    HG2  GLN  32           1HG      GLN  32   3.435  -5.050 -15.777
  224    HG3  GLN  32           2HG      GLN  32   4.425  -6.429 -16.253
  225   HE21  GLN  32          2HE2      GLN  32   1.548  -5.857 -14.247
  226   HE22  GLN  32          1HE2      GLN  32   0.615  -7.145 -14.921
  227    H    ILE  33           H        ILE  33   7.036  -6.976 -12.686
  228    HA   ILE  33           HA       ILE  33   8.765  -6.895 -14.835
  229    HB   ILE  33           HB       ILE  33   9.431  -7.878 -12.057
  230   HG12  ILE  33          1HG1      ILE  33   9.488  -5.086 -13.224
  231   HG13  ILE  33          2HG1      ILE  33   8.336  -5.680 -12.033
  232   HG21  ILE  33          1HG2      ILE  33  11.701  -7.206 -12.549
  233   HG22  ILE  33          2HG2      ILE  33  11.149  -8.367 -13.756
  234   HG23  ILE  33          3HG2      ILE  33  11.218  -6.650 -14.151
  235   HD11  ILE  33          3HD1      ILE  33  10.230  -6.057 -10.478
  236   HD12  ILE  33          1HD1      ILE  33  11.294  -5.296 -11.660
  237   HD13  ILE  33          2HD1      ILE  33   9.989  -4.367 -10.921
  238    HA   PRO  34           HA       PRO  34   8.933 -11.082 -16.250
  239    HB2  PRO  34           1HB      PRO  34  11.112 -10.820 -17.849
  240    HB3  PRO  34           2HB      PRO  34   9.517 -10.197 -18.289
  241    HG2  PRO  34           1HG      PRO  34  11.865  -8.745 -17.132
  242    HG3  PRO  34           2HG      PRO  34  10.770  -8.243 -18.433
  243    HD2  PRO  34           1HD      PRO  34  10.534  -7.326 -15.896
  244    HD3  PRO  34           2HD      PRO  34   9.133  -7.558 -16.962
  245    H    ASP  35           H        ASP  35   9.645 -12.727 -15.060
  246    HA   ASP  35           HA       ASP  35  11.877 -12.551 -13.320
  247    HB2  ASP  35           1HB      ASP  35  11.489 -15.031 -13.030
  248    HB3  ASP  35           2HB      ASP  35  10.093 -14.009 -12.699
  249    H    ASP  36           H        ASP  36  11.629 -13.188 -16.632
  250    HA   ASP  36           HA       ASP  36  13.913 -14.923 -16.853
  251    HB2  ASP  36           1HB      ASP  36  11.922 -14.741 -18.480
  252    HB3  ASP  36           2HB      ASP  36  12.736 -13.310 -19.106
  253    H    TRP  37           H        TRP  37  13.418 -11.566 -16.532
  254    HA   TRP  37           HA       TRP  37  15.465 -10.421 -17.983
  255    HB2  TRP  37           1HB      TRP  37  13.659  -9.471 -16.218
  256    HB3  TRP  37           2HB      TRP  37  15.112  -9.397 -15.224
  257    HD1  TRP  37           HD1      TRP  37  16.641  -7.351 -15.568
  258    HE1  TRP  37           HE1      TRP  37  16.733  -5.406 -17.252
  259    HE3  TRP  37           HE3      TRP  37  13.100  -8.976 -18.879
  260    HZ2  TRP  37           HZ2      TRP  37  15.471  -4.660 -19.664
  261    HZ3  TRP  37           HZ3      TRP  37  12.602  -7.588 -20.848
  262    HH2  TRP  37           HH2      TRP  37  13.763  -5.475 -21.231
  263    H    CYS  38           H        CYS  38  17.628 -10.377 -17.869
  264    HA   CYS  38           HA       CYS  38  18.896 -11.840 -15.656
  265    HB2  CYS  38           1HB      CYS  38  20.086 -11.194 -18.358
  266    HB3  CYS  38           2HB      CYS  38  20.738 -12.289 -17.145
  267    HG   CYS  38           HG       CYS  38  17.771 -12.831 -18.759
  268    H    CYS  39           H        CYS  39  20.518 -10.937 -14.463
  269    HA   CYS  39           HA       CYS  39  21.270  -8.164 -15.095
  270    HB2  CYS  39           1HB      CYS  39  19.944  -9.214 -12.705
  271    HB3  CYS  39           2HB      CYS  39  21.389  -8.277 -12.342
  272    HG   CYS  39           HG       CYS  39  18.908  -7.058 -14.347
  273    HA   PRO  40           HA       PRO  40  25.453  -9.287 -14.413
  274    HB2  PRO  40           1HB      PRO  40  26.454  -7.126 -13.109
  275    HB3  PRO  40           2HB      PRO  40  26.017  -7.097 -14.822
  276    HG2  PRO  40           1HG      PRO  40  24.467  -6.118 -12.456
  277    HG3  PRO  40           2HG      PRO  40  24.697  -5.351 -14.038
  278    HD2  PRO  40           1HD      PRO  40  22.442  -6.702 -13.387
  279    HD3  PRO  40           2HD      PRO  40  23.080  -6.651 -15.043
  280    H    ASP  41           H        ASP  41  24.129  -7.742 -11.479
  281    HA   ASP  41           HA       ASP  41  25.838  -9.329  -9.773
  282    HB2  ASP  41           1HB      ASP  41  23.554  -7.713  -8.714
  283    HB3  ASP  41           2HB      ASP  41  25.161  -7.959  -8.034
  284    H    CYS  42           H        CYS  42  22.323  -9.007 -10.260
  285    HA   CYS  42           HA       CYS  42  21.500 -11.010  -8.526
  286    HB2  CYS  42           1HB      CYS  42  20.055  -9.333  -9.773
  287    HB3  CYS  42           2HB      CYS  42  20.164 -10.405 -11.164
  288    HG   CYS  42           HG       CYS  42  17.804 -10.458  -9.185
  289    H    SER  43           H        SER  43  23.067 -11.254 -11.579
  290    HA   SER  43           HA       SER  43  22.251 -13.691 -12.560
  291    HB2  SER  43           1HB      SER  43  23.764 -12.779 -14.001
  292    HB3  SER  43           2HB      SER  43  24.755 -12.113 -12.704
  293    HG   SER  43           HG       SER  43  25.912 -13.885 -12.667
  294    H    VAL  44           H        VAL  44  24.307 -13.016  -9.816
  295    HA   VAL  44           HA       VAL  44  24.547 -15.914  -9.328
  296    HB   VAL  44           HB       VAL  44  26.527 -15.277  -7.876
  297   HG11  VAL  44          1HG1      VAL  44  26.340 -15.429 -10.779
  298   HG12  VAL  44          2HG1      VAL  44  27.798 -14.607 -10.219
  299   HG13  VAL  44          3HG1      VAL  44  27.442 -16.245  -9.670
  300   HG21  VAL  44          3HG2      VAL  44  25.711 -12.749  -8.146
  301   HG22  VAL  44          1HG2      VAL  44  27.395 -13.180  -7.849
  302   HG23  VAL  44          2HG2      VAL  44  26.854 -12.813  -9.487
  303    H    ARG  45           H        ARG  45  22.457 -13.864  -8.541
  304    HA   ARG  45           HA       ARG  45  22.365 -14.623  -5.720
  305    HB2  ARG  45           1HB      ARG  45  22.546 -11.864  -6.777
  306    HB3  ARG  45           2HB      ARG  45  21.346 -12.131  -5.520
  307    HG2  ARG  45           1HG      ARG  45  23.122 -11.592  -4.219
  308    HG3  ARG  45           2HG      ARG  45  23.386 -13.333  -4.339
  309    HD2  ARG  45           1HD      ARG  45  25.196 -13.103  -5.698
  310    HD3  ARG  45           2HD      ARG  45  24.579 -11.634  -6.451
  311    HE   ARG  45           HE       ARG  45  25.354 -11.315  -3.695
  312   HH11  ARG  45          1HH1      ARG  45  26.405 -11.229  -7.013
  313   HH12  ARG  45          2HH1      ARG  45  27.750 -10.184  -6.696
  314   HH21  ARG  45          1HH2      ARG  45  27.121  -9.938  -3.266
  315   HH22  ARG  45          2HH2      ARG  45  28.156  -9.451  -4.564
  316    H    GLU  46           H        GLU  46  20.485 -15.577  -5.344
  317    HA   GLU  46           HA       GLU  46  18.397 -15.783  -7.156
  318    HB2  GLU  46           1HB      GLU  46  18.719 -16.342  -4.255
  319    HB3  GLU  46           2HB      GLU  46  17.077 -16.272  -4.878
  320    HG2  GLU  46           1HG      GLU  46  17.358 -18.120  -6.218
  321    HG3  GLU  46           2HG      GLU  46  19.109 -17.934  -6.288
  322    H    LYS  47           H        LYS  47  16.468 -14.743  -7.463
  323    HA   LYS  47           HA       LYS  47  16.333 -11.993  -6.954
  324    HB2  LYS  47           1HB      LYS  47  15.036 -13.634  -8.634
  325    HB3  LYS  47           2HB      LYS  47  13.791 -13.461  -7.404
  326    HG2  LYS  47           1HG      LYS  47  13.361 -11.321  -7.948
  327    HG3  LYS  47           2HG      LYS  47  15.053 -10.956  -8.296
  328    HD2  LYS  47           1HD      LYS  47  14.847 -11.478 -10.483
  329    HD3  LYS  47           2HD      LYS  47  13.756 -12.828 -10.163
  330    HE2  LYS  47           1HE      LYS  47  12.999  -9.908 -10.090
  331    HE3  LYS  47           2HE      LYS  47  12.663 -11.017 -11.419
  332    HZ1  LYS  47           3HZ      LYS  47  10.732 -11.287 -10.337
  333    HZ2  LYS  47           1HZ      LYS  47  11.345 -10.751  -8.854
  334    HZ3  LYS  47           2HZ      LYS  47  11.613 -12.344  -9.355
  335    H    VAL  48           H        VAL  48  15.248 -14.727  -5.105
  336    HA   VAL  48           HA       VAL  48  13.453 -13.287  -3.410
  337    HB   VAL  48           HB       VAL  48  13.334 -15.752  -3.761
  338   HG11  VAL  48          1HG1      VAL  48  15.055 -17.103  -3.364
  339   HG12  VAL  48          2HG1      VAL  48  16.040 -15.663  -3.095
  340   HG13  VAL  48          3HG1      VAL  48  15.256 -16.464  -1.733
  341   HG21  VAL  48          3HG2      VAL  48  13.725 -15.431  -0.841
  342   HG22  VAL  48          1HG2      VAL  48  12.586 -14.340  -1.630
  343   HG23  VAL  48          2HG2      VAL  48  12.353 -16.085  -1.737
  344    H    ASP  49           H        ASP  49  16.799 -13.358  -3.653
  345    HA   ASP  49           HA       ASP  49  17.609 -13.245  -0.963
  346    HB2  ASP  49           1HB      ASP  49  18.857 -12.038  -3.439
  347    HB3  ASP  49           2HB      ASP  49  19.644 -12.102  -1.864
  348    H    PHE  50           H        PHE  50  15.957 -10.983  -2.932
  349    HA   PHE  50           HA       PHE  50  16.735  -8.534  -1.916
  350    HB2  PHE  50           1HB      PHE  50  14.246  -9.605  -3.126
  351    HB3  PHE  50           2HB      PHE  50  14.105  -8.082  -2.254
  352    HD1  PHE  50           HD1      PHE  50  16.344  -9.695  -4.767
  353    HD2  PHE  50           HD2      PHE  50  14.387  -6.151  -3.452
  354    HE1  PHE  50           HE1      PHE  50  17.201  -8.494  -6.737
  355    HE2  PHE  50           HE2      PHE  50  15.241  -4.945  -5.420
  356    HZ   PHE  50           HZ       PHE  50  16.649  -6.117  -7.066
  357    H    GLU  51           H        GLU  51  15.281  -7.114  -0.487
  358    HA   GLU  51           HA       GLU  51  14.227  -8.606   1.805
  359    HB2  GLU  51           1HB      GLU  51  16.140  -6.284   2.088
  360    HB3  GLU  51           2HB      GLU  51  15.436  -7.233   3.389
  361    HG2  GLU  51           1HG      GLU  51  16.618  -9.217   2.124
  362    HG3  GLU  51           2HG      GLU  51  17.640  -7.912   1.522
  363    H    ARG  52           H        ARG  52  12.163  -7.992   1.845
  364    HA   ARG  52           HA       ARG  52  11.137  -5.603   0.807
  365    HB2  ARG  52           1HB      ARG  52   9.054  -6.223   1.794
  366    HB3  ARG  52           2HB      ARG  52   9.845  -7.706   1.278
  367    HG2  ARG  52           1HG      ARG  52  10.619  -8.040   3.614
  368    HG3  ARG  52           2HG      ARG  52   9.666  -6.631   4.082
  369    HD2  ARG  52           1HD      ARG  52   7.635  -7.725   3.324
  370    HD3  ARG  52           2HD      ARG  52   8.568  -9.113   2.768
  371    HE   ARG  52           HE       ARG  52   8.895  -8.512   5.566
  372   HH11  ARG  52          1HH1      ARG  52   7.030 -10.239   3.188
  373   HH12  ARG  52          2HH1      ARG  52   6.447 -11.421   4.313
  374   HH21  ARG  52          1HH2      ARG  52   8.134 -10.061   7.057
  375   HH22  ARG  52          2HH2      ARG  52   7.075 -11.318   6.514
  376    H    MET  53           H        MET  53  10.832  -3.610   1.623
  377    HA   MET  53           HA       MET  53  11.953  -3.061   4.266
  378    HB2  MET  53           1HB      MET  53  11.143  -1.178   2.043
  379    HB3  MET  53           2HB      MET  53  11.900  -0.696   3.556
  380    HG2  MET  53           1HG      MET  53  13.228  -2.678   1.757
  381    HG3  MET  53           2HG      MET  53  13.347  -0.950   1.438
  382    HE1  MET  53           3HE      MET  53  15.737  -0.406   1.719
  383    HE2  MET  53           1HE      MET  53  14.851   0.702   2.767
  384    HE3  MET  53           2HE      MET  53  16.349  -0.035   3.331
  385    H    GLY  54           H        GLY  54  10.781  -2.349   5.964
  386    HA2  GLY  54           1HA      GLY  54   8.966  -1.377   7.081
  387    HA3  GLY  54           2HA      GLY  54   8.076  -1.352   5.566
  388    H    GLY  55           H        GLY  55   7.870  -2.548   8.513
  389    HA2  GLY  55           1HA      GLY  55   6.310  -4.848   7.611
  390    HA3  GLY  55           2HA      GLY  55   7.616  -5.168   8.743
  391    H    LYS  56           H        LYS  56   4.444  -3.839   8.319
  392    HA   LYS  56           HA       LYS  56   4.280  -3.057  11.130
  393    HB2  LYS  56           1HB      LYS  56   2.623  -2.549   8.697
  394    HB3  LYS  56           2HB      LYS  56   1.849  -2.461  10.275
  395    HG2  LYS  56           1HG      LYS  56   3.337  -0.725  10.980
  396    HG3  LYS  56           2HG      LYS  56   4.308  -0.900   9.516
  397    HD2  LYS  56           1HD      LYS  56   3.023   0.898   8.924
  398    HD3  LYS  56           2HD      LYS  56   1.994  -0.412   8.341
  399    HE2  LYS  56           1HE      LYS  56   0.538   0.995   9.512
  400    HE3  LYS  56           2HE      LYS  56   0.880  -0.317  10.640
  401    HZ1  LYS  56           3HZ      LYS  56   2.529   1.102  11.713
  402    HZ2  LYS  56           1HZ      LYS  56   0.996   1.817  11.742
  403    HZ3  LYS  56           2HZ      LYS  56   2.163   2.362  10.646
  Start of MODEL    8
    1    H1   MET   1           H        MET   1   1.460   0.304   1.784
    2    HA   MET   1           HA       MET   1   1.280  -1.160  -0.587
    3    HB2  MET   1           1HB      MET   1   3.168   1.121   0.025
    4    HB3  MET   1           2HB      MET   1   2.689   0.574  -1.576
    5    HG2  MET   1           1HG      MET   1   0.446   1.297  -1.235
    6    HG3  MET   1           2HG      MET   1   0.755   1.630   0.467
    7    HE1  MET   1           3HE      MET   1   0.679   3.649   1.210
    8    HE2  MET   1           1HE      MET   1   1.271   5.165   0.528
    9    HE3  MET   1           2HE      MET   1  -0.243   4.469  -0.050
   10    H    THR   2           H        THR   2   3.034  -1.914  -1.976
   11    HA   THR   2           HA       THR   2   4.972  -3.446  -0.429
   12    HB   THR   2           HB       THR   2   4.242  -3.581  -3.361
   13    HG1  THR   2           HG1      THR   2   3.569  -5.154  -1.089
   14   HG21  THR   2          3HG2      THR   2   6.428  -4.373  -3.328
   15   HG22  THR   2          1HG2      THR   2   5.486  -5.845  -3.090
   16   HG23  THR   2          2HG2      THR   2   6.261  -5.061  -1.713
   17    H    ALA   3           H        ALA   3   7.183  -3.335  -0.699
   18    HA   ALA   3           HA       ALA   3   8.329  -1.496  -2.625
   19    HB1  ALA   3           1HB      ALA   3   7.663  -0.428  -0.216
   20    HB2  ALA   3           2HB      ALA   3   9.328  -0.931   0.073
   21    HB3  ALA   3           3HB      ALA   3   8.957   0.167  -1.257
   22    H    TYR   4           H        TYR   4   9.939  -2.620  -3.482
   23    HA   TYR   4           HA       TYR   4  11.492  -4.417  -1.740
   24    HB2  TYR   4           1HB      TYR   4  10.750  -4.577  -4.647
   25    HB3  TYR   4           2HB      TYR   4  12.145  -5.454  -4.028
   26    HD1  TYR   4           HD1      TYR   4  11.848  -7.292  -2.430
   27    HD2  TYR   4           HD2      TYR   4   8.506  -5.263  -4.107
   28    HE1  TYR   4           HE1      TYR   4  10.378  -9.122  -1.697
   29    HE2  TYR   4           HE2      TYR   4   7.026  -7.087  -3.378
   30    HH   TYR   4           HH       TYR   4   6.971  -9.210  -2.591
   31    H    ARG   5           H        ARG   5  13.444  -3.702  -1.236
   32    HA   ARG   5           HA       ARG   5  14.920  -2.105  -3.223
   33    HB2  ARG   5           1HB      ARG   5  14.019  -0.797  -1.232
   34    HB3  ARG   5           2HB      ARG   5  15.146  -1.715  -0.242
   35    HG2  ARG   5           1HG      ARG   5  16.596  -0.671  -2.436
   36    HG3  ARG   5           2HG      ARG   5  15.616   0.634  -1.763
   37    HD2  ARG   5           1HD      ARG   5  17.379  -1.168  -0.114
   38    HD3  ARG   5           2HD      ARG   5  17.894   0.393  -0.750
   39    HE   ARG   5           HE       ARG   5  15.504   0.732   0.682
   40   HH11  ARG   5          1HH1      ARG   5  18.861  -0.021   1.210
   41   HH12  ARG   5          2HH1      ARG   5  18.895   0.650   2.807
   42   HH21  ARG   5          1HH2      ARG   5  15.536   1.620   2.783
   43   HH22  ARG   5          2HH2      ARG   5  17.003   1.583   3.701
   44    H    CYS   6           H        CYS   6  16.415  -3.483  -3.968
   45    HA   CYS   6           HA       CYS   6  18.382  -4.515  -2.110
   46    HB2  CYS   6           1HB      CYS   6  16.387  -6.228  -3.441
   47    HB3  CYS   6           2HB      CYS   6  18.052  -6.772  -3.608
   48    HG   CYS   6           HG       CYS   6  17.670  -5.988  -0.486
   49    HA   PRO   7           HA       PRO   7  20.238  -2.978  -6.005
   50    HB2  PRO   7           1HB      PRO   7  22.456  -1.984  -4.795
   51    HB3  PRO   7           2HB      PRO   7  20.935  -1.088  -4.900
   52    HG2  PRO   7           1HG      PRO   7  22.046  -2.674  -2.617
   53    HG3  PRO   7           2HG      PRO   7  21.245  -1.092  -2.595
   54    HD2  PRO   7           1HD      PRO   7  19.962  -3.384  -1.936
   55    HD3  PRO   7           2HD      PRO   7  19.137  -2.017  -2.713
   56    H    VAL   8           H        VAL   8  21.035  -5.330  -3.702
   57    HA   VAL   8           HA       VAL   8  23.615  -6.093  -4.562
   58    HB   VAL   8           HB       VAL   8  22.623  -6.828  -2.420
   59   HG11  VAL   8          1HG1      VAL   8  21.096  -8.959  -3.832
   60   HG12  VAL   8          2HG1      VAL   8  20.837  -8.252  -2.236
   61   HG13  VAL   8          3HG1      VAL   8  20.377  -7.356  -3.684
   62   HG21  VAL   8          3HG2      VAL   8  23.218  -9.320  -3.955
   63   HG22  VAL   8          1HG2      VAL   8  24.459  -8.077  -3.793
   64   HG23  VAL   8          2HG2      VAL   8  23.770  -8.828  -2.354
   65    H    CYS   9           H        CYS   9  20.508  -6.506  -5.950
   66    HA   CYS   9           HA       CYS   9  21.616  -8.436  -7.882
   67    HB2  CYS   9           1HB      CYS   9  19.020  -8.851  -8.246
   68    HB3  CYS   9           2HB      CYS   9  19.917  -9.690  -6.985
   69    HG   CYS   9           HG       CYS   9  18.435  -8.908  -5.049
   70    H    ASP  10           H        ASP  10  19.119  -5.911  -7.557
   71    HA   ASP  10           HA       ASP  10  20.026  -4.668 -10.008
   72    HB2  ASP  10           1HB      ASP  10  18.454  -6.412 -10.804
   73    HB3  ASP  10           2HB      ASP  10  17.192  -5.706  -9.799
   74    H    TYR  11           H        TYR  11  18.918  -2.605 -10.421
   75    HA   TYR  11           HA       TYR  11  18.867  -0.925  -8.264
   76    HB2  TYR  11           1HB      TYR  11  17.240  -0.639 -10.799
   77    HB3  TYR  11           2HB      TYR  11  17.616   0.663  -9.676
   78    HD1  TYR  11           HD2      TYR  11  20.062   1.282  -9.339
   79    HD2  TYR  11           HD1      TYR  11  18.728  -1.205 -12.524
   80    HE1  TYR  11           HE2      TYR  11  22.147   1.738 -10.561
   81    HE2  TYR  11           HE1      TYR  11  20.810  -0.757 -13.754
   82    HH   TYR  11           HH       TYR  11  22.593   0.769 -13.861
   83    H    THR  12           H        THR  12  17.127   0.204  -7.183
   84    HA   THR  12           HA       THR  12  14.822  -1.563  -6.705
   85    HB   THR  12           HB       THR  12  16.021  -1.286  -4.677
   86    HG1  THR  12           HG1      THR  12  14.026   0.707  -4.425
   87   HG21  THR  12          3HG2      THR  12  16.494   1.396  -5.709
   88   HG22  THR  12          1HG2      THR  12  17.433   0.449  -4.556
   89   HG23  THR  12          2HG2      THR  12  16.048   1.391  -4.003
   90    H    TYR  13           H        TYR  13  12.783  -0.846  -6.989
   91    HA   TYR  13           HA       TYR  13  12.256   1.999  -7.293
   92    HB2  TYR  13           1HB      TYR  13  10.945   1.447  -9.443
   93    HB3  TYR  13           2HB      TYR  13  12.696   1.582  -9.558
   94    HD1  TYR  13           HD2      TYR  13  14.082  -0.461  -9.774
   95    HD2  TYR  13           HD1      TYR  13   9.831  -0.623  -9.872
   96    HE1  TYR  13           HE2      TYR  13  14.196  -2.712 -10.759
   97    HE2  TYR  13           HE1      TYR  13   9.934  -2.875 -10.856
   98    HH   TYR  13           HH       TYR  13  12.347  -4.120 -12.351
   99    H    ASP  14           H        ASP  14  10.702   2.250  -5.826
  100    HA   ASP  14           HA       ASP  14   8.868   0.201  -5.095
  101    HB2  ASP  14           1HB      ASP  14   9.534   1.897  -3.484
  102    HB3  ASP  14           2HB      ASP  14   8.857   3.167  -4.499
  103    H    GLU  15           H        GLU  15   6.633   0.084  -5.446
  104    HA   GLU  15           HA       GLU  15   5.727   0.513  -8.015
  105    HB2  GLU  15           1HB      GLU  15   4.267   0.145  -5.412
  106    HB3  GLU  15           2HB      GLU  15   3.391   0.362  -6.921
  107    HG2  GLU  15           1HG      GLU  15   5.302  -1.851  -6.225
  108    HG3  GLU  15           2HG      GLU  15   3.561  -1.973  -6.468
  109    H    GLY  16           H        GLY  16   4.895   2.457  -5.137
  110    HA2  GLY  16           1HA      GLY  16   3.426   4.422  -6.483
  111    HA3  GLY  16           2HA      GLY  16   4.226   4.642  -4.934
  112    H    LYS  17           H        LYS  17   6.814   3.881  -6.411
  113    HA   LYS  17           HA       LYS  17   7.552   6.598  -7.032
  114    HB2  LYS  17           1HB      LYS  17   8.934   4.625  -5.898
  115    HB3  LYS  17           2HB      LYS  17   9.398   4.321  -7.567
  116    HG2  LYS  17           1HG      LYS  17  11.034   5.784  -7.154
  117    HG3  LYS  17           2HG      LYS  17   9.781   7.005  -7.387
  118    HD2  LYS  17           1HD      LYS  17  10.641   7.655  -5.359
  119    HD3  LYS  17           2HD      LYS  17   9.339   6.584  -4.833
  120    HE2  LYS  17           1HE      LYS  17  11.262   6.013  -3.562
  121    HE3  LYS  17           2HE      LYS  17  11.036   4.733  -4.752
  122    HZ1  LYS  17           3HZ      LYS  17  12.973   5.201  -5.725
  123    HZ2  LYS  17           1HZ      LYS  17  13.346   6.055  -4.312
  124    HZ3  LYS  17           2HZ      LYS  17  12.732   6.874  -5.658
  125    H    GLY  18           H        GLY  18   7.392   3.519  -8.809
  126    HA2  GLY  18           1HA      GLY  18   6.736   3.270 -11.048
  127    HA3  GLY  18           2HA      GLY  18   6.896   5.006 -11.266
  128    H    ASP  19           H        ASP  19   9.007   5.899 -11.572
  129    HA   ASP  19           HA       ASP  19  11.082   5.970 -12.501
  130    HB2  ASP  19           1HB      ASP  19  11.480   4.390 -10.483
  131    HB3  ASP  19           2HB      ASP  19  11.527   3.109 -11.692
  132    HA   PRO  20           HA       PRO  20   9.414   3.675 -16.178
  133    HB2  PRO  20           1HB      PRO  20   9.390   5.843 -17.813
  134    HB3  PRO  20           2HB      PRO  20   8.044   5.431 -16.745
  135    HG2  PRO  20           1HG      PRO  20  10.231   7.436 -16.349
  136    HG3  PRO  20           2HG      PRO  20   8.496   7.591 -16.012
  137    HD2  PRO  20           1HD      PRO  20  10.317   7.075 -14.075
  138    HD3  PRO  20           2HD      PRO  20   8.655   6.452 -14.014
  139    H    ARG  21           H        ARG  21  12.135   5.732 -15.539
  140    HA   ARG  21           HA       ARG  21  13.539   5.489 -17.948
  141    HB2  ARG  21           1HB      ARG  21  14.400   5.944 -15.105
  142    HB3  ARG  21           2HB      ARG  21  15.585   5.794 -16.395
  143    HG2  ARG  21           1HG      ARG  21  15.018   7.789 -17.342
  144    HG3  ARG  21           2HG      ARG  21  13.352   7.716 -16.762
  145    HD2  ARG  21           1HD      ARG  21  14.387   7.983 -14.419
  146    HD3  ARG  21           2HD      ARG  21  15.835   8.508 -15.277
  147    HE   ARG  21           HE       ARG  21  13.721   9.989 -16.288
  148   HH11  ARG  21          1HH1      ARG  21  15.333   9.543 -13.234
  149   HH12  ARG  21          2HH1      ARG  21  14.996  11.148 -12.674
  150   HH21  ARG  21          1HH2      ARG  21  13.272  12.104 -15.562
  151   HH22  ARG  21          2HH2      ARG  21  13.823  12.603 -13.999
  152    H    GLU  22           H        GLU  22  12.991   3.226 -15.398
  153    HA   GLU  22           HA       GLU  22  15.108   1.449 -16.349
  154    HB2  GLU  22           1HB      GLU  22  13.222   1.215 -13.998
  155    HB3  GLU  22           2HB      GLU  22  14.463   0.039 -14.404
  156    HG2  GLU  22           1HG      GLU  22  14.815   2.860 -13.453
  157    HG3  GLU  22           2HG      GLU  22  15.363   1.367 -12.692
  158    H    GLY  23           H        GLY  23  12.640   2.076 -17.896
  159    HA2  GLY  23           1HA      GLY  23  11.278   0.914 -19.338
  160    HA3  GLY  23           2HA      GLY  23  12.113  -0.549 -18.838
  161    H    PHE  24           H        PHE  24  10.730   1.291 -16.311
  162    HA   PHE  24           HA       PHE  24   8.277  -0.313 -16.332
  163    HB2  PHE  24           1HB      PHE  24  10.080  -0.040 -13.918
  164    HB3  PHE  24           2HB      PHE  24   8.550  -0.909 -13.983
  165    HD1  PHE  24           HD1      PHE  24   8.540  -2.622 -16.137
  166    HD2  PHE  24           HD2      PHE  24  11.920  -1.389 -13.862
  167    HE1  PHE  24           HE1      PHE  24   9.731  -4.669 -16.802
  168    HE2  PHE  24           HE2      PHE  24  13.116  -3.434 -14.524
  169    HZ   PHE  24           HZ       PHE  24  12.022  -5.077 -15.997
  170    HA   PRO  25           HA       PRO  25   7.343   4.096 -15.431
  171    HB2  PRO  25           1HB      PRO  25   5.002   4.096 -16.806
  172    HB3  PRO  25           2HB      PRO  25   6.569   4.368 -17.577
  173    HG2  PRO  25           1HG      PRO  25   4.932   1.865 -17.445
  174    HG3  PRO  25           2HG      PRO  25   5.815   2.553 -18.820
  175    HD2  PRO  25           1HD      PRO  25   6.792   0.509 -17.337
  176    HD3  PRO  25           2HD      PRO  25   7.840   1.725 -18.096
  177    H    ALA  26           H        ALA  26   5.159   5.007 -14.622
  178    HA   ALA  26           HA       ALA  26   4.479   3.832 -12.222
  179    HB1  ALA  26           1HB      ALA  26   3.226   5.898 -13.943
  180    HB2  ALA  26           2HB      ALA  26   2.261   5.229 -12.627
  181    HB3  ALA  26           3HB      ALA  26   3.807   6.005 -12.281
  182    H    GLY  27           H        GLY  27   3.309   2.116 -11.657
  183    HA2  GLY  27           1HA      GLY  27   1.157   0.953 -11.840
  184    HA3  GLY  27           2HA      GLY  27   1.313   1.101 -13.584
  185    H    THR  28           H        THR  28   4.142   0.411 -13.603
  186    HA   THR  28           HA       THR  28   4.008  -2.304 -14.082
  187    HB   THR  28           HB       THR  28   6.524  -0.942 -13.124
  188    HG1  THR  28           HG1      THR  28   5.040  -0.592 -15.472
  189   HG21  THR  28          3HG2      THR  28   7.623  -2.714 -13.952
  190   HG22  THR  28          1HG2      THR  28   6.628  -2.762 -15.407
  191   HG23  THR  28          2HG2      THR  28   6.061  -3.531 -13.924
  192    H    ARG  29           H        ARG  29   3.379  -3.809 -12.672
  193    HA   ARG  29           HA       ARG  29   3.784  -3.585  -9.856
  194    HB2  ARG  29           1HB      ARG  29   2.784  -5.817 -11.620
  195    HB3  ARG  29           2HB      ARG  29   2.930  -5.984  -9.875
  196    HG2  ARG  29           1HG      ARG  29   1.502  -3.763  -9.898
  197    HG3  ARG  29           2HG      ARG  29   1.015  -4.383 -11.477
  198    HD2  ARG  29           1HD      ARG  29   0.159  -6.377 -10.533
  199    HD3  ARG  29           2HD      ARG  29   0.923  -6.052  -8.978
  200    HE   ARG  29           HE       ARG  29  -0.892  -3.985  -9.630
  201   HH11  ARG  29          1HH1      ARG  29  -0.787  -7.300  -8.571
  202   HH12  ARG  29          2HH1      ARG  29  -2.307  -7.220  -7.743
  203   HH21  ARG  29          1HH2      ARG  29  -2.894  -3.867  -8.543
  204   HH22  ARG  29          2HH2      ARG  29  -3.505  -5.267  -7.728
  205    H    TRP  30           H        TRP  30   5.314  -4.465  -8.573
  206    HA   TRP  30           HA       TRP  30   7.825  -5.104  -9.556
  207    HB2  TRP  30           1HB      TRP  30   8.196  -6.122  -7.245
  208    HB3  TRP  30           2HB      TRP  30   7.677  -4.439  -7.290
  209    HD1  TRP  30           HD1      TRP  30   5.338  -3.850  -6.233
  210    HE1  TRP  30           HE1      TRP  30   3.661  -5.186  -4.809
  211    HE3  TRP  30           HE3      TRP  30   7.237  -8.544  -6.933
  212    HZ2  TRP  30           HZ2      TRP  30   3.204  -7.874  -4.079
  213    HZ3  TRP  30           HZ3      TRP  30   6.122 -10.443  -5.837
  214    HH2  TRP  30           HH2      TRP  30   4.147 -10.113  -4.439
  215    H    ASP  31           H        ASP  31   5.075  -7.175  -8.915
  216    HA   ASP  31           HA       ASP  31   6.536  -9.628  -9.208
  217    HB2  ASP  31           1HB      ASP  31   4.290  -9.191  -7.956
  218    HB3  ASP  31           2HB      ASP  31   3.561  -9.413  -9.545
  219    H    GLN  32           H        GLN  32   4.931  -7.412 -11.328
  220    HA   GLN  32           HA       GLN  32   4.427  -9.126 -13.502
  221    HB2  GLN  32           1HB      GLN  32   3.518  -6.806 -13.210
  222    HB3  GLN  32           2HB      GLN  32   5.106  -6.186 -13.640
  223    HG2  GLN  32           1HG      GLN  32   4.924  -7.323 -15.820
  224    HG3  GLN  32           2HG      GLN  32   3.296  -7.841 -15.385
  225   HE21  GLN  32          2HE2      GLN  32   2.137  -5.723 -14.312
  226   HE22  GLN  32          1HE2      GLN  32   2.090  -4.392 -15.413
  227    H    ILE  33           H        ILE  33   7.335  -7.731 -12.290
  228    HA   ILE  33           HA       ILE  33   8.955  -7.569 -14.516
  229    HB   ILE  33           HB       ILE  33   9.775  -8.599 -11.797
  230   HG12  ILE  33          1HG1      ILE  33   8.641  -6.424 -11.669
  231   HG13  ILE  33          2HG1      ILE  33  10.357  -6.266 -11.309
  232   HG21  ILE  33          1HG2      ILE  33  11.433  -7.286 -13.946
  233   HG22  ILE  33          2HG2      ILE  33  12.004  -7.868 -12.382
  234   HG23  ILE  33          3HG2      ILE  33  11.419  -9.013 -13.589
  235   HD11  ILE  33          3HD1      ILE  33   9.533  -4.448 -12.714
  236   HD12  ILE  33          1HD1      ILE  33  10.766  -5.404 -13.534
  237   HD13  ILE  33          2HD1      ILE  33   9.065  -5.618 -13.947
  238    HA   PRO  34           HA       PRO  34   9.136 -11.719 -16.034
  239    HB2  PRO  34           1HB      PRO  34  11.229 -11.377 -17.729
  240    HB3  PRO  34           2HB      PRO  34   9.603 -10.778 -18.077
  241    HG2  PRO  34           1HG      PRO  34  11.976  -9.302 -17.002
  242    HG3  PRO  34           2HG      PRO  34  10.809  -8.795 -18.237
  243    HD2  PRO  34           1HD      PRO  34  10.679  -7.940 -15.671
  244    HD3  PRO  34           2HD      PRO  34   9.233  -8.176 -16.673
  245    H    ASP  35           H        ASP  35   9.949 -13.388 -14.948
  246    HA   ASP  35           HA       ASP  35  12.295 -13.185 -13.340
  247    HB2  ASP  35           1HB      ASP  35  10.581 -14.624 -12.541
  248    HB3  ASP  35           2HB      ASP  35  10.491 -15.488 -14.074
  249    H    ASP  36           H        ASP  36  11.750 -13.930 -16.610
  250    HA   ASP  36           HA       ASP  36  14.033 -15.642 -16.972
  251    HB2  ASP  36           1HB      ASP  36  11.975 -14.408 -18.736
  252    HB3  ASP  36           2HB      ASP  36  13.501 -14.887 -19.476
  253    H    TRP  37           H        TRP  37  13.446 -12.250 -16.901
  254    HA   TRP  37           HA       TRP  37  15.436 -11.230 -18.527
  255    HB2  TRP  37           1HB      TRP  37  13.691 -10.223 -16.563
  256    HB3  TRP  37           2HB      TRP  37  15.306  -9.723 -16.069
  257    HD1  TRP  37           HD1      TRP  37  16.015  -7.477 -17.045
  258    HE1  TRP  37           HE1      TRP  37  15.420  -6.093 -19.132
  259    HE3  TRP  37           HE3      TRP  37  12.776 -10.737 -19.285
  260    HZ2  TRP  37           HZ2      TRP  37  13.793  -6.349 -21.424
  261    HZ3  TRP  37           HZ3      TRP  37  11.743 -10.091 -21.423
  262    HH2  TRP  37           HH2      TRP  37  12.242  -7.942 -22.468
  263    H    CYS  38           H        CYS  38  17.585 -10.591 -18.181
  264    HA   CYS  38           HA       CYS  38  18.932 -11.994 -15.967
  265    HB2  CYS  38           1HB      CYS  38  19.801 -11.551 -18.819
  266    HB3  CYS  38           2HB      CYS  38  20.940 -11.994 -17.553
  267    HG   CYS  38           HG       CYS  38  19.734 -14.087 -19.398
  268    H    CYS  39           H        CYS  39  19.902 -10.723 -14.542
  269    HA   CYS  39           HA       CYS  39  20.556  -7.967 -15.336
  270    HB2  CYS  39           1HB      CYS  39  19.401  -9.155 -12.921
  271    HB3  CYS  39           2HB      CYS  39  20.715  -8.034 -12.584
  272    HG   CYS  39           HG       CYS  39  18.638  -6.745 -14.808
  273    HA   PRO  40           HA       PRO  40  24.855  -8.541 -14.700
  274    HB2  PRO  40           1HB      PRO  40  25.587  -6.241 -13.456
  275    HB3  PRO  40           2HB      PRO  40  25.131  -6.307 -15.162
  276    HG2  PRO  40           1HG      PRO  40  23.496  -5.481 -12.795
  277    HG3  PRO  40           2HG      PRO  40  23.607  -4.726 -14.396
  278    HD2  PRO  40           1HD      PRO  40  21.551  -6.339 -13.685
  279    HD3  PRO  40           2HD      PRO  40  22.158  -6.244 -15.350
  280    H    ASP  41           H        ASP  41  23.373  -7.117 -11.780
  281    HA   ASP  41           HA       ASP  41  25.292  -8.433 -10.066
  282    HB2  ASP  41           1HB      ASP  41  23.382  -6.274  -9.824
  283    HB3  ASP  41           2HB      ASP  41  23.222  -7.402  -8.480
  284    H    CYS  42           H        CYS  42  21.772  -8.596 -10.567
  285    HA   CYS  42           HA       CYS  42  21.216 -10.637  -8.761
  286    HB2  CYS  42           1HB      CYS  42  19.590  -9.173 -10.106
  287    HB3  CYS  42           2HB      CYS  42  19.790 -10.350 -11.399
  288    HG   CYS  42           HG       CYS  42  18.656 -11.142  -8.269
  289    H    SER  43           H        SER  43  22.784 -10.754 -11.825
  290    HA   SER  43           HA       SER  43  22.292 -13.310 -12.721
  291    HB2  SER  43           1HB      SER  43  23.631 -12.176 -14.199
  292    HB3  SER  43           2HB      SER  43  24.605 -11.446 -12.923
  293    HG   SER  43           HG       SER  43  25.097 -13.656 -14.364
  294    H    VAL  44           H        VAL  44  24.461 -12.263 -10.151
  295    HA   VAL  44           HA       VAL  44  25.159 -15.064  -9.604
  296    HB   VAL  44           HB       VAL  44  26.895 -14.090  -8.079
  297   HG11  VAL  44          1HG1      VAL  44  28.435 -13.908  -9.770
  298   HG12  VAL  44          2HG1      VAL  44  27.105 -14.687 -10.629
  299   HG13  VAL  44          3HG1      VAL  44  27.363 -12.950 -10.791
  300   HG21  VAL  44          3HG2      VAL  44  26.232 -11.486  -9.443
  301   HG22  VAL  44          1HG2      VAL  44  25.722 -11.897  -7.806
  302   HG23  VAL  44          2HG2      VAL  44  27.438 -11.765  -8.188
  303    H    ARG  45           H        ARG  45  22.572 -13.891  -8.931
  304    HA   ARG  45           HA       ARG  45  22.532 -14.641  -6.132
  305    HB2  ARG  45           1HB      ARG  45  22.821 -12.002  -6.592
  306    HB3  ARG  45           2HB      ARG  45  21.069 -12.124  -6.681
  307    HG2  ARG  45           1HG      ARG  45  21.717 -11.544  -4.445
  308    HG3  ARG  45           2HG      ARG  45  21.064 -13.183  -4.451
  309    HD2  ARG  45           1HD      ARG  45  23.126 -12.898  -3.073
  310    HD3  ARG  45           2HD      ARG  45  23.251 -14.131  -4.328
  311    HE   ARG  45           HE       ARG  45  24.206 -11.635  -5.272
  312   HH11  ARG  45          1HH1      ARG  45  25.054 -14.306  -3.207
  313   HH12  ARG  45          2HH1      ARG  45  26.762 -14.086  -3.404
  314   HH21  ARG  45          1HH2      ARG  45  26.451 -11.335  -5.540
  315   HH22  ARG  45          2HH2      ARG  45  27.555 -12.395  -4.731
  316    H    GLU  46           H        GLU  46  20.247 -14.737  -5.301
  317    HA   GLU  46           HA       GLU  46  18.530 -15.775  -7.434
  318    HB2  GLU  46           1HB      GLU  46  18.335 -16.112  -4.436
  319    HB3  GLU  46           2HB      GLU  46  17.284 -16.878  -5.618
  320    HG2  GLU  46           1HG      GLU  46  20.257 -17.301  -5.461
  321    HG3  GLU  46           2HG      GLU  46  19.053 -18.362  -4.732
  322    H    LYS  47           H        LYS  47  16.410 -15.117  -7.715
  323    HA   LYS  47           HA       LYS  47  15.820 -12.423  -7.322
  324    HB2  LYS  47           1HB      LYS  47  14.742 -14.340  -8.843
  325    HB3  LYS  47           2HB      LYS  47  13.553 -14.336  -7.546
  326    HG2  LYS  47           1HG      LYS  47  12.725 -12.319  -8.125
  327    HG3  LYS  47           2HG      LYS  47  14.297 -11.698  -8.635
  328    HD2  LYS  47           1HD      LYS  47  14.073 -13.315 -10.615
  329    HD3  LYS  47           2HD      LYS  47  12.371 -13.426 -10.161
  330    HE2  LYS  47           1HE      LYS  47  12.574 -11.748 -11.849
  331    HE3  LYS  47           2HE      LYS  47  12.245 -10.939 -10.318
  332    HZ1  LYS  47           3HZ      LYS  47  14.251  -9.956 -10.308
  333    HZ2  LYS  47           1HZ      LYS  47  14.200 -10.226 -11.977
  334    HZ3  LYS  47           2HZ      LYS  47  15.049 -11.291 -10.973
  335    H    VAL  48           H        VAL  48  15.404 -15.132  -5.219
  336    HA   VAL  48           HA       VAL  48  13.376 -14.092  -3.545
  337    HB   VAL  48           HB       VAL  48  14.086 -16.481  -3.580
  338   HG11  VAL  48          1HG1      VAL  48  16.061 -17.229  -2.562
  339   HG12  VAL  48          2HG1      VAL  48  16.563 -15.853  -3.547
  340   HG13  VAL  48          3HG1      VAL  48  16.366 -15.666  -1.804
  341   HG21  VAL  48          3HG2      VAL  48  13.001 -16.607  -1.646
  342   HG22  VAL  48          1HG2      VAL  48  14.442 -16.078  -0.777
  343   HG23  VAL  48          2HG2      VAL  48  13.293 -14.887  -1.387
  344    H    ASP  49           H        ASP  49  16.602 -13.177  -3.989
  345    HA   ASP  49           HA       ASP  49  17.339 -12.375  -1.397
  346    HB2  ASP  49           1HB      ASP  49  18.774 -12.539  -3.544
  347    HB3  ASP  49           2HB      ASP  49  18.204 -10.906  -3.875
  348    H    PHE  50           H        PHE  50  15.204 -10.978  -3.732
  349    HA   PHE  50           HA       PHE  50  15.222  -8.308  -2.831
  350    HB2  PHE  50           1HB      PHE  50  13.385  -9.991  -4.462
  351    HB3  PHE  50           2HB      PHE  50  12.745  -8.487  -3.806
  352    HD1  PHE  50           HD2      PHE  50  14.099  -6.349  -4.270
  353    HD2  PHE  50           HD1      PHE  50  14.594  -9.980  -6.434
  354    HE1  PHE  50           HE2      PHE  50  15.134  -5.101  -6.121
  355    HE2  PHE  50           HE1      PHE  50  15.631  -8.738  -8.288
  356    HZ   PHE  50           HZ       PHE  50  15.900  -6.295  -8.134
  357    H    GLU  51           H        GLU  51  14.680  -7.583  -0.892
  358    HA   GLU  51           HA       GLU  51  12.598  -9.020   0.619
  359    HB2  GLU  51           1HB      GLU  51  14.704  -7.218   1.806
  360    HB3  GLU  51           2HB      GLU  51  13.658  -8.355   2.644
  361    HG2  GLU  51           1HG      GLU  51  14.824 -10.180   1.332
  362    HG3  GLU  51           2HG      GLU  51  16.001  -8.952   0.869
  363    H    ARG  52           H        ARG  52  11.292  -7.667   2.090
  364    HA   ARG  52           HA       ARG  52  10.578  -5.159   0.755
  365    HB2  ARG  52           1HB      ARG  52   8.819  -6.883   1.075
  366    HB3  ARG  52           2HB      ARG  52   9.029  -6.739   2.815
  367    HG2  ARG  52           1HG      ARG  52   8.368  -4.363   2.659
  368    HG3  ARG  52           2HG      ARG  52   8.061  -4.595   0.937
  369    HD2  ARG  52           1HD      ARG  52   5.956  -4.903   1.802
  370    HD3  ARG  52           2HD      ARG  52   6.554  -6.561   1.778
  371    HE   ARG  52           HE       ARG  52   7.085  -5.238   4.256
  372   HH11  ARG  52          1HH1      ARG  52   4.661  -6.940   2.426
  373   HH12  ARG  52          2HH1      ARG  52   3.793  -7.475   3.827
  374   HH21  ARG  52          1HH2      ARG  52   5.951  -5.937   6.108
  375   HH22  ARG  52          2HH2      ARG  52   4.527  -6.903   5.920
  376    H    MET  53           H        MET  53  10.440  -3.213   1.832
  377    HA   MET  53           HA       MET  53  12.100  -2.969   4.178
  378    HB2  MET  53           1HB      MET  53  10.822  -1.093   2.251
  379    HB3  MET  53           2HB      MET  53  11.230  -0.472   3.844
  380    HG2  MET  53           1HG      MET  53  13.211  -1.892   2.091
  381    HG3  MET  53           2HG      MET  53  12.955  -0.149   2.040
  382    HE1  MET  53           3HE      MET  53  15.306  -2.036   2.444
  383    HE2  MET  53           1HE      MET  53  16.344  -1.194   3.595
  384    HE3  MET  53           2HE      MET  53  15.524  -2.681   4.072
  385    H    GLY  54           H        GLY  54  11.483  -2.361   6.224
  386    HA2  GLY  54           1HA      GLY  54   9.804  -1.401   7.712
  387    HA3  GLY  54           2HA      GLY  54   8.577  -2.162   6.710
  388    H    GLY  55           H        GLY  55   9.740  -2.334   9.652
  389    HA2  GLY  55           1HA      GLY  55   9.455  -5.270   9.768
  390    HA3  GLY  55           2HA      GLY  55  10.707  -4.445  10.685
  391    H    LYS  56           H        LYS  56   7.220  -3.918  10.149
  392    HA   LYS  56           HA       LYS  56   5.520  -3.480  11.597
  393    HB2  LYS  56           1HB      LYS  56   7.197  -5.408  13.186
  394    HB3  LYS  56           2HB      LYS  56   5.703  -4.746  13.836
  395    HG2  LYS  56           1HG      LYS  56   4.391  -5.809  12.224
  396    HG3  LYS  56           2HG      LYS  56   5.774  -6.116  11.171
  397    HD2  LYS  56           1HD      LYS  56   5.418  -8.199  12.105
  398    HD3  LYS  56           2HD      LYS  56   6.643  -7.526  13.183
  399    HE2  LYS  56           1HE      LYS  56   3.685  -7.351  13.718
  400    HE3  LYS  56           2HE      LYS  56   4.699  -8.666  14.311
  401    HZ1  LYS  56           3HZ      LYS  56   4.989  -7.338  16.067
  402    HZ2  LYS  56           1HZ      LYS  56   4.476  -5.949  15.249
  403    HZ3  LYS  56           2HZ      LYS  56   6.072  -6.485  15.086
  Start of MODEL    9
    1    H1   MET   1           H        MET   1   2.530  -0.086   2.067
    2    HA   MET   1           HA       MET   1   1.608  -1.370  -0.420
    3    HB2  MET   1           1HB      MET   1   3.274   0.214  -1.545
    4    HB3  MET   1           2HB      MET   1   1.770   0.911  -0.959
    5    HG2  MET   1           1HG      MET   1   2.799   2.034   0.761
    6    HG3  MET   1           2HG      MET   1   4.172   0.930   0.801
    7    HE1  MET   1           3HE      MET   1   4.482   4.975  -0.665
    8    HE2  MET   1           1HE      MET   1   2.907   4.312  -0.225
    9    HE3  MET   1           2HE      MET   1   4.261   4.187   0.898
   10    H    THR   2           H        THR   2   3.340  -2.282  -1.763
   11    HA   THR   2           HA       THR   2   5.298  -3.639  -0.084
   12    HB   THR   2           HB       THR   2   4.506  -4.103  -2.965
   13    HG1  THR   2           HG1      THR   2   2.915  -4.777  -1.510
   14   HG21  THR   2          3HG2      THR   2   6.721  -4.854  -2.856
   15   HG22  THR   2          1HG2      THR   2   5.769  -6.302  -2.532
   16   HG23  THR   2          2HG2      THR   2   6.539  -5.437  -1.202
   17    H    ALA   3           H        ALA   3   7.503  -3.566  -0.391
   18    HA   ALA   3           HA       ALA   3   8.616  -1.947  -2.529
   19    HB1  ALA   3           1HB      ALA   3   8.038  -0.674  -0.180
   20    HB2  ALA   3           2HB      ALA   3   9.726  -1.132   0.048
   21    HB3  ALA   3           3HB      ALA   3   9.258  -0.160  -1.346
   22    H    TYR   4           H        TYR   4  10.196  -3.160  -3.318
   23    HA   TYR   4           HA       TYR   4  11.772  -4.814  -1.460
   24    HB2  TYR   4           1HB      TYR   4  10.938  -5.220  -4.314
   25    HB3  TYR   4           2HB      TYR   4  12.366  -6.035  -3.685
   26    HD1  TYR   4           HD1      TYR   4  12.164  -7.778  -1.996
   27    HD2  TYR   4           HD2      TYR   4   8.717  -5.832  -3.558
   28    HE1  TYR   4           HE1      TYR   4  10.743  -9.551  -1.054
   29    HE2  TYR   4           HE2      TYR   4   7.287  -7.599  -2.619
   30    HH   TYR   4           HH       TYR   4   8.513  -9.988  -0.432
   31    H    ARG   5           H        ARG   5  13.803  -4.227  -1.128
   32    HA   ARG   5           HA       ARG   5  15.223  -2.764  -3.250
   33    HB2  ARG   5           1HB      ARG   5  14.637  -1.094  -1.645
   34    HB3  ARG   5           2HB      ARG   5  15.126  -2.122  -0.304
   35    HG2  ARG   5           1HG      ARG   5  17.210  -1.375  -0.397
   36    HG3  ARG   5           2HG      ARG   5  17.316  -1.702  -2.128
   37    HD2  ARG   5           1HD      ARG   5  17.525   0.545  -2.242
   38    HD3  ARG   5           2HD      ARG   5  15.764   0.483  -2.180
   39    HE   ARG   5           HE       ARG   5  16.888   0.596   0.428
   40   HH11  ARG   5          1HH1      ARG   5  16.151   2.539  -2.366
   41   HH12  ARG   5          2HH1      ARG   5  15.996   4.010  -1.464
   42   HH21  ARG   5          1HH2      ARG   5  16.687   2.526   1.626
   43   HH22  ARG   5          2HH2      ARG   5  16.303   4.002   0.807
   44    H    CYS   6           H        CYS   6  16.809  -4.044  -3.922
   45    HA   CYS   6           HA       CYS   6  18.696  -5.115  -2.003
   46    HB2  CYS   6           1HB      CYS   6  16.670  -6.774  -3.209
   47    HB3  CYS   6           2HB      CYS   6  18.266  -7.287  -3.745
   48    HG   CYS   6           HG       CYS   6  19.228  -7.519  -1.065
   49    HA   PRO   7           HA       PRO   7  20.714  -3.514  -5.791
   50    HB2  PRO   7           1HB      PRO   7  22.880  -2.543  -4.472
   51    HB3  PRO   7           2HB      PRO   7  21.366  -1.644  -4.626
   52    HG2  PRO   7           1HG      PRO   7  22.379  -3.269  -2.325
   53    HG3  PRO   7           2HG      PRO   7  21.579  -1.687  -2.311
   54    HD2  PRO   7           1HD      PRO   7  20.267  -3.986  -1.744
   55    HD3  PRO   7           2HD      PRO   7  19.477  -2.606  -2.533
   56    H    VAL   8           H        VAL   8  21.595  -5.767  -3.340
   57    HA   VAL   8           HA       VAL   8  24.141  -6.552  -4.202
   58    HB   VAL   8           HB       VAL   8  23.584  -8.763  -3.126
   59   HG11  VAL   8          1HG1      VAL   8  24.371  -6.503  -2.007
   60   HG12  VAL   8          2HG1      VAL   8  22.802  -6.629  -1.209
   61   HG13  VAL   8          3HG1      VAL   8  23.986  -7.926  -1.039
   62   HG21  VAL   8          3HG2      VAL   8  21.474  -9.337  -2.734
   63   HG22  VAL   8          1HG2      VAL   8  21.231  -7.887  -1.760
   64   HG23  VAL   8          2HG2      VAL   8  20.947  -7.838  -3.500
   65    H    CYS   9           H        CYS   9  21.060  -7.017  -5.622
   66    HA   CYS   9           HA       CYS   9  22.196  -8.999  -7.484
   67    HB2  CYS   9           1HB      CYS   9  19.242  -8.675  -7.216
   68    HB3  CYS   9           2HB      CYS   9  20.180 -10.108  -7.615
   69    HG   CYS   9           HG       CYS   9  18.764  -9.483  -4.838
   70    H    ASP  10           H        ASP  10  19.680  -6.475  -7.324
   71    HA   ASP  10           HA       ASP  10  20.703  -5.248  -9.731
   72    HB2  ASP  10           1HB      ASP  10  18.697  -5.464 -11.047
   73    HB3  ASP  10           2HB      ASP  10  19.217  -7.077 -10.565
   74    H    TYR  11           H        TYR  11  19.552  -3.228 -10.255
   75    HA   TYR  11           HA       TYR  11  19.319  -1.511  -8.146
   76    HB2  TYR  11           1HB      TYR  11  18.082  -1.447 -10.886
   77    HB3  TYR  11           2HB      TYR  11  17.806  -0.143  -9.737
   78    HD1  TYR  11           HD1      TYR  11  20.104   0.692  -8.575
   79    HD2  TYR  11           HD2      TYR  11  19.775  -1.122 -12.409
   80    HE1  TYR  11           HE1      TYR  11  22.227   1.738  -9.245
   81    HE2  TYR  11           HE2      TYR  11  21.897  -0.083 -13.090
   82    HH   TYR  11           HH       TYR  11  23.790   1.885 -10.824
   83    H    THR  12           H        THR  12  17.491  -0.436  -7.166
   84    HA   THR  12           HA       THR  12  15.230  -2.277  -6.771
   85    HB   THR  12           HB       THR  12  16.335  -1.921  -4.695
   86    HG1  THR  12           HG1      THR  12  13.907  -1.505  -4.909
   87   HG21  THR  12          3HG2      THR  12  17.612  -0.109  -4.442
   88   HG22  THR  12          1HG2      THR  12  16.140   0.809  -4.126
   89   HG23  THR  12          2HG2      THR  12  16.792   0.723  -5.763
   90    H    TYR  13           H        TYR  13  13.153  -1.601  -7.039
   91    HA   TYR  13           HA       TYR  13  12.589   1.215  -7.509
   92    HB2  TYR  13           1HB      TYR  13  11.984  -0.908  -9.579
   93    HB3  TYR  13           2HB      TYR  13  11.458   0.770  -9.652
   94    HD1  TYR  13           HD2      TYR  13  13.224   2.580  -9.819
   95    HD2  TYR  13           HD1      TYR  13  14.105  -1.546 -10.374
   96    HE1  TYR  13           HE2      TYR  13  15.308   3.186 -10.976
   97    HE2  TYR  13           HE1      TYR  13  16.192  -0.951 -11.531
   98    HH   TYR  13           HH       TYR  13  16.835   1.905 -12.811
   99    H    ASP  14           H        ASP  14  11.069   1.485  -5.999
  100    HA   ASP  14           HA       ASP  14   9.235  -0.540  -5.209
  101    HB2  ASP  14           1HB      ASP  14   9.801   1.085  -3.572
  102    HB3  ASP  14           2HB      ASP  14   9.402   2.419  -4.651
  103    H    GLU  15           H        GLU  15   7.208  -0.973  -5.871
  104    HA   GLU  15           HA       GLU  15   6.302  -0.186  -8.377
  105    HB2  GLU  15           1HB      GLU  15   4.113  -1.145  -7.682
  106    HB3  GLU  15           2HB      GLU  15   5.478  -2.203  -7.353
  107    HG2  GLU  15           1HG      GLU  15   4.278  -2.394  -5.415
  108    HG3  GLU  15           2HG      GLU  15   5.408  -1.108  -4.995
  109    H    GLY  16           H        GLY  16   5.753   1.238  -5.223
  110    HA2  GLY  16           1HA      GLY  16   3.758   3.086  -6.262
  111    HA3  GLY  16           2HA      GLY  16   4.320   2.982  -4.600
  112    H    LYS  17           H        LYS  17   6.853   3.025  -6.844
  113    HA   LYS  17           HA       LYS  17   7.553   5.731  -6.035
  114    HB2  LYS  17           1HB      LYS  17   9.066   3.510  -6.286
  115    HB3  LYS  17           2HB      LYS  17   9.319   4.223  -7.874
  116    HG2  LYS  17           1HG      LYS  17  11.062   5.082  -6.619
  117    HG3  LYS  17           2HG      LYS  17   9.867   6.380  -6.583
  118    HD2  LYS  17           1HD      LYS  17  10.303   6.311  -4.361
  119    HD3  LYS  17           2HD      LYS  17   9.107   5.013  -4.402
  120    HE2  LYS  17           1HE      LYS  17  11.105   3.458  -4.820
  121    HE3  LYS  17           2HE      LYS  17  12.100   4.812  -4.287
  122    HZ1  LYS  17           3HZ      LYS  17  11.678   4.257  -2.202
  123    HZ2  LYS  17           1HZ      LYS  17  10.729   2.953  -2.714
  124    HZ3  LYS  17           2HZ      LYS  17  10.017   4.464  -2.448
  125    H    GLY  18           H        GLY  18   7.145   3.889  -9.055
  126    HA2  GLY  18           1HA      GLY  18   6.231   4.654 -11.057
  127    HA3  GLY  18           2HA      GLY  18   6.167   6.275 -10.379
  128    H    ASP  19           H        ASP  19   8.346   3.859 -11.762
  129    HA   ASP  19           HA       ASP  19  10.154   6.050 -12.543
  130    HB2  ASP  19           1HB      ASP  19  11.843   4.135 -12.824
  131    HB3  ASP  19           2HB      ASP  19  11.413   4.602 -11.181
  132    HA   PRO  20           HA       PRO  20   8.175   4.470 -16.428
  133    HB2  PRO  20           1HB      PRO  20   7.791   6.932 -17.505
  134    HB3  PRO  20           2HB      PRO  20   6.632   6.171 -16.408
  135    HG2  PRO  20           1HG      PRO  20   8.720   8.235 -15.824
  136    HG3  PRO  20           2HG      PRO  20   7.042   8.150 -15.257
  137    HD2  PRO  20           1HD      PRO  20   9.139   7.392 -13.721
  138    HD3  PRO  20           2HD      PRO  20   7.544   6.620 -13.608
  139    H    ARG  21           H        ARG  21  10.952   6.201 -15.545
  140    HA   ARG  21           HA       ARG  21  11.985   6.651 -18.188
  141    HB2  ARG  21           1HB      ARG  21  13.157   6.845 -15.423
  142    HB3  ARG  21           2HB      ARG  21  14.154   7.039 -16.859
  143    HG2  ARG  21           1HG      ARG  21  13.237   9.051 -17.398
  144    HG3  ARG  21           2HG      ARG  21  11.680   8.663 -16.663
  145    HD2  ARG  21           1HD      ARG  21  12.449  10.159 -15.127
  146    HD3  ARG  21           2HD      ARG  21  13.134   8.682 -14.453
  147    HE   ARG  21           HE       ARG  21  15.207   9.531 -14.864
  148   HH11  ARG  21          1HH1      ARG  21  12.916  11.168 -16.911
  149   HH12  ARG  21          2HH1      ARG  21  14.081  12.283 -17.543
  150   HH21  ARG  21          1HH2      ARG  21  16.750  10.994 -15.689
  151   HH22  ARG  21          2HH2      ARG  21  16.261  12.183 -16.849
  152    H    GLU  22           H        GLU  22  11.970   4.047 -15.927
  153    HA   GLU  22           HA       GLU  22  14.101   2.651 -17.378
  154    HB2  GLU  22           1HB      GLU  22  12.843   2.306 -14.684
  155    HB3  GLU  22           2HB      GLU  22  13.627   0.931 -15.449
  156    HG2  GLU  22           1HG      GLU  22  14.895   3.573 -14.767
  157    HG3  GLU  22           2HG      GLU  22  15.164   2.028 -13.960
  158    H    GLY  23           H        GLY  23  11.252   3.120 -18.286
  159    HA2  GLY  23           1HA      GLY  23   9.854   1.915 -19.677
  160    HA3  GLY  23           2HA      GLY  23  10.852   0.498 -19.384
  161    H    PHE  24           H        PHE  24   9.622   2.202 -16.651
  162    HA   PHE  24           HA       PHE  24   7.346   0.387 -16.395
  163    HB2  PHE  24           1HB      PHE  24   9.389   0.699 -14.190
  164    HB3  PHE  24           2HB      PHE  24   7.978  -0.353 -14.188
  165    HD1  PHE  24           HD1      PHE  24   7.910  -2.075 -16.194
  166    HD2  PHE  24           HD2      PHE  24  11.430  -0.222 -14.682
  167    HE1  PHE  24           HE1      PHE  24   9.269  -3.901 -17.130
  168    HE2  PHE  24           HE2      PHE  24  12.795  -2.043 -15.616
  169    HZ   PHE  24           HZ       PHE  24  11.715  -3.886 -16.842
  170    HA   PRO  25           HA       PRO  25   6.261   4.673 -15.139
  171    HB2  PRO  25           1HB      PRO  25   3.757   4.567 -16.182
  172    HB3  PRO  25           2HB      PRO  25   5.180   4.985 -17.142
  173    HG2  PRO  25           1HG      PRO  25   3.745   2.367 -16.925
  174    HG3  PRO  25           2HG      PRO  25   4.381   3.178 -18.368
  175    HD2  PRO  25           1HD      PRO  25   5.686   1.145 -17.144
  176    HD3  PRO  25           2HD      PRO  25   6.537   2.466 -17.971
  177    H    ALA  26           H        ALA  26   4.094   5.370 -14.040
  178    HA   ALA  26           HA       ALA  26   3.852   4.088 -11.610
  179    HB1  ALA  26           1HB      ALA  26   2.870   6.382 -12.644
  180    HB2  ALA  26           2HB      ALA  26   1.399   5.413 -12.548
  181    HB3  ALA  26           3HB      ALA  26   2.364   5.697 -11.099
  182    H    GLY  27           H        GLY  27   2.410   2.624 -10.708
  183    HA2  GLY  27           1HA      GLY  27   0.573   1.139 -10.726
  184    HA3  GLY  27           2HA      GLY  27   0.463   1.333 -12.469
  185    H    THR  28           H        THR  28   3.407   0.896 -12.727
  186    HA   THR  28           HA       THR  28   3.329  -1.887 -13.210
  187    HB   THR  28           HB       THR  28   5.718  -0.038 -13.065
  188    HG1  THR  28           HG1      THR  28   4.035   0.377 -14.694
  189   HG21  THR  28          3HG2      THR  28   6.671  -1.854 -14.627
  190   HG22  THR  28          1HG2      THR  28   5.411  -2.889 -13.956
  191   HG23  THR  28          2HG2      THR  28   6.630  -2.185 -12.895
  192    H    ARG  29           H        ARG  29   3.213  -3.341 -11.622
  193    HA   ARG  29           HA       ARG  29   4.528  -2.870  -9.076
  194    HB2  ARG  29           1HB      ARG  29   2.657  -4.992 -10.103
  195    HB3  ARG  29           2HB      ARG  29   3.484  -5.166  -8.561
  196    HG2  ARG  29           1HG      ARG  29   2.483  -2.814  -8.070
  197    HG3  ARG  29           2HG      ARG  29   1.358  -3.236  -9.362
  198    HD2  ARG  29           1HD      ARG  29   0.744  -5.275  -8.164
  199    HD3  ARG  29           2HD      ARG  29   1.881  -4.869  -6.880
  200    HE   ARG  29           HE       ARG  29   0.264  -2.704  -6.981
  201   HH11  ARG  29          1HH1      ARG  29  -0.330  -6.124  -6.722
  202   HH12  ARG  29          2HH1      ARG  29  -1.791  -5.934  -5.811
  203   HH21  ARG  29          1HH2      ARG  29  -1.658  -2.440  -5.782
  204   HH22  ARG  29          2HH2      ARG  29  -2.546  -3.838  -5.277
  205    H    TRP  30           H        TRP  30   6.118  -4.198  -8.177
  206    HA   TRP  30           HA       TRP  30   8.190  -5.006  -9.808
  207    HB2  TRP  30           1HB      TRP  30   9.030  -6.273  -7.827
  208    HB3  TRP  30           2HB      TRP  30   8.545  -4.621  -7.452
  209    HD1  TRP  30           HD1      TRP  30   6.219  -4.322  -6.067
  210    HE1  TRP  30           HE1      TRP  30   5.041  -5.911  -4.421
  211    HE3  TRP  30           HE3      TRP  30   8.583  -8.681  -7.314
  212    HZ2  TRP  30           HZ2      TRP  30   5.105  -8.650  -3.740
  213    HZ3  TRP  30           HZ3      TRP  30   7.966 -10.740  -6.117
  214    HH2  TRP  30           HH2      TRP  30   6.263 -10.723  -4.367
  215    H    ASP  31           H        ASP  31   5.355  -6.778  -8.820
  216    HA   ASP  31           HA       ASP  31   6.205  -9.384  -9.410
  217    HB2  ASP  31           1HB      ASP  31   4.132  -8.874  -8.176
  218    HB3  ASP  31           2HB      ASP  31   3.421  -8.221  -9.650
  219    H    GLN  32           H        GLN  32   4.907  -6.832 -11.454
  220    HA   GLN  32           HA       GLN  32   4.458  -8.378 -13.762
  221    HB2  GLN  32           1HB      GLN  32   3.622  -6.041 -13.336
  222    HB3  GLN  32           2HB      GLN  32   5.245  -5.464 -13.689
  223    HG2  GLN  32           1HG      GLN  32   3.667  -5.291 -15.592
  224    HG3  GLN  32           2HG      GLN  32   5.113  -6.239 -15.938
  225   HE21  GLN  32          2HE2      GLN  32   1.932  -6.858 -14.481
  226   HE22  GLN  32          1HE2      GLN  32   1.579  -8.255 -15.434
  227    H    ILE  33           H        ILE  33   7.342  -7.034 -12.375
  228    HA   ILE  33           HA       ILE  33   9.047  -6.872 -14.536
  229    HB   ILE  33           HB       ILE  33   9.757  -7.910 -11.790
  230   HG12  ILE  33          1HG1      ILE  33   8.632  -5.734 -11.689
  231   HG13  ILE  33          2HG1      ILE  33  10.338  -5.575 -11.285
  232   HG21  ILE  33          1HG2      ILE  33  12.010  -7.187 -12.286
  233   HG22  ILE  33          2HG2      ILE  33  11.467  -8.328 -13.516
  234   HG23  ILE  33          3HG2      ILE  33  11.503  -6.601 -13.870
  235   HD11  ILE  33          3HD1      ILE  33  10.814  -4.687 -13.469
  236   HD12  ILE  33          1HD1      ILE  33   9.147  -4.954 -13.976
  237   HD13  ILE  33          2HD1      ILE  33   9.509  -3.765 -12.725
  238    HA   PRO  34           HA       PRO  34   9.275 -11.019 -16.056
  239    HB2  PRO  34           1HB      PRO  34  11.434 -10.680 -17.667
  240    HB3  PRO  34           2HB      PRO  34   9.825 -10.074 -18.077
  241    HG2  PRO  34           1HG      PRO  34  12.159  -8.610 -16.905
  242    HG3  PRO  34           2HG      PRO  34  11.043  -8.096 -18.184
  243    HD2  PRO  34           1HD      PRO  34  10.815  -7.246 -15.623
  244    HD3  PRO  34           2HD      PRO  34   9.408  -7.475 -16.682
  245    H    ASP  35           H        ASP  35   9.956 -12.571 -14.712
  246    HA   ASP  35           HA       ASP  35  12.296 -12.401 -13.125
  247    HB2  ASP  35           1HB      ASP  35  10.935 -14.996 -13.800
  248    HB3  ASP  35           2HB      ASP  35  11.723 -14.522 -12.298
  249    H    ASP  36           H        ASP  36  11.838 -13.174 -16.380
  250    HA   ASP  36           HA       ASP  36  14.029 -15.018 -16.647
  251    HB2  ASP  36           1HB      ASP  36  12.713 -13.439 -18.858
  252    HB3  ASP  36           2HB      ASP  36  13.585 -14.964 -18.992
  253    H    TRP  37           H        TRP  37  13.666 -11.612 -16.534
  254    HA   TRP  37           HA       TRP  37  15.722 -10.670 -18.114
  255    HB2  TRP  37           1HB      TRP  37  13.999  -9.542 -16.323
  256    HB3  TRP  37           2HB      TRP  37  15.533  -9.375 -15.474
  257    HD1  TRP  37           HD1      TRP  37  17.080  -7.438 -16.214
  258    HE1  TRP  37           HE1      TRP  37  17.002  -5.669 -18.082
  259    HE3  TRP  37           HE3      TRP  37  13.134  -9.267 -18.900
  260    HZ2  TRP  37           HZ2      TRP  37  15.470  -5.121 -20.388
  261    HZ3  TRP  37           HZ3      TRP  37  12.425  -8.061 -20.925
  262    HH2  TRP  37           HH2      TRP  37  13.570  -6.031 -21.651
  263    H    CYS  38           H        CYS  38  17.892 -10.662 -18.027
  264    HA   CYS  38           HA       CYS  38  19.149 -12.079 -15.785
  265    HB2  CYS  38           1HB      CYS  38  19.948 -11.639 -18.651
  266    HB3  CYS  38           2HB      CYS  38  21.136 -12.122 -17.446
  267    HG   CYS  38           HG       CYS  38  18.480 -14.078 -17.282
  268    H    CYS  39           H        CYS  39  20.494 -11.076 -14.425
  269    HA   CYS  39           HA       CYS  39  21.365  -8.346 -15.113
  270    HB2  CYS  39           1HB      CYS  39  19.983  -9.387 -12.755
  271    HB3  CYS  39           2HB      CYS  39  21.427  -8.465 -12.354
  272    HG   CYS  39           HG       CYS  39  18.601  -7.217 -12.676
  273    HA   PRO  40           HA       PRO  40  25.535  -9.474 -14.360
  274    HB2  PRO  40           1HB      PRO  40  26.520  -7.287 -13.089
  275    HB3  PRO  40           2HB      PRO  40  26.109  -7.296 -14.808
  276    HG2  PRO  40           1HG      PRO  40  24.526  -6.263 -12.487
  277    HG3  PRO  40           2HG      PRO  40  24.780  -5.531 -14.082
  278    HD2  PRO  40           1HD      PRO  40  22.514  -6.864 -13.435
  279    HD3  PRO  40           2HD      PRO  40  23.177  -6.850 -15.082
  280    H    ASP  41           H        ASP  41  24.169  -7.866 -11.480
  281    HA   ASP  41           HA       ASP  41  25.861  -9.379  -9.705
  282    HB2  ASP  41           1HB      ASP  41  24.052  -7.096  -9.502
  283    HB3  ASP  41           2HB      ASP  41  23.909  -8.198  -8.135
  284    H    CYS  42           H        CYS  42  22.350  -9.193 -10.282
  285    HA   CYS  42           HA       CYS  42  21.565 -11.207  -8.537
  286    HB2  CYS  42           1HB      CYS  42  20.021  -9.647  -9.702
  287    HB3  CYS  42           2HB      CYS  42  20.299 -10.529 -11.199
  288    HG   CYS  42           HG       CYS  42  18.856 -12.680 -10.640
  289    H    SER  43           H        SER  43  23.178 -11.419 -11.573
  290    HA   SER  43           HA       SER  43  22.465 -13.896 -12.535
  291    HB2  SER  43           1HB      SER  43  23.958 -12.972 -13.980
  292    HB3  SER  43           2HB      SER  43  24.886 -12.206 -12.691
  293    HG   SER  43           HG       SER  43  25.167 -14.719 -13.839
  294    H    VAL  44           H        VAL  44  24.436 -13.114  -9.764
  295    HA   VAL  44           HA       VAL  44  24.955 -15.978  -9.319
  296    HB   VAL  44           HB       VAL  44  26.314 -13.652  -7.957
  297   HG11  VAL  44          1HG1      VAL  44  26.509 -16.594  -7.780
  298   HG12  VAL  44          2HG1      VAL  44  28.032 -15.703  -7.770
  299   HG13  VAL  44          3HG1      VAL  44  26.800 -15.360  -6.554
  300   HG21  VAL  44          3HG2      VAL  44  26.981 -13.426 -10.186
  301   HG22  VAL  44          1HG2      VAL  44  28.262 -14.394  -9.455
  302   HG23  VAL  44          2HG2      VAL  44  27.026 -15.170 -10.446
  303    H    ARG  45           H        ARG  45  23.213 -13.260  -8.186
  304    HA   ARG  45           HA       ARG  45  22.660 -14.566  -5.614
  305    HB2  ARG  45           1HB      ARG  45  23.377 -12.043  -5.936
  306    HB3  ARG  45           2HB      ARG  45  21.665 -11.829  -6.272
  307    HG2  ARG  45           1HG      ARG  45  22.050 -11.369  -3.962
  308    HG3  ARG  45           2HG      ARG  45  21.158 -12.887  -4.085
  309    HD2  ARG  45           1HD      ARG  45  23.036 -12.898  -2.428
  310    HD3  ARG  45           2HD      ARG  45  23.119 -14.165  -3.652
  311    HE   ARG  45           HE       ARG  45  24.595 -11.817  -4.370
  312   HH11  ARG  45          1HH1      ARG  45  24.693 -14.788  -2.558
  313   HH12  ARG  45          2HH1      ARG  45  26.420 -14.916  -2.610
  314   HH21  ARG  45          1HH2      ARG  45  26.869 -11.973  -4.445
  315   HH22  ARG  45          2HH2      ARG  45  27.657 -13.314  -3.683
  316    H    GLU  46           H        GLU  46  20.883 -15.755  -5.502
  317    HA   GLU  46           HA       GLU  46  18.956 -16.009  -7.470
  318    HB2  GLU  46           1HB      GLU  46  18.999 -16.668  -4.548
  319    HB3  GLU  46           2HB      GLU  46  17.513 -16.875  -5.465
  320    HG2  GLU  46           1HG      GLU  46  20.139 -18.127  -6.225
  321    HG3  GLU  46           2HG      GLU  46  18.908 -18.926  -5.249
  322    H    LYS  47           H        LYS  47  16.962 -15.132  -7.859
  323    HA   LYS  47           HA       LYS  47  16.518 -12.454  -7.225
  324    HB2  LYS  47           1HB      LYS  47  15.499 -13.996  -9.086
  325    HB3  LYS  47           2HB      LYS  47  14.229 -14.265  -7.899
  326    HG2  LYS  47           1HG      LYS  47  13.376 -12.196  -8.142
  327    HG3  LYS  47           2HG      LYS  47  14.960 -11.452  -8.375
  328    HD2  LYS  47           1HD      LYS  47  14.996 -11.946 -10.645
  329    HD3  LYS  47           2HD      LYS  47  13.796 -13.230 -10.485
  330    HE2  LYS  47           1HE      LYS  47  13.162 -10.331  -9.989
  331    HE3  LYS  47           2HE      LYS  47  13.013 -11.082 -11.578
  332    HZ1  LYS  47           3HZ      LYS  47  11.707 -12.414  -9.329
  333    HZ2  LYS  47           1HZ      LYS  47  11.219 -12.290 -10.944
  334    HZ3  LYS  47           2HZ      LYS  47  11.008 -10.981  -9.894
  335    H    VAL  48           H        VAL  48  15.767 -15.321  -5.465
  336    HA   VAL  48           HA       VAL  48  13.646 -14.336  -3.874
  337    HB   VAL  48           HB       VAL  48  14.228 -16.747  -4.093
  338   HG11  VAL  48          1HG1      VAL  48  16.216 -16.699  -1.960
  339   HG12  VAL  48          2HG1      VAL  48  16.198 -17.606  -3.474
  340   HG13  VAL  48          3HG1      VAL  48  16.772 -15.938  -3.451
  341   HG21  VAL  48          3HG2      VAL  48  13.528 -17.333  -1.924
  342   HG22  VAL  48          1HG2      VAL  48  14.302 -15.920  -1.205
  343   HG23  VAL  48          2HG2      VAL  48  12.861 -15.724  -2.202
  344    H    ASP  49           H        ASP  49  16.940 -13.572  -3.941
  345    HA   ASP  49           HA       ASP  49  17.475 -13.077  -1.225
  346    HB2  ASP  49           1HB      ASP  49  19.192 -13.159  -3.034
  347    HB3  ASP  49           2HB      ASP  49  18.607 -11.600  -3.609
  348    H    PHE  50           H        PHE  50  15.494 -11.433  -3.480
  349    HA   PHE  50           HA       PHE  50  15.603  -8.808  -2.515
  350    HB2  PHE  50           1HB      PHE  50  13.696 -10.412  -4.115
  351    HB3  PHE  50           2HB      PHE  50  13.031  -8.984  -3.329
  352    HD1  PHE  50           HD1      PHE  50  14.228  -6.759  -3.725
  353    HD2  PHE  50           HD2      PHE  50  14.853 -10.223  -6.117
  354    HE1  PHE  50           HE1      PHE  50  15.121  -5.346  -5.531
  355    HE2  PHE  50           HE2      PHE  50  15.747  -8.816  -7.927
  356    HZ   PHE  50           HZ       PHE  50  15.883  -6.375  -7.635
  357    H    GLU  51           H        GLU  51  14.931  -7.894  -0.689
  358    HA   GLU  51           HA       GLU  51  12.943  -9.323   0.948
  359    HB2  GLU  51           1HB      GLU  51  14.194  -8.342   2.944
  360    HB3  GLU  51           2HB      GLU  51  14.961  -9.683   2.106
  361    HG2  GLU  51           1HG      GLU  51  16.648  -8.397   1.287
  362    HG3  GLU  51           2HG      GLU  51  15.663  -6.935   1.246
  363    H    ARG  52           H        ARG  52  11.334  -8.121   1.819
  364    HA   ARG  52           HA       ARG  52  10.721  -5.615   0.734
  365    HB2  ARG  52           1HB      ARG  52   8.800  -5.646   2.065
  366    HB3  ARG  52           2HB      ARG  52   9.169  -7.351   1.838
  367    HG2  ARG  52           1HG      ARG  52   9.891  -5.725   4.268
  368    HG3  ARG  52           2HG      ARG  52   8.520  -6.829   4.142
  369    HD2  ARG  52           1HD      ARG  52  10.133  -8.662   3.639
  370    HD3  ARG  52           2HD      ARG  52  11.446  -7.530   3.963
  371    HE   ARG  52           HE       ARG  52   9.711  -7.549   6.164
  372   HH11  ARG  52          1HH1      ARG  52  11.987  -9.626   4.544
  373   HH12  ARG  52          2HH1      ARG  52  12.407 -10.502   5.978
  374   HH21  ARG  52          1HH2      ARG  52  10.256  -8.695   8.059
  375   HH22  ARG  52          2HH2      ARG  52  11.422  -9.972   7.977
  376    H    MET  53           H        MET  53  10.813  -3.531   1.542
  377    HA   MET  53           HA       MET  53  12.411  -3.142   3.982
  378    HB2  MET  53           1HB      MET  53  12.873  -2.107   1.243
  379    HB3  MET  53           2HB      MET  53  13.126  -0.971   2.561
  380    HG2  MET  53           1HG      MET  53  14.414  -3.684   2.431
  381    HG3  MET  53           2HG      MET  53  15.159  -2.212   1.810
  382    HE1  MET  53           3HE      MET  53  17.179  -3.357   4.523
  383    HE2  MET  53           1HE      MET  53  17.056  -2.677   2.900
  384    HE3  MET  53           2HE      MET  53  17.403  -1.625   4.272
  385    H    GLY  54           H        GLY  54  11.160  -2.177   5.439
  386    HA2  GLY  54           1HA      GLY  54   9.778  -0.609   6.401
  387    HA3  GLY  54           2HA      GLY  54   9.932   0.337   4.928
  388    H    GLY  55           H        GLY  55   8.078  -2.107   6.599
  389    HA2  GLY  55           1HA      GLY  55   6.126  -2.252   4.435
  390    HA3  GLY  55           2HA      GLY  55   6.114  -3.202   5.913
  391    H    LYS  56           H        LYS  56   5.515  -2.072   7.915
  392    HA   LYS  56           HA       LYS  56   3.125  -0.591   7.560
  393    HB2  LYS  56           1HB      LYS  56   3.095  -0.434  10.009
  394    HB3  LYS  56           2HB      LYS  56   3.452  -2.072   9.475
  395    HG2  LYS  56           1HG      LYS  56   5.620  -1.991  10.215
  396    HG3  LYS  56           2HG      LYS  56   5.712  -0.233  10.088
  397    HD2  LYS  56           1HD      LYS  56   3.857  -0.360  11.970
  398    HD3  LYS  56           2HD      LYS  56   4.604  -1.931  12.266
  399    HE2  LYS  56           1HE      LYS  56   6.818  -0.475  12.130
  400    HE3  LYS  56           2HE      LYS  56   5.708   0.805  12.619
  401    HZ1  LYS  56           3HZ      LYS  56   5.177  -0.331  14.589
  402    HZ2  LYS  56           1HZ      LYS  56   6.860  -0.441  14.460
  403    HZ3  LYS  56           2HZ      LYS  56   5.894  -1.772  14.066
  Start of MODEL   10
    1    H1   MET   1           H        MET   1   2.055  -0.206   2.306
    2    HA   MET   1           HA       MET   1   1.866  -1.580  -0.076
    3    HB2  MET   1           1HB      MET   1   3.694   0.721   0.629
    4    HB3  MET   1           2HB      MET   1   3.379   0.172  -1.011
    5    HG2  MET   1           1HG      MET   1   1.181   1.046   0.832
    6    HG3  MET   1           2HG      MET   1   2.072   2.179  -0.182
    7    HE1  MET   1           3HE      MET   1   1.618   2.258  -3.057
    8    HE2  MET   1           1HE      MET   1  -0.141   2.384  -3.015
    9    HE3  MET   1           2HE      MET   1   0.826   3.119  -1.736
   10    H    THR   2           H        THR   2   3.555  -2.286  -1.569
   11    HA   THR   2           HA       THR   2   5.547  -3.889  -0.168
   12    HB   THR   2           HB       THR   2   4.695  -3.901  -3.070
   13    HG1  THR   2           HG1      THR   2   3.092  -4.875  -1.971
   14   HG21  THR   2          3HG2      THR   2   5.928  -6.216  -2.859
   15   HG22  THR   2          1HG2      THR   2   6.815  -5.384  -1.583
   16   HG23  THR   2          2HG2      THR   2   6.830  -4.747  -3.227
   17    H    ALA   3           H        ALA   3   7.745  -3.780  -0.527
   18    HA   ALA   3           HA       ALA   3   8.820  -1.866  -2.421
   19    HB1  ALA   3           1HB      ALA   3   8.382  -1.095   0.259
   20    HB2  ALA   3           2HB      ALA   3  10.122  -1.296   0.051
   21    HB3  ALA   3           3HB      ALA   3   9.228  -0.206  -1.008
   22    H    TYR   4           H        TYR   4  10.388  -2.954  -3.395
   23    HA   TYR   4           HA       TYR   4  11.994  -4.844  -1.807
   24    HB2  TYR   4           1HB      TYR   4  11.186  -4.842  -4.707
   25    HB3  TYR   4           2HB      TYR   4  12.544  -5.803  -4.135
   26    HD1  TYR   4           HD1      TYR   4  12.153  -7.624  -2.480
   27    HD2  TYR   4           HD2      TYR   4   8.941  -5.527  -4.320
   28    HE1  TYR   4           HE1      TYR   4  10.610  -9.421  -1.818
   29    HE2  TYR   4           HE2      TYR   4   7.388  -7.318  -3.663
   30    HH   TYR   4           HH       TYR   4   8.268 -10.289  -2.800
   31    H    ARG   5           H        ARG   5  13.787  -3.808  -1.177
   32    HA   ARG   5           HA       ARG   5  15.272  -2.265  -3.202
   33    HB2  ARG   5           1HB      ARG   5  14.411  -0.979  -1.216
   34    HB3  ARG   5           2HB      ARG   5  15.468  -1.956  -0.204
   35    HG2  ARG   5           1HG      ARG   5  16.759  -0.632  -2.495
   36    HG3  ARG   5           2HG      ARG   5  16.151   0.433  -1.225
   37    HD2  ARG   5           1HD      ARG   5  17.971  -1.929  -0.772
   38    HD3  ARG   5           2HD      ARG   5  18.509  -0.254  -0.893
   39    HE   ARG   5           HE       ARG   5  16.568  -0.321   1.078
   40   HH11  ARG   5          1HH1      ARG   5  19.703  -1.724   0.509
   41   HH12  ARG   5          2HH1      ARG   5  20.110  -1.819   2.191
   42   HH21  ARG   5          1HH2      ARG   5  17.093  -0.441   3.295
   43   HH22  ARG   5          2HH2      ARG   5  18.624  -1.089   3.774
   44    H    CYS   6           H        CYS   6  16.765  -3.613  -4.009
   45    HA   CYS   6           HA       CYS   6  18.788  -4.651  -2.216
   46    HB2  CYS   6           1HB      CYS   6  16.828  -6.380  -3.617
   47    HB3  CYS   6           2HB      CYS   6  18.508  -6.899  -3.674
   48    HG   CYS   6           HG       CYS   6  18.814  -7.441  -1.087
   49    HA   PRO   7           HA       PRO   7  20.535  -3.012  -6.120
   50    HB2  PRO   7           1HB      PRO   7  22.766  -2.012  -4.940
   51    HB3  PRO   7           2HB      PRO   7  21.232  -1.136  -4.992
   52    HG2  PRO   7           1HG      PRO   7  22.416  -2.752  -2.768
   53    HG3  PRO   7           2HG      PRO   7  21.595  -1.182  -2.696
   54    HD2  PRO   7           1HD      PRO   7  20.357  -3.503  -2.055
   55    HD3  PRO   7           2HD      PRO   7  19.497  -2.133  -2.785
   56    H    VAL   8           H        VAL   8  21.414  -5.400  -3.886
   57    HA   VAL   8           HA       VAL   8  23.982  -6.108  -4.840
   58    HB   VAL   8           HB       VAL   8  23.668  -8.224  -3.690
   59   HG11  VAL   8          1HG1      VAL   8  22.385  -6.777  -1.606
   60   HG12  VAL   8          2HG1      VAL   8  24.102  -7.127  -1.811
   61   HG13  VAL   8          3HG1      VAL   8  23.410  -5.662  -2.508
   62   HG21  VAL   8          3HG2      VAL   8  21.259  -8.217  -2.447
   63   HG22  VAL   8          1HG2      VAL   8  20.830  -7.534  -4.015
   64   HG23  VAL   8          2HG2      VAL   8  21.612  -9.112  -3.925
   65    H    CYS   9           H        CYS   9  20.833  -6.554  -6.114
   66    HA   CYS   9           HA       CYS   9  21.892  -8.457  -8.099
   67    HB2  CYS   9           1HB      CYS   9  19.287  -8.898  -8.369
   68    HB3  CYS   9           2HB      CYS   9  20.242  -9.739  -7.154
   69    HG   CYS   9           HG       CYS   9  18.382  -9.189  -5.442
   70    H    ASP  10           H        ASP  10  19.378  -5.966  -7.666
   71    HA   ASP  10           HA       ASP  10  20.178  -4.698 -10.143
   72    HB2  ASP  10           1HB      ASP  10  18.596  -6.448 -10.893
   73    HB3  ASP  10           2HB      ASP  10  17.368  -5.774  -9.825
   74    H    TYR  11           H        TYR  11  19.040  -2.643 -10.499
   75    HA   TYR  11           HA       TYR  11  19.055  -0.979  -8.327
   76    HB2  TYR  11           1HB      TYR  11  17.768  -0.827 -11.013
   77    HB3  TYR  11           2HB      TYR  11  17.323   0.383  -9.815
   78    HD1  TYR  11           HD2      TYR  11  19.328   1.587  -8.633
   79    HD2  TYR  11           HD1      TYR  11  19.625  -0.462 -12.350
   80    HE1  TYR  11           HE2      TYR  11  21.353   2.874  -9.174
   81    HE2  TYR  11           HE1      TYR  11  21.651   0.819 -12.901
   82    HH   TYR  11           HH       TYR  11  22.961   2.538 -12.308
   83    H    THR  12           H        THR  12  17.346   0.129  -7.176
   84    HA   THR  12           HA       THR  12  15.070  -1.656  -6.637
   85    HB   THR  12           HB       THR  12  16.339  -1.391  -4.649
   86    HG1  THR  12           HG1      THR  12  14.374   0.593  -4.248
   87   HG21  THR  12          3HG2      THR  12  16.519   1.140  -3.818
   88   HG22  THR  12          1HG2      THR  12  16.570   1.424  -5.558
   89   HG23  THR  12          2HG2      THR  12  17.769   0.377  -4.799
   90    H    TYR  13           H        TYR  13  13.023  -0.955  -6.876
   91    HA   TYR  13           HA       TYR  13  12.461   1.890  -7.109
   92    HB2  TYR  13           1HB      TYR  13  11.104   1.362  -9.239
   93    HB3  TYR  13           2HB      TYR  13  12.849   1.529  -9.390
   94    HD1  TYR  13           HD1      TYR  13  14.263  -0.487  -9.681
   95    HD2  TYR  13           HD2      TYR  13  10.014  -0.715  -9.689
   96    HE1  TYR  13           HE1      TYR  13  14.391  -2.715 -10.715
   97    HE2  TYR  13           HE2      TYR  13  10.130  -2.944 -10.722
   98    HH   TYR  13           HH       TYR  13  12.791  -4.814 -10.768
   99    H    ASP  14           H        ASP  14  10.964   2.066  -5.568
  100    HA   ASP  14           HA       ASP  14   9.151  -0.013  -4.871
  101    HB2  ASP  14           1HB      ASP  14   9.792   1.535  -3.163
  102    HB3  ASP  14           2HB      ASP  14   9.273   2.912  -4.131
  103    H    GLU  15           H        GLU  15   7.031  -0.314  -5.385
  104    HA   GLU  15           HA       GLU  15   6.074   0.509  -7.857
  105    HB2  GLU  15           1HB      GLU  15   4.920  -0.826  -5.483
  106    HB3  GLU  15           2HB      GLU  15   3.765  -0.074  -6.575
  107    HG2  GLU  15           1HG      GLU  15   4.334  -2.526  -6.952
  108    HG3  GLU  15           2HG      GLU  15   4.356  -1.455  -8.352
  109    H    GLY  16           H        GLY  16   5.533   1.892  -4.653
  110    HA2  GLY  16           1HA      GLY  16   3.658   3.857  -5.623
  111    HA3  GLY  16           2HA      GLY  16   4.335   3.767  -4.003
  112    H    LYS  17           H        LYS  17   6.895   3.596  -6.045
  113    HA   LYS  17           HA       LYS  17   7.335   6.503  -5.885
  114    HB2  LYS  17           1HB      LYS  17   8.851   4.798  -4.635
  115    HB3  LYS  17           2HB      LYS  17   9.536   4.490  -6.225
  116    HG2  LYS  17           1HG      LYS  17  10.962   6.113  -5.586
  117    HG3  LYS  17           2HG      LYS  17   9.683   7.159  -6.207
  118    HD2  LYS  17           1HD      LYS  17   8.771   6.936  -3.744
  119    HD3  LYS  17           2HD      LYS  17  10.460   6.563  -3.392
  120    HE2  LYS  17           1HE      LYS  17  11.176   8.658  -4.313
  121    HE3  LYS  17           2HE      LYS  17   9.552   9.009  -4.901
  122    HZ1  LYS  17           3HZ      LYS  17   9.502   8.504  -2.117
  123    HZ2  LYS  17           1HZ      LYS  17   9.029   9.895  -2.955
  124    HZ3  LYS  17           2HZ      LYS  17  10.635   9.713  -2.459
  125    H    GLY  18           H        GLY  18   7.523   3.676  -7.961
  126    HA2  GLY  18           1HA      GLY  18   7.361   3.593 -10.273
  127    HA3  GLY  18           2HA      GLY  18   7.341   5.350 -10.302
  128    H    ASP  19           H        ASP  19   8.769   3.781 -12.139
  129    HA   ASP  19           HA       ASP  19  11.285   5.028 -12.066
  130    HB2  ASP  19           1HB      ASP  19  11.417   3.075 -10.298
  131    HB3  ASP  19           2HB      ASP  19  11.647   2.078 -11.732
  132    HA   PRO  20           HA       PRO  20   9.762   3.381 -16.128
  133    HB2  PRO  20           1HB      PRO  20   9.965   5.755 -17.429
  134    HB3  PRO  20           2HB      PRO  20   8.529   5.281 -16.514
  135    HG2  PRO  20           1HG      PRO  20  10.787   7.070 -15.702
  136    HG3  PRO  20           2HG      PRO  20   9.045   7.283 -15.450
  137    HD2  PRO  20           1HD      PRO  20  10.700   6.385 -13.503
  138    HD3  PRO  20           2HD      PRO  20   9.008   5.865 -13.632
  139    H    ARG  21           H        ARG  21  12.586   4.777 -14.875
  140    HA   ARG  21           HA       ARG  21  14.183   5.082 -17.154
  141    HB2  ARG  21           1HB      ARG  21  14.673   4.694 -14.252
  142    HB3  ARG  21           2HB      ARG  21  16.019   4.359 -15.333
  143    HG2  ARG  21           1HG      ARG  21  16.387   6.563 -14.892
  144    HG3  ARG  21           2HG      ARG  21  15.378   6.701 -16.333
  145    HD2  ARG  21           1HD      ARG  21  13.405   7.005 -14.896
  146    HD3  ARG  21           2HD      ARG  21  14.443   6.915 -13.473
  147    HE   ARG  21           HE       ARG  21  14.112   9.160 -15.242
  148   HH11  ARG  21          1HH1      ARG  21  16.199   7.614 -12.923
  149   HH12  ARG  21          2HH1      ARG  21  17.028   9.075 -12.500
  150   HH21  ARG  21          1HH2      ARG  21  15.196  11.090 -14.693
  151   HH22  ARG  21          2HH2      ARG  21  16.456  11.052 -13.506
  152    H    GLU  22           H        GLU  22  13.091   2.250 -15.498
  153    HA   GLU  22           HA       GLU  22  14.923   0.580 -17.084
  154    HB2  GLU  22           1HB      GLU  22  13.408   0.000 -14.538
  155    HB3  GLU  22           2HB      GLU  22  14.240  -1.239 -15.467
  156    HG2  GLU  22           1HG      GLU  22  15.531   1.182 -14.231
  157    HG3  GLU  22           2HG      GLU  22  15.572  -0.455 -13.579
  158    H    GLY  23           H        GLY  23  12.359   1.874 -17.938
  159    HA2  GLY  23           1HA      GLY  23  10.742   1.261 -19.473
  160    HA3  GLY  23           2HA      GLY  23  11.301  -0.400 -19.337
  161    H    PHE  24           H        PHE  24  10.531   1.175 -16.394
  162    HA   PHE  24           HA       PHE  24   7.858  -0.048 -16.368
  163    HB2  PHE  24           1HB      PHE  24   9.813  -0.182 -14.065
  164    HB3  PHE  24           2HB      PHE  24   8.218  -0.922 -14.142
  165    HD1  PHE  24           HD2      PHE  24   7.872  -2.599 -16.133
  166    HD2  PHE  24           HD1      PHE  24  11.656  -1.465 -14.548
  167    HE1  PHE  24           HE2      PHE  24   8.868  -4.652 -17.052
  168    HE2  PHE  24           HE1      PHE  24  12.658  -3.516 -15.465
  169    HZ   PHE  24           HZ       PHE  24  11.264  -5.114 -16.717
  170    HA   PRO  25           HA       PRO  25   7.547   4.343 -15.048
  171    HB2  PRO  25           1HB      PRO  25   5.129   4.739 -16.217
  172    HB3  PRO  25           2HB      PRO  25   6.656   4.892 -17.094
  173    HG2  PRO  25           1HG      PRO  25   4.736   2.597 -17.020
  174    HG3  PRO  25           2HG      PRO  25   5.593   3.294 -18.407
  175    HD2  PRO  25           1HD      PRO  25   6.416   1.028 -17.176
  176    HD3  PRO  25           2HD      PRO  25   7.548   2.173 -17.923
  177    H    ALA  26           H        ALA  26   5.523   5.427 -14.019
  178    HA   ALA  26           HA       ALA  26   4.898   4.158 -11.652
  179    HB1  ALA  26           1HB      ALA  26   4.322   6.615 -12.822
  180    HB2  ALA  26           2HB      ALA  26   2.748   5.910 -12.451
  181    HB3  ALA  26           3HB      ALA  26   3.948   6.109 -11.174
  182    H    GLY  27           H        GLY  27   3.472   2.655 -11.015
  183    HA2  GLY  27           1HA      GLY  27   1.212   1.737 -11.160
  184    HA3  GLY  27           2HA      GLY  27   1.331   1.902 -12.905
  185    H    THR  28           H        THR  28   4.020   0.879 -13.099
  186    HA   THR  28           HA       THR  28   3.544  -1.798 -13.567
  187    HB   THR  28           HB       THR  28   6.199  -0.529 -12.871
  188    HG1  THR  28           HG1      THR  28   5.128  -1.088 -15.445
  189   HG21  THR  28          3HG2      THR  28   7.091  -2.559 -13.075
  190   HG22  THR  28          1HG2      THR  28   6.457  -2.661 -14.717
  191   HG23  THR  28          2HG2      THR  28   5.495  -3.251 -13.362
  192    H    ARG  29           H        ARG  29   3.300  -3.530 -12.318
  193    HA   ARG  29           HA       ARG  29   3.746  -3.292  -9.457
  194    HB2  ARG  29           1HB      ARG  29   2.666  -5.698 -10.917
  195    HB3  ARG  29           2HB      ARG  29   2.442  -5.265  -9.228
  196    HG2  ARG  29           1HG      ARG  29   1.319  -3.751 -11.576
  197    HG3  ARG  29           2HG      ARG  29   0.426  -4.887 -10.562
  198    HD2  ARG  29           1HD      ARG  29   0.880  -3.460  -8.608
  199    HD3  ARG  29           2HD      ARG  29   1.714  -2.314  -9.657
  200    HE   ARG  29           HE       ARG  29  -0.319  -1.489 -10.272
  201   HH11  ARG  29          1HH1      ARG  29  -0.767  -4.689  -8.975
  202   HH12  ARG  29          2HH1      ARG  29  -2.496  -4.618  -9.048
  203   HH21  ARG  29          1HH2      ARG  29  -2.596  -1.383 -10.373
  204   HH22  ARG  29          2HH2      ARG  29  -3.536  -2.737  -9.843
  205    H    TRP  30           H        TRP  30   5.273  -4.347  -8.304
  206    HA   TRP  30           HA       TRP  30   7.641  -5.177  -9.486
  207    HB2  TRP  30           1HB      TRP  30   8.087  -6.280  -7.229
  208    HB3  TRP  30           2HB      TRP  30   7.720  -4.557  -7.205
  209    HD1  TRP  30           HD1      TRP  30   5.528  -3.790  -5.963
  210    HE1  TRP  30           HE1      TRP  30   3.846  -5.008  -4.441
  211    HE3  TRP  30           HE3      TRP  30   6.940  -8.615  -6.891
  212    HZ2  TRP  30           HZ2      TRP  30   3.204  -7.663  -3.728
  213    HZ3  TRP  30           HZ3      TRP  30   5.742 -10.435  -5.749
  214    HH2  TRP  30           HH2      TRP  30   3.913  -9.967  -4.200
  215    H    ASP  31           H        ASP  31   4.723  -6.951  -8.869
  216    HA   ASP  31           HA       ASP  31   5.876  -9.557  -9.131
  217    HB2  ASP  31           1HB      ASP  31   3.708  -9.013  -7.941
  218    HB3  ASP  31           2HB      ASP  31   2.977  -8.809  -9.531
  219    H    GLN  32           H        GLN  32   4.561  -7.183 -11.315
  220    HA   GLN  32           HA       GLN  32   4.073  -8.849 -13.530
  221    HB2  GLN  32           1HB      GLN  32   4.778  -5.918 -13.369
  222    HB3  GLN  32           2HB      GLN  32   4.307  -6.726 -14.858
  223    HG2  GLN  32           1HG      GLN  32   2.503  -6.977 -12.519
  224    HG3  GLN  32           2HG      GLN  32   2.573  -5.423 -13.349
  225   HE21  GLN  32          2HE2      GLN  32   1.344  -8.581 -13.383
  226   HE22  GLN  32          1HE2      GLN  32   0.560  -8.519 -14.921
  227    H    ILE  33           H        ILE  33   6.989  -7.652 -12.146
  228    HA   ILE  33           HA       ILE  33   8.736  -7.553 -14.276
  229    HB   ILE  33           HB       ILE  33   9.338  -8.684 -11.541
  230   HG12  ILE  33          1HG1      ILE  33   8.340  -6.443 -11.425
  231   HG13  ILE  33          2HG1      ILE  33  10.041  -6.401 -10.974
  232   HG21  ILE  33          1HG2      ILE  33  11.638  -8.091 -11.988
  233   HG22  ILE  33          2HG2      ILE  33  11.048  -9.169 -13.251
  234   HG23  ILE  33          3HG2      ILE  33  11.194  -7.440 -13.565
  235   HD11  ILE  33          3HD1      ILE  33  10.617  -5.536 -13.165
  236   HD12  ILE  33          1HD1      ILE  33   8.926  -5.622 -13.657
  237   HD13  ILE  33          2HD1      ILE  33   9.417  -4.510 -12.379
  238    HA   PRO  34           HA       PRO  34   8.743 -11.677 -15.875
  239    HB2  PRO  34           1HB      PRO  34  10.945 -11.437 -17.445
  240    HB3  PRO  34           2HB      PRO  34   9.382 -10.728 -17.868
  241    HG2  PRO  34           1HG      PRO  34  11.778  -9.428 -16.631
  242    HG3  PRO  34           2HG      PRO  34  10.716  -8.824 -17.917
  243    HD2  PRO  34           1HD      PRO  34  10.496  -8.011 -15.343
  244    HD3  PRO  34           2HD      PRO  34   9.096  -8.136 -16.428
  245    H    ASP  35           H        ASP  35   9.378 -13.404 -14.761
  246    HA   ASP  35           HA       ASP  35  11.616 -13.393 -13.010
  247    HB2  ASP  35           1HB      ASP  35  11.035 -15.671 -12.513
  248    HB3  ASP  35           2HB      ASP  35   9.538 -14.760 -12.688
  249    H    ASP  36           H        ASP  36  11.277 -14.005 -16.341
  250    HA   ASP  36           HA       ASP  36  13.720 -15.605 -16.476
  251    HB2  ASP  36           1HB      ASP  36  11.526 -14.955 -18.410
  252    HB3  ASP  36           2HB      ASP  36  13.095 -15.474 -19.021
  253    H    TRP  37           H        TRP  37  13.757 -12.789 -15.671
  254    HA   TRP  37           HA       TRP  37  14.959 -11.409 -17.932
  255    HB2  TRP  37           1HB      TRP  37  13.421 -10.405 -16.047
  256    HB3  TRP  37           2HB      TRP  37  14.935 -10.294 -15.154
  257    HD1  TRP  37           HD1      TRP  37  16.282  -8.148 -15.533
  258    HE1  TRP  37           HE1      TRP  37  16.276  -6.257 -17.278
  259    HE3  TRP  37           HE3      TRP  37  12.848 -10.067 -18.798
  260    HZ2  TRP  37           HZ2      TRP  37  14.987  -5.657 -19.717
  261    HZ3  TRP  37           HZ3      TRP  37  12.284  -8.772 -20.812
  262    HH2  TRP  37           HH2      TRP  37  13.332  -6.612 -21.260
  263    H    CYS  38           H        CYS  38  17.093 -10.531 -17.873
  264    HA   CYS  38           HA       CYS  38  18.921 -12.010 -16.096
  265    HB2  CYS  38           1HB      CYS  38  20.593 -11.820 -17.971
  266    HB3  CYS  38           2HB      CYS  38  19.218 -12.865 -18.310
  267    HG   CYS  38           HG       CYS  38  19.429 -11.706 -20.686
  268    H    CYS  39           H        CYS  39  20.084 -10.786 -14.777
  269    HA   CYS  39           HA       CYS  39  20.539  -7.970 -15.514
  270    HB2  CYS  39           1HB      CYS  39  19.482  -9.181 -13.067
  271    HB3  CYS  39           2HB      CYS  39  20.801  -8.056 -12.769
  272    HG   CYS  39           HG       CYS  39  19.290  -6.188 -14.616
  273    HA   PRO  40           HA       PRO  40  24.864  -8.514 -15.041
  274    HB2  PRO  40           1HB      PRO  40  25.624  -6.217 -13.812
  275    HB3  PRO  40           2HB      PRO  40  25.105  -6.276 -15.500
  276    HG2  PRO  40           1HG      PRO  40  23.553  -5.476 -13.069
  277    HG3  PRO  40           2HG      PRO  40  23.599  -4.712 -14.668
  278    HD2  PRO  40           1HD      PRO  40  21.583  -6.343 -13.891
  279    HD3  PRO  40           2HD      PRO  40  22.127  -6.235 -15.578
  280    H    ASP  41           H        ASP  41  23.483  -7.117 -12.060
  281    HA   ASP  41           HA       ASP  41  25.472  -8.431 -10.427
  282    HB2  ASP  41           1HB      ASP  41  23.555  -6.287 -10.099
  283    HB3  ASP  41           2HB      ASP  41  23.463  -7.422  -8.755
  284    H    CYS  42           H        CYS  42  21.937  -8.612 -10.799
  285    HA   CYS  42           HA       CYS  42  21.460 -10.665  -8.984
  286    HB2  CYS  42           1HB      CYS  42  19.776  -9.204 -10.259
  287    HB3  CYS  42           2HB      CYS  42  19.936 -10.372 -11.566
  288    HG   CYS  42           HG       CYS  42  17.732 -10.509  -9.389
  289    H    SER  43           H        SER  43  22.915 -10.758 -12.103
  290    HA   SER  43           HA       SER  43  22.404 -13.312 -12.996
  291    HB2  SER  43           1HB      SER  43  23.698 -12.239 -14.535
  292    HB3  SER  43           2HB      SER  43  24.640 -11.394 -13.307
  293    HG   SER  43           HG       SER  43  25.211 -13.679 -14.631
  294    H    VAL  44           H        VAL  44  24.440 -12.283 -10.358
  295    HA   VAL  44           HA       VAL  44  25.261 -15.076  -9.905
  296    HB   VAL  44           HB       VAL  44  27.132 -13.500 -10.160
  297   HG11  VAL  44          1HG1      VAL  44  25.506 -11.884  -8.430
  298   HG12  VAL  44          2HG1      VAL  44  27.111 -12.104  -7.729
  299   HG13  VAL  44          3HG1      VAL  44  26.941 -11.438  -9.354
  300   HG21  VAL  44          3HG2      VAL  44  27.160 -15.508  -8.590
  301   HG22  VAL  44          1HG2      VAL  44  28.398 -14.277  -8.338
  302   HG23  VAL  44          2HG2      VAL  44  26.990 -14.343  -7.278
  303    H    ARG  45           H        ARG  45  23.344 -12.514  -8.720
  304    HA   ARG  45           HA       ARG  45  23.123 -13.768  -6.073
  305    HB2  ARG  45           1HB      ARG  45  23.026 -11.030  -7.018
  306    HB3  ARG  45           2HB      ARG  45  21.590 -11.430  -6.085
  307    HG2  ARG  45           1HG      ARG  45  23.079 -10.593  -4.508
  308    HG3  ARG  45           2HG      ARG  45  23.213 -12.344  -4.331
  309    HD2  ARG  45           1HD      ARG  45  25.072 -11.573  -6.306
  310    HD3  ARG  45           2HD      ARG  45  25.241 -10.431  -4.973
  311    HE   ARG  45           HE       ARG  45  25.140 -13.079  -3.989
  312   HH11  ARG  45          1HH1      ARG  45  27.236 -10.862  -5.667
  313   HH12  ARG  45          2HH1      ARG  45  28.694 -11.606  -5.099
  314   HH21  ARG  45          1HH2      ARG  45  27.053 -14.067  -3.235
  315   HH22  ARG  45          2HH2      ARG  45  28.588 -13.430  -3.717
  316    H    GLU  46           H        GLU  46  21.465 -15.077  -5.725
  317    HA   GLU  46           HA       GLU  46  19.468 -15.688  -7.529
  318    HB2  GLU  46           1HB      GLU  46  20.231 -16.716  -5.157
  319    HB3  GLU  46           2HB      GLU  46  18.744 -15.917  -4.665
  320    HG2  GLU  46           1HG      GLU  46  18.178 -18.142  -5.197
  321    HG3  GLU  46           2HG      GLU  46  17.586 -17.141  -6.521
  322    H    LYS  47           H        LYS  47  17.390 -15.028  -7.894
  323    HA   LYS  47           HA       LYS  47  16.733 -12.343  -7.447
  324    HB2  LYS  47           1HB      LYS  47  15.837 -13.968  -9.229
  325    HB3  LYS  47           2HB      LYS  47  14.688 -14.482  -8.000
  326    HG2  LYS  47           1HG      LYS  47  13.503 -12.549  -8.098
  327    HG3  LYS  47           2HG      LYS  47  14.912 -11.575  -8.522
  328    HD2  LYS  47           1HD      LYS  47  14.772 -12.120 -10.771
  329    HD3  LYS  47           2HD      LYS  47  13.843 -13.588 -10.460
  330    HE2  LYS  47           1HE      LYS  47  12.755 -10.838  -9.914
  331    HE3  LYS  47           2HE      LYS  47  12.589 -11.626 -11.483
  332    HZ1  LYS  47           3HZ      LYS  47  10.636 -12.006 -10.147
  333    HZ2  LYS  47           1HZ      LYS  47  11.567 -12.654  -8.891
  334    HZ3  LYS  47           2HZ      LYS  47  11.456 -13.469 -10.368
  335    H    VAL  48           H        VAL  48  16.325 -15.120  -5.466
  336    HA   VAL  48           HA       VAL  48  14.131 -14.236  -3.901
  337    HB   VAL  48           HB       VAL  48  14.938 -16.593  -3.978
  338   HG11  VAL  48          1HG1      VAL  48  17.388 -15.407  -3.254
  339   HG12  VAL  48          2HG1      VAL  48  16.890 -16.418  -1.897
  340   HG13  VAL  48          3HG1      VAL  48  17.043 -17.117  -3.510
  341   HG21  VAL  48          3HG2      VAL  48  14.994 -15.634  -1.138
  342   HG22  VAL  48          1HG2      VAL  48  13.528 -15.519  -2.112
  343   HG23  VAL  48          2HG2      VAL  48  14.261 -17.093  -1.803
  344    H    ASP  49           H        ASP  49  17.311 -13.141  -4.121
  345    HA   ASP  49           HA       ASP  49  17.881 -12.436  -1.460
  346    HB2  ASP  49           1HB      ASP  49  19.431 -12.414  -3.520
  347    HB3  ASP  49           2HB      ASP  49  18.771 -10.811  -3.833
  348    H    PHE  50           H        PHE  50  15.792 -11.027  -3.835
  349    HA   PHE  50           HA       PHE  50  15.612  -8.407  -2.868
  350    HB2  PHE  50           1HB      PHE  50  13.858 -10.181  -4.500
  351    HB3  PHE  50           2HB      PHE  50  13.151  -8.712  -3.835
  352    HD1  PHE  50           HD2      PHE  50  14.456  -6.515  -4.276
  353    HD2  PHE  50           HD1      PHE  50  14.992 -10.101  -6.506
  354    HE1  PHE  50           HE2      PHE  50  15.416  -5.214  -6.131
  355    HE2  PHE  50           HE1      PHE  50  15.953  -8.806  -8.364
  356    HZ   PHE  50           HZ       PHE  50  16.165  -6.359  -8.179
  357    H    GLU  51           H        GLU  51  14.869  -7.622  -1.018
  358    HA   GLU  51           HA       GLU  51  13.077  -9.306   0.600
  359    HB2  GLU  51           1HB      GLU  51  14.852  -7.060   1.563
  360    HB3  GLU  51           2HB      GLU  51  13.942  -8.187   2.558
  361    HG2  GLU  51           1HG      GLU  51  15.383  -9.976   1.295
  362    HG3  GLU  51           2HG      GLU  51  16.461  -8.606   1.035
  363    H    ARG  52           H        ARG  52  11.156  -8.526   1.301
  364    HA   ARG  52           HA       ARG  52  10.248  -6.026   0.123
  365    HB2  ARG  52           1HB      ARG  52   8.034  -6.757   0.615
  366    HB3  ARG  52           2HB      ARG  52   8.908  -8.155   0.001
  367    HG2  ARG  52           1HG      ARG  52   9.242  -8.935   2.309
  368    HG3  ARG  52           2HG      ARG  52   8.305  -7.557   2.890
  369    HD2  ARG  52           1HD      ARG  52   6.352  -8.340   1.691
  370    HD3  ARG  52           2HD      ARG  52   7.281  -9.668   0.996
  371    HE   ARG  52           HE       ARG  52   7.291  -9.669   3.862
  372   HH11  ARG  52          1HH1      ARG  52   5.512 -10.623   1.026
  373   HH12  ARG  52          2HH1      ARG  52   4.673 -11.911   1.826
  374   HH21  ARG  52          1HH2      ARG  52   6.194 -11.361   4.926
  375   HH22  ARG  52          2HH2      ARG  52   5.062 -12.330   4.045
  376    H    MET  53           H        MET  53   9.545  -4.253   1.252
  377    HA   MET  53           HA       MET  53   9.964  -4.306   4.169
  378    HB2  MET  53           1HB      MET  53  10.586  -2.054   2.250
  379    HB3  MET  53           2HB      MET  53  10.708  -1.949   4.001
  380    HG2  MET  53           1HG      MET  53  12.210  -4.093   2.596
  381    HG3  MET  53           2HG      MET  53  12.807  -2.437   2.507
  382    HE1  MET  53           3HE      MET  53  12.622  -0.995   5.119
  383    HE2  MET  53           1HE      MET  53  14.047  -1.602   5.962
  384    HE3  MET  53           2HE      MET  53  14.115  -1.291   4.227
  385    H    GLY  54           H        GLY  54   8.894  -2.245   5.177
  386    HA2  GLY  54           1HA      GLY  54   6.543  -1.248   3.886
  387    HA3  GLY  54           2HA      GLY  54   6.161  -2.497   5.061
  388    H    GLY  55           H        GLY  55   6.982  -2.154   7.288
  389    HA2  GLY  55           1HA      GLY  55   8.079  -0.209   8.610
  390    HA3  GLY  55           2HA      GLY  55   6.709   0.690   7.975
  391    H    LYS  56           H        LYS  56   7.807  -0.853  10.629
  392    HA   LYS  56           HA       LYS  56   5.100  -1.150  11.688
  393    HB2  LYS  56           1HB      LYS  56   7.230  -3.288  11.868
  394    HB3  LYS  56           2HB      LYS  56   5.739  -3.290  12.802
  395    HG2  LYS  56           1HG      LYS  56   4.449  -3.376  10.714
  396    HG3  LYS  56           2HG      LYS  56   5.959  -3.427   9.801
  397    HD2  LYS  56           1HD      LYS  56   5.404  -5.667   9.936
  398    HD3  LYS  56           2HD      LYS  56   6.491  -5.478  11.314
  399    HE2  LYS  56           1HE      LYS  56   4.570  -5.241  12.801
  400    HE3  LYS  56           2HE      LYS  56   3.477  -5.398  11.427
  401    HZ1  LYS  56           3HZ      LYS  56   4.006  -7.626  11.160
  402    HZ2  LYS  56           1HZ      LYS  56   3.944  -7.456  12.842
  403    HZ3  LYS  56           2HZ      LYS  56   5.439  -7.512  12.053