*HEADER    APOPTOSIS                               03-SEP-12   2LXW              
*TITLE     THE SOLUTION STRUCTURE OF XIAP(RING)-BINDING DOMAIN OF HUMAN XAF1     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: XIAP-ASSOCIATED FACTOR 1;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 251-301;                                      
*COMPND   5 SYNONYM: BIRC4-BINDING PROTEIN;                                      
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: XAF1, BIRC4BP, XIAPAF1;                                        
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PGB1-HIS                                   
*KEYWDS    XAF1, XIAP(RING)-BINDING DOMAIN, APOPTOSIS                            
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    15                                                                    
*AUTHOR    M.TSE, C.CHO, X.GUAN, K.SZE                                           
*REVDAT   1   04-SEP-13 2LXW    0                                                


 21 CYSZ HA     22 SER  H       3.45            #peak     8 #SUP  0.89  #QF  0.89
 34 ASN  HA     37 GLN  H       4.16            #peak     9 #SUP  0.64  #QF  0.64
 36 HIS  HB3    37 GLN  H       4.31            #peak    14 #SUP  0.98  #QF  0.98
 37 GLN  H      37 GLN  HB2     3.72            #peak    16 #SUP  0.79  #QF  0.79
 23 GLN  H      23 GLN  QB      3.71            #peak    18 #SUP  0.96  #QF  0.96
 20 ARG  HA     21 CYSZ H       3.13            #peak    21 #SUP  0.82  #QF  0.82
 18 LEU  HA     19 ARG  H       3.22            #peak    22 #SUP  0.86  #QF  0.86
 29 PRO  HD3    30 LEU  H       4.80            #peak    29 #SUP  0.97  #QF  0.23
 30 LEU  H      31 PRO  HD3     4.97            #peak    29 #SUP  0.97  #QF  0.23
 21 CYSZ H      21 CYSZ HB3     3.51            #peak    30 #SUP  0.91  #QF  0.91
 34 ASN  H      34 ASN  QB      3.74            #peak    32 #SUP  0.92  #QF  0.92
 21 CYSZ H      21 CYSZ HB2     3.64            #peak    34 #SUP  0.96  #QF  0.96
 33 LEU  HB2    34 ASN  H       4.45            #peak    35 #SUP  0.79  #QF  0.79
 19 ARG  H      19 ARG  HB3     4.01            #peak    37 #SUP  0.84  #QF  0.84
 30 LEU  H      30 LEU  HB2     3.91            #peak    38 #SUP  0.87  #QF  0.87
 19 ARG  H      19 ARG  HB2     4.01            #peak    39 #SUP  0.90  #QF  0.90
 20 ARG  HB3    21 CYSZ H       4.24            #peak    40 #SUP  0.95  #QF  0.95
 18 LEU  HB2    19 ARG  H       4.26            #peak    43 #SUP  0.91  #QF  0.91
 19 ARG  H      33 LEU  QD1     5.12            #peak    45 #SUP  0.99  #QF  0.98
 19 ARG  HA     20 ARG  H       3.11            #peak    58 #SUP  0.84  #QF  0.84
 42 TRP  HB3    43 LEU  H       4.00            #peak    70 #SUP  0.95  #QF  0.76
 21 CYSZ HB3    24 CYS- H       4.45            #peak    71 #SUP  0.99  #QF  0.22
 11 ASP  QB     12 LYS  H       5.10            #peak    72 #SUP  0.96  #QF  0.90
 23 GLN  QB     24 CYS- H       4.15            #peak    75 #SUP  0.99  #QF  0.99
 50 GLN  QB     51 VAL  H       4.46            #peak    76 #SUP  0.99  #QF  0.81
 12 LYS  H      12 LYS  QB      4.15            #peak    77 #SUP  0.95  #QF  0.78
 12 LYS  QB     13 ALA  H       4.64            #peak    77 #SUP  0.95  #QF  0.78
  9 ARG  H       9 ARG  QB      3.61            #peak    78 #SUP  0.82  #QF  0.41
 43 LEU  H      43 LEU  HB3     4.01            #peak    78 #SUP  0.82  #QF  0.41
  9 ARG  QB     10 GLY  H       3.92            #peak    79 #SUP  0.93  #QF  0.37
 43 LEU  H      43 LEU  HB2     4.01            #peak    82 #SUP  0.94  #QF  0.94
 19 ARG  QG     20 ARG  H       3.74            #peak    83 #SUP  0.82  #QF  0.37
 20 ARG  H      20 ARG  HG3     4.51            #peak    84 #SUP  0.99  #QF  0.91
 49 LYS  QG     50 GLN  H       4.38            #peak    84 #SUP  0.99  #QF  0.91
 13 ALA  H      13 ALA  QB      3.51            #peak    85 #SUP  0.91  #QF  0.91
 20 ARG  H      27 LEU  QD2     4.82            #peak    90 #SUP  0.83  #QF  0.77
 20 ARG  H      27 LEU  QD1     5.41            #peak    90 #SUP  0.83  #QF  0.77
 18 LEU  H      18 LEU  QD2     4.56            #peak    91 #SUP  0.87  #QF  0.87
 15 TYR  H      15 TYR  HD1     5.27            #peak    97 #SUP  0.97  #QF  0.92
 15 TYR  H      15 TYR  HD2     5.50            #peak    97 #SUP  0.97  #QF  0.92
 41 ARG  H      42 TRP  H       4.13            #peak   100 #SUP  0.97  #QF  0.97
 51 VAL  H      52 ARG  H       4.98            #peak   109 #SUP  0.88  #QF  0.81
 53 ASN  H      54 PHE  H       5.45            #peak   109 #SUP  0.88  #QF  0.81
 50 GLN  H      51 VAL  H       5.30            #peak   110 #SUP  0.96  #QF  0.37
 54 PHE  H      55 SER  H       4.56            #peak   111 #SUP  0.96  #QF  0.96
 46 SER  H      47 LYS  H       4.05            #peak   120 #SUP  0.99  #QF  0.61
 24 CYS- HA     26 ILE  H       4.86            #peak   127 #SUP  0.27  #QF  0.27
 32 ILE  HA     35 GLN  H       4.86            #peak   131 #SUP  1.00
 26 ILE  HA     27 LEU  H       3.04            #peak   140 #SUP  0.95  #QF  0.89
 36 HIS  H      37 GLN  HA      5.35            #peak   141 #SUP  0.85  #QF  0.85
 42 TRP  H      42 TRP  HB2     3.47            #peak   151 #SUP  0.94  #QF  0.77
 42 TRP  H      42 TRP  HB3     3.91            #peak   151 #SUP  0.94  #QF  0.77
 21 CYSZ HB3    25 GLY  H       4.01            #peak   152 #SUP  0.92  #QF  0.92
 15 TYR  H      15 TYR  HB3     4.04            #peak   153 #SUP  0.88  #QF  0.88
 15 TYR  H      15 TYR  HB2     4.04            #peak   154 #SUP  0.84  #QF  0.84
 36 HIS  H      36 HIS  HB3     3.67            #peak   155 #SUP  0.94  #QF  0.94
 33 LEU  H      33 LEU  HB2     3.78            #peak   159 #SUP  0.96  #QF  0.96
 26 ILE  H      26 ILE  HB      3.71            #peak   160 #SUP  0.68  #QF  0.68
 35 GLN  H      35 GLN  QB      3.44            #peak   161 #SUP  0.99  #QF  0.58
 38 GLU  H      38 GLU  HG3     4.32            #peak   163 #SUP  0.95  #QF  0.46
 35 GLN  QB     36 HIS  H       3.84            #peak   164 #SUP  0.83  #QF  0.83
 38 GLU  H      38 GLU  HB3     3.95            #peak   165 #SUP  0.34  #QF  0.34
 16 ASP  H      16 ASP  HB2     4.13            #peak   167 #SUP  0.80  #QF  0.44
 26 ILE  H      26 ILE  QG2     3.60            #peak   168 #SUP  0.91  #QF  0.91
 27 LEU  H      27 LEU  QB      3.44            #peak   172 #SUP  0.93  #QF  0.91
 44 ALA  QB     45 SER  H       3.80            #peak   172 #SUP  0.93  #QF  0.91
 14 ALA  QB     15 TYR  H       3.91            #peak   176 #SUP  0.78  #QF  0.78
 14 ALA  H      14 ALA  QB      3.56            #peak   177 #SUP  0.98  #QF  0.35
 28 LEU  HB3    33 LEU  H       3.71            #peak   177 #SUP  0.98  #QF  0.35
 26 ILE  HG13   27 LEU  H       4.63            #peak   178 #SUP  0.68  #QF  0.68
 26 ILE  QG2    36 HIS  HE1     3.66            #peak   179 #SUP  0.82  #QF  0.29
 26 ILE  HB     27 LEU  H       4.52            #peak   180 #SUP  0.86  #QF  0.82
 26 ILE  HB     36 HIS  HE1     5.02            #peak   180 #SUP  0.86  #QF  0.82
 17 ILE  H      17 ILE  HB      3.68            #peak   182 #SUP  0.89  #QF  0.89
 17 ILE  H      18 LEU  HG      4.03            #peak   183 #SUP  0.74  #QF  0.74
 17 ILE  H      17 ILE  QG2     4.06            #peak   185 #SUP  0.98  #QF  0.94
 42 TRP  HE3    43 LEU  HG      5.32            #peak   190 #SUP  0.69  #QF  0.56
 42 TRP  HE3    43 LEU  HA      4.41            #peak   193 #SUP  0.82  #QF  0.82
 42 TRP  HB3    42 TRP  HE3     3.84            #peak   194 #SUP  0.78  #QF  0.78
 54 PHE  HD1    55 SER  H       4.32            #peak   209 #SUP  0.40  #QF  0.40
 42 TRP  H      42 TRP  HD1     4.89            #peak   211 #SUP  0.83  #QF  0.83
 54 PHE  HA     54 PHE  HD1     4.90            #peak   224 #SUP  0.80  #QF  0.55
 54 PHE  HA     54 PHE  HD2     5.21            #peak   224 #SUP  0.80  #QF  0.55
 15 TYR  HA     15 TYR  HD1     4.65            #peak   228 #SUP  0.99  #QF  0.95
 15 TYR  HA     15 TYR  HD2     5.20            #peak   228 #SUP  0.99  #QF  0.95
 36 HIS  HD2    37 GLN  HA      3.41            #peak   229 #SUP  0.73  #QF  0.73
 42 TRP  HB2    42 TRP  HD1     3.66            #peak   231 #SUP  0.94  #QF  0.48
 32 ILE  H      32 ILE  HG13    4.21            #peak   245 #SUP  0.72  #QF  0.72
 38 GLU  HB2    39 LYS  H       4.35            #peak   251 #SUP  0.98  #QF  0.97
 39 LYS  H      39 LYS  QG      4.50            #peak   254 #SUP  0.45  #QF  0.45
 26 ILE  QG2    28 LEU  QD2     3.54            #peak   279 #SUP  0.99  #QF  0.94
 28 LEU  QD2    36 HIS  HB3     4.00            #peak   281 #SUP  0.75  #QF  0.75
 28 LEU  QD2    36 HIS  HB2     4.00            #peak   282 #SUP  0.94  #QF  0.94
 28 LEU  QD2    33 LEU  HA      3.61            #peak   283 #SUP  0.80  #QF  0.80
 28 LEU  HA     28 LEU  QD2     4.33            #peak   284 #SUP  0.92  #QF  0.29
 18 LEU  QD2    28 LEU  HA      3.72            #peak   285 #SUP  0.83  #QF  0.83
 18 LEU  HA     18 LEU  QD2     3.76            #peak   286 #SUP  0.77  #QF  0.63
 18 LEU  QD2    29 PRO  HA      3.88            #peak   286 #SUP  0.77  #QF  0.63
 26 ILE  HA     26 ILE  QD1     3.98            #peak   287 #SUP  0.94  #QF  0.89
 28 LEU  QD2    36 HIS  HD2     4.78            #peak   288 #SUP  0.90  #QF  0.90
 21 CYSZ HB3    26 ILE  QG2     4.17            #peak   293 #SUP  0.68  #QF  0.68
 26 ILE  QG2    26 ILE  HG12    3.72            #peak   299 #SUP  1.00  #QF  0.43
 18 LEU  HB3    27 LEU  QD2     3.87            #peak   305 #SUP  0.70  #QF  0.70
 27 LEU  QB     27 LEU  QD1     3.43            #peak   306 #SUP  0.95  #QF  0.24
 27 LEU  QB     27 LEU  QD2     3.27            #peak   307 #SUP  1.00  #QF  0.99
 27 LEU  HA     27 LEU  QD1     3.77            #peak   311 #SUP  0.84  #QF  0.70
 20 ARG  HA     27 LEU  QD1     4.09            #peak   313 #SUP  0.73  #QF  0.31
 21 CYSZ H      27 LEU  QD1     4.42            #peak   316 #SUP  0.26  #QF  0.26
 28 LEU  HA     28 LEU  QD1     3.23            #peak   317 #SUP  0.83  #QF  0.83
 29 PRO  HG3    32 ILE  QD1     3.70            #peak   320 #SUP  0.99  #QF  0.91
 18 LEU  QD1    27 LEU  QD2     2.79            #peak   327 #SUP  0.36  #QF  0.36
 17 ILE  QD1    18 LEU  QD2     3.42            #peak   329 #SUP  0.81  #QF  0.66
 51 VAL  HA     51 VAL  QG1     3.80            #peak   332 #SUP  1.00  #QF  0.94
 33 LEU  HA     33 LEU  QD1     4.69            #peak   333 #SUP  0.64  #QF  0.64
 29 PRO  HD2    32 ILE  QD1     3.90            #peak   334 #SUP  0.92  #QF  0.92
 19 ARG  H      33 LEU  QD2     5.12            #peak   339 #SUP  0.97  #QF  0.23
 30 LEU  H      32 ILE  QD1     4.11            #peak   340 #SUP  0.23  #QF  0.23
 43 LEU  H      43 LEU  QD1     4.83            #peak   344 #SUP  0.99  #QF  0.91
 16 ASP  H      17 ILE  QG2     4.75            #peak   349 #SUP  0.88  #QF  0.22
 50 GLN  HA     51 VAL  QG2     4.58            #peak   357 #SUP  0.39  #QF  0.39
 18 LEU  HB2    27 LEU  QB      4.03            #peak   362 #SUP  0.94  #QF  0.33
 32 ILE  QG2    32 ILE  HG13    3.82            #peak   364 #SUP  0.42  #QF  0.42
 26 ILE  HG12   28 LEU  QD1     4.08            #peak   366 #SUP  0.34  #QF  0.34
 28 LEU  HB2    28 LEU  QD2     3.72            #peak   371 #SUP  0.95  #QF  0.68
 28 LEU  HB3    28 LEU  QD2     3.77            #peak   372 #SUP  0.82  #QF  0.82
 26 ILE  HG13   28 LEU  QD1     4.08            #peak   373 #SUP  0.94  #QF  0.60
 26 ILE  QG2    28 LEU  HG      4.57            #peak   375 #SUP  0.81  #QF  0.69
 26 ILE  QD1    28 LEU  HG      5.05            #peak   375 #SUP  0.81  #QF  0.69
 18 LEU  HB3    18 LEU  QD1     3.76            #peak   393 #SUP  0.89  #QF  0.46
 18 LEU  QD1    27 LEU  QB      3.59            #peak   398 #SUP  0.97  #QF  0.24
 30 LEU  HA     33 LEU  HB3     3.81            #peak   405 #SUP  0.35  #QF  0.35
 39 LYS  HA     39 LYS  QD      4.20            #peak   411 #SUP  0.99  #QF  0.54
 29 PRO  HD2    32 ILE  HB      4.23            #peak   422 #SUP  1.00  #QF  0.97
 52 ARG  QB     52 ARG  QG      2.58            #peak   433 #SUP  0.84  #QF  0.84
 28 LEU  H      28 LEU  HG      4.71            #peak   518 #SUP  0.90  #QF  0.90
 20 ARG  HB2    21 CYSZ H       4.24            #peak   522 #SUP  0.96  #QF  0.29
 20 ARG  H      20 ARG  HG2     4.51            #peak   529 #SUP  0.85  #QF  0.85
 12 LYS  QD     13 ALA  H       4.09            #peak   530 #SUP  0.24  #QF  0.24
 28 LEU  HB2    33 LEU  H       4.64            #peak   538 #SUP  0.90  #QF  0.67
 26 ILE  H      26 ILE  HG12    4.82            #peak   541 #SUP  0.91  #QF  0.91
 38 GLU  H      38 GLU  HB2     3.95            #peak   545 #SUP  0.90  #QF  0.90
 47 LYS  H      47 LYS  QB      4.15            #peak   548 #SUP  0.92  #QF  0.88
 23 GLN  QB     23 GLN  HE21    4.65            #peak   553 #SUP  0.87  #QF  0.87
 38 GLU  HB3    39 LYS  H       4.35            #peak   565 #SUP  0.84  #QF  0.84
 47 LYS  QG     48 GLY  H       4.71            #peak   581 #SUP  0.79  #QF  0.79
 28 LEU  HB2    33 LEU  HB2     4.48            #peak   611 #SUP  0.98  #QF  0.97
  9 ARG  QB      9 ARG  QD      3.77            #peak   617 #SUP  0.98  #QF  0.41
 18 LEU  HB3    28 LEU  H       4.67            #peak   620 #SUP  0.95  #QF  0.42
 26 ILE  HG12   27 LEU  H       4.63            #peak   632 #SUP  0.90  #QF  0.90
 27 LEU  H      28 LEU  QD2     4.78            #peak   639 #SUP  0.96  #QF  0.79
 23 GLN  QB     23 GLN  HE22    4.65            #peak   643 #SUP  1.00
 28 LEU  HB2    29 PRO  HD2     4.07            #peak   649 #SUP  0.89  #QF  0.89
 27 LEU  QD1    28 LEU  QD2     4.78            #peak   650 #SUP  0.21  #QF  0.21
 26 ILE  QG2    28 LEU  QD1     3.29            #peak   651 #SUP  0.29  #QF  0.29
 33 LEU  HB2    33 LEU  QD1     4.05            #peak     1 #SUP  1.00
 19 ARG  HD2    20 ARG  H       4.54            #peak     4 #SUP  0.90  #QF  0.71
 34 ASN  QB     35 GLN  H       4.02            #peak    10 #SUP  0.98  #QF  0.98
 29 PRO  HD2    32 ILE  QG2     4.64            #peak    12 #SUP  0.83  #QF  0.83
 12 LYS  HA     12 LYS  QG      3.93            #peak   139 #SUP  0.99  #QF  0.84
 47 LYS  HA     47 LYS  QG      4.17            #peak   139 #SUP  0.99  #QF  0.84
  7 SER  HA      8 PRO  HD2     3.53            #peak   164 #SUP  0.95  #QF  0.95
  7 SER  HA      8 PRO  HD3     3.53            #peak   167 #SUP  0.92  #QF  0.92
 28 LEU  HA     29 PRO  HD3     3.82            #peak   174 #SUP  0.95  #QF  0.95
 13 ALA  QB     14 ALA  H       3.75            #peak   179 #SUP  1.00  #QF  0.35
 17 ILE  QD1    18 LEU  HB2     4.56            #peak   192 #SUP  0.84  #QF  0.84
 17 ILE  HB     17 ILE  QD1     3.74            #peak   196 #SUP  0.98  #QF  0.98
 17 ILE  HA     17 ILE  QD1     3.81            #peak   198 #SUP  0.84  #QF  0.84
 16 ASP  H      16 ASP  HB3     4.13            #peak   201 #SUP  0.94  #QF  0.94
 17 ILE  QG2    18 LEU  H       4.07            #peak   203 #SUP  0.98  #QF  0.98
 17 ILE  HA     17 ILE  QG2     3.58            #peak   205 #SUP  1.00
 17 ILE  QG2    18 LEU  HG      3.56            #peak   207 #SUP  1.00  #QF  0.99
 17 ILE  QG2    17 ILE  HG12    3.66            #peak   209 #SUP  0.97  #QF  0.97
 17 ILE  QG2    18 LEU  HB2     4.21            #peak   210 #SUP  0.88  #QF  0.88
 18 LEU  HB2    18 LEU  QD1     4.06            #peak   214 #SUP  0.63  #QF  0.63
 18 LEU  QD2    29 PRO  HB2     4.28            #peak   222 #SUP  0.97  #QF  0.97
 18 LEU  QD2    29 PRO  HD2     4.30            #peak   223 #SUP  0.96  #QF  0.96
 18 LEU  QD2    29 PRO  HD3     4.15            #peak   225 #SUP  0.99  #QF  0.99
 33 LEU  HB2    33 LEU  QD2     4.05            #peak   228 #SUP  0.85  #QF  0.85
 19 ARG  HD3    33 LEU  QD2     5.50            #peak   230 #SUP  0.92  #QF  0.92
 33 LEU  HA     33 LEU  QD2     4.69            #peak   231 #SUP  0.73  #QF  0.35
 18 LEU  QD1    27 LEU  HA      5.22            #peak   232 #SUP  0.91  #QF  0.88
 33 LEU  QD2    34 ASN  HA      5.50            #peak   232 #SUP  0.91  #QF  0.88
 19 ARG  HB2    33 LEU  QD1     4.79            #peak   233 #SUP  0.90  #QF  0.75
 19 ARG  HB2    33 LEU  QD2     4.79            #peak   233 #SUP  0.90  #QF  0.75
 19 ARG  HB3    33 LEU  QD1     4.79            #peak   236 #SUP  0.95  #QF  0.79
 19 ARG  HB3    33 LEU  QD2     4.79            #peak   236 #SUP  0.95  #QF  0.79
 19 ARG  HD2    33 LEU  QD1     5.50            #peak   237 #SUP  0.93  #QF  0.85
 19 ARG  HD2    33 LEU  QD2     5.50            #peak   237 #SUP  0.93  #QF  0.85
 19 ARG  HD3    33 LEU  QD1     5.50            #peak   238 #SUP  0.80  #QF  0.57
 19 ARG  HD3    20 ARG  H       4.54            #peak   246 #SUP  0.74  #QF  0.74
 18 LEU  QD1    28 LEU  H       5.18            #peak   249 #SUP  0.93  #QF  0.87
 18 LEU  QD2    19 ARG  H       4.00            #peak   251 #SUP  0.59  #QF  0.59
 21 CYSZ HB2    36 HIS  HD2     4.98            #peak   260 #SUP  0.79  #QF  0.79
 21 CYSZ HB2    25 GLY  H       4.51            #peak   261 #SUP  0.99  #QF  0.99
 21 CYSZ HB2    26 ILE  H       4.54            #peak   262 #SUP  0.92  #QF  0.92
 21 CYSZ HB3    26 ILE  H       4.39            #peak   268 #SUP  0.95  #QF  0.95
 21 CYSZ HB3    24 CYS- HA      4.63            #peak   273 #SUP  0.67  #QF  0.67
 26 ILE  QD1    27 LEU  H       3.90            #peak   291 #SUP  0.97  #QF  0.97
 26 ILE  H      26 ILE  QD1     4.70            #peak   292 #SUP  0.78  #QF  0.78
 27 LEU  QD2    28 LEU  H       5.37            #peak   298 #SUP  1.00
 27 LEU  QD1    28 LEU  H       5.50            #peak   298 #SUP  1.00
 26 ILE  HA     27 LEU  QB      4.34            #peak   304 #SUP  0.87  #QF  0.87
 26 ILE  QD1    28 LEU  QD2     3.72            #peak   308 #SUP  0.88  #QF  0.88
 26 ILE  QD1    28 LEU  QD1     3.53            #peak   309 #SUP  0.81  #QF  0.81
 26 ILE  HB     26 ILE  QD1     3.68            #peak   311 #SUP  0.99  #QF  0.99
 26 ILE  QG2    26 ILE  HG13    3.72            #peak   317 #SUP  0.99  #QF  0.99
 28 LEU  HB3    28 LEU  QD1     4.14            #peak   331 #SUP  0.72  #QF  0.72
 28 LEU  QD2    36 HIS  H       4.59            #peak   338 #SUP  0.95  #QF  0.95
 28 LEU  QD1    32 ILE  HB      4.03            #peak   344 #SUP  0.97  #QF  0.97
 28 LEU  QD1    33 LEU  HB2     4.49            #peak   346 #SUP  0.65  #QF  0.65
 28 LEU  QD1    29 PRO  HD2     3.70            #peak   347 #SUP  1.00
 28 LEU  QD1    29 PRO  HD3     3.83            #peak   350 #SUP  0.95  #QF  0.95
 26 ILE  HA     28 LEU  QD1     5.36            #peak   351 #SUP  0.95  #QF  0.95
 33 LEU  QD1    34 ASN  HA      5.50            #peak   354 #SUP  0.83  #QF  0.76
 28 LEU  QD1    36 HIS  H       5.39            #peak   361 #SUP  0.90  #QF  0.90
 28 LEU  HG     29 PRO  HD2     5.00            #peak   364 #SUP  0.97  #QF  0.87
 28 LEU  HB2    29 PRO  HD3     5.06            #peak   376 #SUP  0.74  #QF  0.59
 30 LEU  HA     30 LEU  QD1     4.35            #peak   387 #SUP  0.99  #QF  0.99
 30 LEU  H      30 LEU  HG      4.54            #peak   398 #SUP  0.89  #QF  0.89
 30 LEU  H      31 PRO  HD2     4.97            #peak   414 #SUP  0.99  #QF  0.99
 29 PRO  HG2    32 ILE  QD1     3.70            #peak   428 #SUP  1.00  #QF  0.97
 32 ILE  HB     32 ILE  QD1     4.04            #peak   428 #SUP  1.00  #QF  0.97
 29 PRO  HB3    32 ILE  QD1     4.63            #peak   430 #SUP  0.99  #QF  0.98
 31 PRO  HG3    32 ILE  QD1     4.84            #peak   430 #SUP  0.99  #QF  0.98
 32 ILE  HA     32 ILE  QD1     4.39            #peak   436 #SUP  0.94  #QF  0.94
 32 ILE  QG2    33 LEU  H       4.29            #peak   443 #SUP  0.97  #QF  0.97
 32 ILE  H      32 ILE  QG2     4.13            #peak   444 #SUP  1.00
 32 ILE  HA     32 ILE  QG2     3.48            #peak   447 #SUP  0.99  #QF  0.99
 35 GLN  HA     35 GLN  HG3     3.87            #peak   462 #SUP  0.98  #QF  0.84
 35 GLN  H      35 GLN  HG3     4.92            #peak   468 #SUP  0.99  #QF  0.97
 35 GLN  H      35 GLN  HG2     5.41            #peak   468 #SUP  0.99  #QF  0.97
 40 CYS- HB3    41 ARG  H       4.35            #peak   488 #SUP  0.84  #QF  0.84
 38 GLU  H      38 GLU  HG2     4.32            #peak   490 #SUP  0.93  #QF  0.93
 38 GLU  HA     38 GLU  HG2     4.24            #peak   494 #SUP  0.93  #QF  0.93
 38 GLU  HA     38 GLU  HG3     4.24            #peak   498 #SUP  0.96  #QF  0.96
 40 CYS- HB2    41 ARG  H       4.35            #peak   504 #SUP  0.97  #QF  0.97
 40 CYS- H      40 CYS- HB2     3.84            #peak   505 #SUP  0.99  #QF  0.99
 40 CYS- H      40 CYS- HB3     3.84            #peak   507 #SUP  1.00
 37 GLN  HA     40 CYS- HB2     4.30            #peak   509 #SUP  0.97  #QF  0.97
 37 GLN  HA     40 CYS- HB3     4.30            #peak   514 #SUP  0.64  #QF  0.64
 12 LYS  QG     12 LYS  QD      2.87            #peak   518 #SUP  1.00  #QF  0.99
 41 ARG  HA     41 ARG  QG      3.89            #peak   525 #SUP  0.99  #QF  0.99
 41 ARG  HA     44 ALA  QB      4.09            #peak   526 #SUP  0.81  #QF  0.81
 41 ARG  HA     41 ARG  QD      4.23            #peak   534 #SUP  0.98  #QF  0.98
 52 ARG  QB     52 ARG  QD      3.50            #peak   535 #SUP  0.99  #QF  0.39
 42 TRP  HA     42 TRP  HE3     4.40            #peak   537 #SUP  0.99  #QF  0.99
 42 TRP  HA     42 TRP  HD1     4.38            #peak   538 #SUP  0.94  #QF  0.94
 41 ARG  H      41 ARG  QG      4.57            #peak   541 #SUP  0.93  #QF  0.34
 42 TRP  HA     45 SER  QB      4.12            #peak   543 #SUP  0.46  #QF  0.46
 43 LEU  HB2    43 LEU  QD1     3.75            #peak   556 #SUP  1.00  #QF  0.99
 43 LEU  HB3    43 LEU  QD1     3.75            #peak   562 #SUP  1.00  #QF  0.60
 43 LEU  HB3    43 LEU  QD2     3.75            #peak   565 #SUP  0.99  #QF  0.83
 43 LEU  HB2    43 LEU  QD2     3.75            #peak   566 #SUP  0.99  #QF  0.99
 43 LEU  H      43 LEU  QD2     4.83            #peak   569 #SUP  0.98  #QF  0.98
 44 ALA  QB     45 SER  QB      4.19            #peak   574 #SUP  0.46  #QF  0.46
 44 ALA  H      44 ALA  QB      3.42            #peak   576 #SUP  0.99  #QF  0.99
 41 ARG  H      44 ALA  QB      4.73            #peak   577 #SUP  0.82  #QF  0.82
 49 LYS  HA     49 LYS  QD      4.08            #peak   591 #SUP  0.99  #QF  0.43
 12 LYS  QG     12 LYS  QE      4.04            #peak   594 #SUP  1.00  #QF  0.93
 50 GLN  HA     51 VAL  QG1     4.58            #peak   595 #SUP  0.85  #QF  0.41
 49 LYS  HA     49 LYS  QG      3.91            #peak   596 #SUP  0.97  #QF  0.97
 50 GLN  HA     51 VAL  H       3.38            #peak   601 #SUP  0.88  #QF  0.88
 51 VAL  HA     51 VAL  QG2     3.80            #peak   612 #SUP  0.97  #QF  0.97
  5 THR  HA      5 THR  QG2     3.82            #peak   628 #SUP  1.00
 21 CYSZ HB2    26 ILE  QG2     4.12            #peak   651 #SUP  0.97  #QF  0.97
 26 ILE  HA     26 ILE  QG2     3.55            #peak   659 #SUP  0.99  #QF  0.99
 26 ILE  QG2    27 LEU  HA      4.42            #peak   660 #SUP  0.97  #QF  0.97
 20 ARG  HA     27 LEU  HA      4.10            #peak   661 #SUP  0.57  #QF  0.57
 30 LEU  HA     30 LEU  QD2     4.35            #peak   669 #SUP  0.98  #QF  0.98
 29 PRO  HB2    32 ILE  QD1     4.47            #peak   670 #SUP  0.86  #QF  0.86
 28 LEU  QD2    32 ILE  QG2     3.92            #peak   671 #SUP  0.94  #QF  0.94
 28 LEU  QD1    32 ILE  QG2     3.65            #peak   672 #SUP  0.75  #QF  0.75
 32 ILE  QG2    32 ILE  HG12    3.82            #peak   673 #SUP  1.00
 28 LEU  HG     32 ILE  QG2     4.14            #peak   674 #SUP  0.91  #QF  0.63
 49 LYS  QD     50 GLN  H       3.60            #peak     7 #SUP  0.38  #QF  0.38
 20 ARG  H      27 LEU  HG      4.81            #peak     8 #SUP  0.75  #QF  0.55
 47 LYS  H      48 GLY  H       4.01            #peak    16 #SUP  0.41  #QF  0.41
 49 LYS  H      49 LYS  QD      4.44            #peak    43 #SUP  0.77  #QF  0.77
 45 SER  HA     47 LYS  H       4.26            #peak    57 #SUP  0.35  #QF  0.35
 47 LYS  H      47 LYS  QD      4.49            #peak    58 #SUP  0.68  #QF  0.68
 42 TRP  HB2    42 TRP  HE1     4.81            #peak    66 #SUP  0.79  #QF  0.79
 38 GLU  HA     42 TRP  H       4.21            #peak    72 #SUP  0.22  #QF  0.22
 39 LYS  QD     42 TRP  H       4.92            #peak    75 #SUP  0.47  #QF  0.47
 39 LYS  QG     43 LEU  H       4.64            #peak    81 #SUP  0.73  #QF  0.73
 39 LYS  QD     43 LEU  H       3.57            #peak    82 #SUP  0.68  #QF  0.68
 41 ARG  HA     43 LEU  H       4.77            #peak    88 #SUP  0.31  #QF  0.31
 39 LYS  HA     43 LEU  H       4.39            #peak    89 #SUP  0.90  #QF  0.90
 43 LEU  HG     44 ALA  H       4.75            #peak    93 #SUP  0.61  #QF  0.61
 39 LYS  HA     42 TRP  H       3.56            #peak    96 #SUP  0.70  #QF  0.70
 39 LYS  HA     41 ARG  H       4.51            #peak   104 #SUP  0.57  #QF  0.57
 32 ILE  QD1    33 LEU  H       4.60            #peak   110 #SUP  0.81  #QF  0.81
 33 LEU  H      33 LEU  HG      5.02            #peak   112 #SUP  0.71  #QF  0.44
 39 LYS  QD     40 CYS- H       5.22            #peak   112 #SUP  0.71  #QF  0.44
 33 LEU  H      33 LEU  HB3     3.54            #peak   113 #SUP  0.69  #QF  0.69
 39 LYS  QB     40 CYS- H       3.61            #peak   115 #SUP  0.61  #QF  0.61
 39 LYS  QE     40 CYS- H       4.12            #peak   119 #SUP  0.20  #QF  0.20
 35 GLN  HA     39 LYS  H       4.38            #peak   133 #SUP  0.47  #QF  0.47
 39 LYS  H      39 LYS  QB      3.68            #peak   135 #SUP  0.60  #QF  0.60
 35 GLN  HG3    39 LYS  H       5.50            #peak   138 #SUP  0.75  #QF  0.35
 35 GLN  HG2    39 LYS  H       5.50            #peak   138 #SUP  0.75  #QF  0.35
 38 GLU  H      39 LYS  QB      4.45            #peak   140 #SUP  0.59  #QF  0.59
 35 GLN  HA     38 GLU  H       3.79            #peak   146 #SUP  0.49  #QF  0.49
 35 GLN  HA     37 GLN  H       4.40            #peak   154 #SUP  0.84  #QF  0.84
 36 HIS  HB2    37 GLN  H       4.31            #peak   155 #SUP  0.93  #QF  0.93
 37 GLN  H      37 GLN  HB3     3.72            #peak   158 #SUP  0.88  #QF  0.88
 34 ASN  QB     37 GLN  H       4.97            #peak   160 #SUP  0.95  #QF  0.95
 36 HIS  H      36 HIS  HB2     3.67            #peak   165 #SUP  0.82  #QF  0.82
 31 PRO  HA     34 ASN  H       4.48            #peak   186 #SUP  0.45  #QF  0.45
 30 LEU  H      33 LEU  H       4.35            #peak   195 #SUP  0.36  #QF  0.36
 32 ILE  H      32 ILE  QD1     4.28            #peak   204 #SUP  0.98  #QF  0.98
 31 PRO  HG2    32 ILE  H       3.80            #peak   206 #SUP  0.42  #QF  0.42
 32 ILE  H      32 ILE  HG12    4.21            #peak   207 #SUP  0.79  #QF  0.79
 28 LEU  HB3    32 ILE  H       3.97            #peak   208 #SUP  0.33  #QF  0.33
 29 PRO  HB2    32 ILE  H       4.79            #peak   211 #SUP  0.79  #QF  0.79
 28 LEU  QD1    30 LEU  H       5.03            #peak   214 #SUP  0.25  #QF  0.25
 30 LEU  H      31 PRO  HG2     3.73            #peak   216 #SUP  0.52  #QF  0.52
 30 LEU  H      30 LEU  HB3     3.91            #peak   217 #SUP  0.95  #QF  0.95
 12 LYS  QG     13 ALA  H       3.71            #peak   228 #SUP  0.58  #QF  0.58
 19 ARG  HA     28 LEU  H       4.77            #peak   230 #SUP  0.78  #QF  0.78
 18 LEU  HA     28 LEU  H       4.54            #peak   232 #SUP  0.66  #QF  0.66
 28 LEU  H      28 LEU  QD1     3.69            #peak   234 #SUP  0.53  #QF  0.53
 18 LEU  QD2    28 LEU  H       4.21            #peak   235 #SUP  0.68  #QF  0.68
 27 LEU  QB     28 LEU  H       3.58            #peak   236 #SUP  0.67  #QF  0.67
 27 LEU  H      27 LEU  QD1     3.79            #peak   237 #SUP  0.95  #QF  0.90
 26 ILE  QG2    27 LEU  H       4.30            #peak   238 #SUP  1.00  #QF  0.99
 27 LEU  H      27 LEU  HG      4.25            #peak   240 #SUP  0.90  #QF  0.90
 23 GLN  H      26 ILE  H       5.50            #peak   244 #SUP  0.77  #QF  0.77
 24 CYS- QB     26 ILE  H       4.39            #peak   252 #SUP  0.61  #QF  0.61
 26 ILE  H      27 LEU  QD1     4.25            #peak   255 #SUP  0.71  #QF  0.71
 26 ILE  H      26 ILE  HG13    4.82            #peak   259 #SUP  0.99  #QF  0.99
 12 LYS  QB     14 ALA  H       4.08            #peak   261 #SUP  0.37  #QF  0.37
 24 CYS- QB     25 GLY  H       3.99            #peak   274 #SUP  0.97  #QF  0.97
 21 CYSZ HB2    24 CYS- H       4.13            #peak   282 #SUP  0.96  #QF  0.96
 22 SER  QB     24 CYS- H       5.27            #peak   286 #SUP  0.74  #QF  0.74
 12 LYS  QG     14 ALA  H       3.34            #peak   290 #SUP  0.50  #QF  0.50
 22 SER  QB     23 GLN  H       4.05            #peak   302 #SUP  0.55  #QF  0.55
 21 CYSZ HB2    23 GLN  H       4.41            #peak   306 #SUP  0.93  #QF  0.93
 15 TYR  H      17 ILE  H       4.42            #peak   317 #SUP  0.71  #QF  0.71
 16 ASP  H      18 LEU  H       4.64            #peak   318 #SUP  0.62  #QF  0.62
 21 CYSZ H      26 ILE  H       4.25            #peak   319 #SUP  0.97  #QF  0.97
 21 CYSZ H      24 CYS- QB      4.06            #peak   325 #SUP  0.76  #QF  0.76
 21 CYSZ H      26 ILE  QG2     4.10            #peak   328 #SUP  0.51  #QF  0.51
 21 CYSZ H      27 LEU  HG      4.96            #peak   332 #SUP  0.77  #QF  0.77
 19 ARG  H      27 LEU  HA      4.23            #peak   339 #SUP  0.95  #QF  0.95
 19 ARG  H      28 LEU  HA      4.68            #peak   340 #SUP  0.73  #QF  0.73
 19 ARG  H      29 PRO  HA      4.49            #peak   341 #SUP  0.57  #QF  0.57
 18 LEU  HB3    19 ARG  H       3.72            #peak   346 #SUP  0.91  #QF  0.91
 19 ARG  H      27 LEU  QB      3.96            #peak   347 #SUP  0.75  #QF  0.75
 19 ARG  H      28 LEU  HB2     4.11            #peak   348 #SUP  0.80  #QF  0.80
 17 ILE  HG12   18 LEU  H       4.55            #peak   352 #SUP  0.67  #QF  0.67
 18 LEU  H      18 LEU  HG      3.78            #peak   354 #SUP  0.62  #QF  0.62
 18 LEU  H      29 PRO  HA      5.14            #peak   358 #SUP  0.63  #QF  0.63
 14 ALA  HA     16 ASP  H       4.02            #peak   359 #SUP  0.78  #QF  0.36
 35 GLN  HG2    36 HIS  H       3.79            #peak   360 #SUP  0.45  #QF  0.45
 14 ALA  HA     17 ILE  H       4.65            #peak   367 #SUP  0.58  #QF  0.58
 17 ILE  H      17 ILE  HG12    4.51            #peak   370 #SUP  0.95  #QF  0.95
 17 ILE  H      18 LEU  HB2     4.55            #peak   371 #SUP  0.58  #QF  0.58
 13 ALA  H      14 ALA  H       3.70            #peak   377 #SUP  0.87  #QF  0.87
 14 ALA  H      15 TYR  H       3.56            #peak   380 #SUP  0.45  #QF  0.45
 15 TYR  H      16 ASP  H       3.64            #peak   382 #SUP  0.86  #QF  0.86
 16 ASP  H      17 ILE  H       3.43            #peak   386 #SUP  0.95  #QF  0.95
 17 ILE  H      18 LEU  H       3.97            #peak   389 #SUP  0.95  #QF  0.95
 18 LEU  H      19 ARG  H       4.71            #peak   391 #SUP  0.90  #QF  0.90
 19 ARG  H      20 ARG  H       4.50            #peak   394 #SUP  0.75  #QF  0.75
 21 CYSZ H      24 CYS- H       4.53            #peak   397 #SUP  0.98  #QF  0.98
 21 CYSZ H      25 GLY  H       4.09            #peak   398 #SUP  0.90  #QF  0.90
 22 SER  H      23 GLN  H       3.84            #peak   401 #SUP  0.93  #QF  0.93
 22 SER  H      24 CYS- H       4.36            #peak   402 #SUP  0.84  #QF  0.84
 22 SER  H      25 GLY  H       4.92            #peak   403 #SUP  0.58  #QF  0.58
 23 GLN  H      24 CYS- H       3.52            #peak   406 #SUP  0.99  #QF  0.99
 24 CYS- H      25 GLY  H       3.42            #peak   410 #SUP  0.94  #QF  0.94
 24 CYS- H      26 ILE  H       4.23            #peak   411 #SUP  0.97  #QF  0.97
 23 GLN  H      25 GLY  H       4.11            #peak   412 #SUP  0.98  #QF  0.98
 25 GLY  H      26 ILE  H       3.76            #peak   415 #SUP  0.98  #QF  0.98
 26 ILE  H      27 LEU  H       4.77            #peak   418 #SUP  0.99  #QF  0.99
 19 ARG  H      28 LEU  H       3.06            #peak   421 #SUP  0.93  #QF  0.93
 27 LEU  H      28 LEU  H       4.53            #peak   422 #SUP  1.00
 32 ILE  H      34 ASN  H       4.62            #peak   426 #SUP  0.94  #QF  0.94
 32 ILE  H      33 LEU  H       3.33            #peak   427 #SUP  0.99  #QF  0.99
 34 ASN  H      35 GLN  H       4.25            #peak   432 #SUP  0.62  #QF  0.62
 33 LEU  H      34 ASN  H       3.84            #peak   433 #SUP  0.86  #QF  0.69
 35 GLN  H      37 GLN  H       4.40            #peak   436 #SUP  0.83  #QF  0.83
 37 GLN  H      38 GLU  H       3.70            #peak   438 #SUP  0.96  #QF  0.96
 37 GLN  H      40 CYS- H       4.83            #peak   439 #SUP  0.34  #QF  0.34
 36 HIS  H      37 GLN  H       3.36            #peak   440 #SUP  0.97  #QF  0.97
 36 HIS  HD2    37 GLN  H       4.31            #peak   444 #SUP  0.94  #QF  0.89
 37 GLN  H      39 LYS  H       4.71            #peak   444 #SUP  0.94  #QF  0.89
 38 GLU  H      39 LYS  H       3.39            #peak   445 #SUP  0.99  #QF  0.99
 39 LYS  H      40 CYS- H       3.57            #peak   447 #SUP  0.98  #QF  0.98
 38 GLU  H      40 CYS- H       4.59            #peak   448 #SUP  0.93  #QF  0.93
 39 LYS  H      41 ARG  H       4.28            #peak   451 #SUP  0.86  #QF  0.86
 40 CYS- H      41 ARG  H       4.10            #peak   452 #SUP  0.87  #QF  0.87
 40 CYS- H      42 TRP  H       4.60            #peak   454 #SUP  0.81  #QF  0.81
 42 TRP  H      43 LEU  H       3.70            #peak   460 #SUP  0.96  #QF  0.84
 43 LEU  H      44 ALA  H       3.96            #peak   460 #SUP  0.96  #QF  0.84
 44 ALA  H      45 SER  H       4.13            #peak   463 #SUP  0.90  #QF  0.90
  3 GLU  QB      4 PHE  H       3.88            #peak    40
  4 PHE  H       4 PHE  QB      3.67            #peak   336
  8 PRO  QB      9 ARG  H       4.08            #peak   130
 15 TYR  H      15 TYR  QB      3.40            #peak   154
 18 LEU  QD2    29 PRO  QG      4.16            #peak   220
 19 ARG  H      19 ARG  QB      3.44            #peak    39
 19 ARG  H      33 LEU  QQD     4.29            #peak    45
 19 ARG  HA     19 ARG  QD      4.08            #peak   644
 19 ARG  QB     20 ARG  H       4.26            #peak   247
 19 ARG  QB     33 LEU  QQD     3.69            #peak   236
 19 ARG  QD     20 ARG  H       3.98            #peak     4
 19 ARG  QD     20 ARG  QB      5.13            #peak   645
 19 ARG  QD     33 LEU  QQD     3.81            #peak   230
 20 ARG  H      20 ARG  QB      3.46            #peak   528
 20 ARG  H      20 ARG  QG      3.88            #peak    84
 20 ARG  HA     20 ARG  QG      3.72            #peak   570
 20 ARG  HA     33 LEU  QQD     4.87            #peak   454
 20 ARG  QB     20 ARG  QD      3.32            #peak   621
 20 ARG  QB     21 CYSZ H       3.71            #peak   522
 20 ARG  QB     25 GLY  H       5.24            #peak   277
 20 ARG  QB     27 LEU  HG      3.67            #peak   243
 20 ARG  QD     27 LEU  QD1     4.52            #peak   635
 20 ARG  QD     27 LEU  QD2     4.40            #peak   294
 21 CYSZ HB2    33 LEU  QQD     4.38            #peak   650
 23 GLN  QB     23 GLN  QE2     3.84            #peak   553
 23 GLN  QE2    44 ALA  QB      4.29            #peak   566
 26 ILE  H      26 ILE  QG1     4.23            #peak   259
 26 ILE  QG1    27 LEU  H       4.01            #peak   178
 26 ILE  QG1    28 LEU  QD1     3.52            #peak   366
 27 LEU  HA     33 LEU  QQD     4.74            #peak   354
 28 LEU  H      33 LEU  QQD     3.94            #peak   342
 28 LEU  HB2    33 LEU  QQD     4.34            #peak   325
 28 LEU  HB3    33 LEU  QQD     4.15            #peak   330
 28 LEU  QD2    33 LEU  QQD     3.36            #peak   328
 28 LEU  QD2    36 HIS  QB      3.48            #peak   281
 29 PRO  HB2    31 PRO  QD      3.12            #peak   588
 29 PRO  QG     32 ILE  H       4.30            #peak   241
 29 PRO  HD3    32 ILE  QG1     5.34            #peak   376
 30 LEU  H      30 LEU  QB      3.39            #peak   217
 30 LEU  H      30 LEU  QQD     4.64            #peak   395
 30 LEU  H      31 PRO  QB      5.34            #peak   219
 30 LEU  H      31 PRO  QD      4.18            #peak   414
 30 LEU  HA     30 LEU  QQD     3.51            #peak   669
 30 LEU  HA     33 LEU  QQD     4.35            #peak   231
 30 LEU  QB     31 PRO  QD      3.25            #peak   375
 30 LEU  QQD    31 PRO  QD      4.19            #peak   564
 31 PRO  QB     32 ILE  H       3.93            #peak   243
 31 PRO  QD     32 ILE  H       4.32            #peak   476
 31 PRO  QD     32 ILE  QD1     4.27            #peak   489
 32 ILE  H      32 ILE  QG1     3.57            #peak   207
 32 ILE  HA     32 ILE  QG1     3.73            #peak   407
 33 LEU  H      33 LEU  QQD     4.06            #peak   359
 33 LEU  HA     33 LEU  QQD     3.33            #peak   333
 33 LEU  QQD    34 ASN  HA      4.84            #peak   354
 33 LEU  QQD    36 HIS  H       5.10            #peak   349
 33 LEU  QQD    36 HIS  QB      3.91            #peak   348
 33 LEU  QQD    36 HIS  HD2     3.71            #peak   249
 33 LEU  QQD    37 GLN  QG      5.00            #peak   229
 33 LEU  QQD    37 GLN  QE2     4.19            #peak   351
 34 ASN  HA     37 GLN  QE2     5.34            #peak   586
 34 ASN  QB     37 GLN  QB      4.98            #peak   475
 34 ASN  QD2    35 GLN  H       5.25            #peak   175
 35 GLN  H      35 GLN  QE2     5.34            #peak   175
 35 GLN  H      38 GLU  QG      4.37            #peak   181
 36 HIS  H      38 GLU  QG      4.88            #peak   163
 36 HIS  QB     37 GLN  H       3.57            #peak   155
 36 HIS  HD2    37 GLN  QB      5.19            #peak   239
 36 HIS  HD2    37 GLN  QE2     3.90            #peak   270
 36 HIS  HD2    40 CYS- QB      3.32            #peak   238
 37 GLN  H      38 GLU  QG      4.82            #peak   157
 37 GLN  HA     40 CYS- QB      3.62            #peak   509
 37 GLN  QB     37 GLN  QE2     4.37            #peak   645
 37 GLN  QB     38 GLU  H       3.29            #peak   142
 38 GLU  H      38 GLU  QB      3.23            #peak   165
 38 GLU  QB     39 LYS  H       3.82            #peak   251
 38 GLU  QG     39 LYS  H       3.84            #peak   137
 39 LYS  H      40 CYS- QB      4.99            #peak   506
 39 LYS  H      41 ARG  QB      4.78            #peak   563
 41 ARG  QB     41 ARG  QD      3.62            #peak   532
 41 ARG  QB     44 ALA  QB      5.23            #peak   571
 42 TRP  HE3    43 LEU  QB      4.71            #peak   190
 42 TRP  HE3    43 LEU  QQD     3.96            #peak   568
 42 TRP  HZ3    43 LEU  QQD     4.02            #peak   347
 43 LEU  H      43 LEU  QQD     3.94            #peak   569
 43 LEU  HA     43 LEU  QQD     3.38            #peak   567
 43 LEU  QB     44 ALA  H       3.39            #peak    76
 43 LEU  QB     44 ALA  QB      5.34            #peak   571
 43 LEU  QB     45 SER  H       4.90            #peak    60
 50 GLN  HA     51 VAL  QQG     3.94            #peak   357
 51 VAL  H      51 VAL  QQG     4.25            #peak   613
 51 VAL  QQG    52 ARG  H       4.48            #peak   610
 21 CYSZ  ZN      24 CYS- SG       2.50  5E01
 21 CYSZ  ZN      36 HIS  NE2      2.50  5E01
 21 CYSZ  ZN      40 CYS- SG       2.50  5E01
 21 CYSZ  SG      24 CYS- SG       4.00  5E01
 21 CYSZ  SG      36 HIS  NE2      4.00  5E01
 21 CYSZ  SG      40 CYS- SG       4.00  5E01
 24 CYS-  SG      36 HIS  NE2      4.00  5E01
 24 CYS-  SG      40 CYS- SG       4.00  5E01
 36 HIS   NE2     40 CYS- SG       4.00  5E01


 28 LEU  O      19 ARG  H       2.00 
 28 LEU  O      19 ARG  N       3.00 
 33 LEU  O      37 GLN  H       2.00 
 33 LEU  O      37 GLN  N       3.00 
 34 ASN  O      38 GLU  H       2.00 
 34 ASN  O      38 GLU  N       3.00 
 35 GLN  O      39 LYS  H       2.00 
 35 GLN  O      39 LYS  N       3.00 
 36 HIS  O      40 CYS-  H       2.00 
 36 HIS  O      40 CYS-  N       3.00 
 37 GLN  O      41 ARG  H       2.00 
 37 GLN  O      41 ARG  N       3.00 
 38 GLU  O      42 TRP  H       2.00 
 38 GLU  O      42 TRP  N       3.00 
 39 LYS  O      43 LEU  H       2.00 
 39 LYS  O      43 LEU  N       3.00 
 40 CYS-  O      44 ALA  H       2.00 
 40 CYS-  O      44 ALA  N       3.00 
 41 ARG  O      45 SER  H       2.00 
 41 ARG  O      45 SER  N       3.00
 42 TRP  O      46 SER  H       2.00 
 42 TRP  O      46 SER  N       3.00 
 43 LEU  O      47 LYS  H       2.00 
 43 LEU  O      47 LYS  N       3.00 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H1       GLY   1  21.603 -17.307  -1.351
    2    H2   GLY   1           H2       GLY   1  20.060 -17.847  -1.407
    3    H3   GLY   1           H3       GLY   1  21.276 -18.880  -1.041
    4    HA2  GLY   1           HA2      GLY   1  20.155 -18.385   0.974
    5    HA3  GLY   1           HA3      GLY   1  21.756 -17.619   0.991
    6    H    SER   2           H        SER   2  19.618 -16.807   2.600
    7    HA   SER   2           HA       SER   2  19.096 -14.020   1.642
    8    HB2  SER   2           HB2      SER   2  17.138 -15.812   3.127
    9    HB3  SER   2           HB3      SER   2  16.872 -14.117   2.691
   10    HG   SER   2           HG       SER   2  16.974 -14.691   0.502
   11    H    GLU   3           H        GLU   3  21.222 -15.073   3.301
   12    HA   GLU   3           HA       GLU   3  20.898 -14.295   6.060
   13    HB2  GLU   3           HB2      GLU   3  23.275 -14.594   6.193
   14    HB3  GLU   3           HB3      GLU   3  22.608 -15.878   5.193
   15    HG2  GLU   3           HG2      GLU   3  23.278 -14.490   3.144
   16    HG3  GLU   3           HG3      GLU   3  24.134 -13.413   4.248
   17    H    PHE   4           H        PHE   4  22.523 -12.620   6.956
   18    HA   PHE   4           HA       PHE   4  22.512 -10.048   5.445
   19    HB2  PHE   4           HB2      PHE   4  21.737 -10.400   8.363
   20    HB3  PHE   4           HB3      PHE   4  21.843  -8.876   7.497
   21    HD1  PHE   4           HD1      PHE   4  20.375  -8.852   5.183
   22    HD2  PHE   4           HD2      PHE   4  19.558 -11.210   8.704
   23    HE1  PHE   4           HE1      PHE   4  17.981  -8.989   4.539
   24    HE2  PHE   4           HE2      PHE   4  17.163 -11.336   8.059
   25    HZ   PHE   4           HZ       PHE   4  16.372 -10.229   5.975
   26    H    THR   5           H        THR   5  23.865  -8.406   6.959
   27    HA   THR   5           HA       THR   5  25.979  -7.747   7.454
   28    HB   THR   5           HB       THR   5  26.448 -10.294   9.005
   29    HG1  THR   5           HG1      THR   5  25.208  -9.425  10.652
   30   HG21  THR   5          HG21      THR   5  27.464  -8.773  10.619
   31   HG22  THR   5          HG22      THR   5  26.925  -7.358   9.695
   32   HG23  THR   5          HG23      THR   5  28.169  -8.433   9.040
   33    H    SER   6           H        SER   6  25.810  -8.832   4.964
   34    HA   SER   6           HA       SER   6  28.429 -10.206   4.502
   35    HB2  SER   6           HB2      SER   6  27.321 -11.480   2.718
   36    HB3  SER   6           HB3      SER   6  26.595 -11.790   4.298
   37    HG   SER   6           HG       SER   6  24.770 -10.979   3.615
   38    H    SER   7           H        SER   7  27.391  -7.287   4.246
   39    HA   SER   7           HA       SER   7  28.165  -6.744   1.415
   40    HB2  SER   7           HB2      SER   7  26.709  -4.722   1.670
   41    HB3  SER   7           HB3      SER   7  25.839  -6.257   1.802
   42    HG   SER   7           HG       SER   7  25.230  -4.764   3.442
   43    HA   PRO   8           HA       PRO   8  31.482  -4.227   2.929
   44    HB2  PRO   8           HB2      PRO   8  31.700  -2.222   1.067
   45    HB3  PRO   8           HB3      PRO   8  32.155  -3.923   0.754
   46    HG2  PRO   8           HG2      PRO   8  29.556  -2.532   0.044
   47    HG3  PRO   8           HG3      PRO   8  30.577  -3.574  -0.997
   48    HD2  PRO   8           HD2      PRO   8  28.384  -4.536   0.285
   49    HD3  PRO   8           HD3      PRO   8  29.854  -5.535   0.099
   50    H    ARG   9           H        ARG   9  31.567  -2.877   4.582
   51    HA   ARG   9           HA       ARG   9  30.153  -0.320   4.708
   52    HB2  ARG   9           HB2      ARG   9  28.632  -2.359   5.555
   53    HB3  ARG   9           HB3      ARG   9  29.600  -2.214   7.020
   54    HG2  ARG   9           HG2      ARG   9  28.845   0.111   7.309
   55    HG3  ARG   9           HG3      ARG   9  28.096   0.097   5.701
   56    HD2  ARG   9           HD2      ARG   9  26.583  -1.758   6.489
   57    HD3  ARG   9           HD3      ARG   9  27.219  -1.544   8.118
   58    HE   ARG   9           HE       ARG   9  25.410   0.236   6.602
   59   HH11  ARG   9          HH11      ARG   9  27.358   0.025   9.508
   60   HH12  ARG   9          HH12      ARG   9  26.564   1.392  10.242
   61   HH21  ARG   9          HH21      ARG   9  24.446   1.955   7.589
   62   HH22  ARG   9          HH22      ARG   9  24.948   2.451   9.177
   63    H    GLY  10           H        GLY  10  30.767   0.864   6.775
   64    HA2  GLY  10           HA2      GLY  10  33.581   0.952   7.111
   65    HA3  GLY  10           HA3      GLY  10  32.404   1.732   8.164
   66    H    ASP  11           H        ASP  11  34.887   0.613   8.988
   67    HA   ASP  11           HA       ASP  11  34.116  -1.773  10.634
   68    HB2  ASP  11           HB2      ASP  11  36.808  -0.806   9.606
   69    HB3  ASP  11           HB3      ASP  11  36.619  -2.054  10.833
   70    H    LYS  12           H        LYS  12  34.078  -1.634  12.751
   71    HA   LYS  12           HA       LYS  12  35.575   0.331  14.322
   72    HB2  LYS  12           HB2      LYS  12  33.261   1.333  13.457
   73    HB3  LYS  12           HB3      LYS  12  32.563   0.314  14.717
   74    HG2  LYS  12           HG2      LYS  12  34.227   1.496  16.323
   75    HG3  LYS  12           HG3      LYS  12  34.564   2.605  15.005
   76    HD2  LYS  12           HD2      LYS  12  31.797   2.147  16.239
   77    HD3  LYS  12           HD3      LYS  12  32.937   3.382  16.742
   78    HE2  LYS  12           HE2      LYS  12  31.490   4.559  15.393
   79    HE3  LYS  12           HE3      LYS  12  32.900   4.303  14.369
   80    HZ1  LYS  12           HZ1      LYS  12  30.779   3.877  13.222
   81    HZ2  LYS  12           HZ2      LYS  12  30.396   2.687  14.265
   82    HZ3  LYS  12           HZ3      LYS  12  31.673   2.519  13.249
   83    H    ALA  13           H        ALA  13  35.204  -0.075  16.685
   84    HA   ALA  13           HA       ALA  13  34.429  -2.895  17.319
   85    HB1  ALA  13           HB1      ALA  13  36.875  -2.544  17.208
   86    HB2  ALA  13           HB2      ALA  13  36.747  -1.265  18.437
   87    HB3  ALA  13           HB3      ALA  13  36.340  -2.946  18.847
   88    H    ALA  14           H        ALA  14  32.924  -0.253  17.566
   89    HA   ALA  14           HA       ALA  14  32.061  -0.545  20.410
   90    HB1  ALA  14           HB1      ALA  14  32.502   2.068  18.901
   91    HB2  ALA  14           HB2      ALA  14  31.933   1.898  20.574
   92    HB3  ALA  14           HB3      ALA  14  33.579   1.402  20.150
   93    H    TYR  15           H        TYR  15  30.958  -1.304  17.537
   94    HA   TYR  15           HA       TYR  15  28.493   0.184  17.270
   95    HB2  TYR  15           HB2      TYR  15  27.951  -1.405  15.544
   96    HB3  TYR  15           HB3      TYR  15  29.604  -0.863  15.369
   97    HD1  TYR  15           HD2      TYR  15  27.419  -3.731  16.203
   98    HD2  TYR  15           HD1      TYR  15  31.493  -2.421  15.622
   99    HE1  TYR  15           HE2      TYR  15  28.172  -6.104  16.072
  100    HE2  TYR  15           HE1      TYR  15  32.241  -4.785  15.516
  101    HH   TYR  15           HH       TYR  15  31.610  -6.992  15.573
  102    H    ASP  16           H        ASP  16  29.360  -2.115  19.587
  103    HA   ASP  16           HA       ASP  16  26.714  -3.331  19.950
  104    HB2  ASP  16           HB2      ASP  16  27.773  -4.574  21.698
  105    HB3  ASP  16           HB3      ASP  16  28.821  -4.598  20.285
  106    H    ILE  17           H        ILE  17  28.589  -0.661  21.416
  107    HA   ILE  17           HA       ILE  17  26.615  -0.326  23.587
  108    HB   ILE  17           HB       ILE  17  28.844   0.069  24.176
  109   HG12  ILE  17          HG12      ILE  17  26.967   1.542  25.101
  110   HG13  ILE  17          HG13      ILE  17  28.637   1.935  25.448
  111   HG21  ILE  17          HG21      ILE  17  29.089   2.178  22.006
  112   HG22  ILE  17          HG22      ILE  17  30.243   1.928  23.330
  113   HG23  ILE  17          HG23      ILE  17  29.977   0.643  22.159
  114   HD11  ILE  17          HD11      ILE  17  27.274   3.940  25.008
  115   HD12  ILE  17          HD12      ILE  17  28.629   3.798  23.881
  116   HD13  ILE  17          HD13      ILE  17  26.983   3.405  23.350
  117    H    LEU  18           H        LEU  18  27.474   1.306  20.530
  118    HA   LEU  18           HA       LEU  18  25.473   3.369  20.691
  119    HB2  LEU  18           HB2      LEU  18  26.701   2.020  18.248
  120    HB3  LEU  18           HB3      LEU  18  25.789   3.525  18.236
  121    HG   LEU  18           HG       LEU  18  28.497   3.098  19.571
  122   HD11  LEU  18          HD11      LEU  18  27.689   4.717  17.122
  123   HD12  LEU  18          HD12      LEU  18  28.557   3.163  17.101
  124   HD13  LEU  18          HD13      LEU  18  29.321   4.592  17.816
  125   HD21  LEU  18          HD21      LEU  18  28.481   5.584  19.841
  126   HD22  LEU  18          HD22      LEU  18  27.300   4.755  20.849
  127   HD23  LEU  18          HD23      LEU  18  26.766   5.596  19.369
  128    H    ARG  19           H        ARG  19  23.476   3.542  19.658
  129    HA   ARG  19           HA       ARG  19  22.118   1.021  18.760
  130    HB2  ARG  19           HB2      ARG  19  21.402   1.829  21.063
  131    HB3  ARG  19           HB3      ARG  19  20.889   3.334  20.318
  132    HG2  ARG  19           HG2      ARG  19  18.938   1.968  20.645
  133    HG3  ARG  19           HG3      ARG  19  19.230   2.062  18.922
  134    HD2  ARG  19           HD2      ARG  19  18.594  -0.193  19.511
  135    HD3  ARG  19           HD3      ARG  19  20.289  -0.211  19.010
  136    HE   ARG  19           HE       ARG  19  20.003   0.129  21.881
  137   HH11  ARG  19          HH11      ARG  19  19.906  -2.397  19.453
  138   HH12  ARG  19          HH12      ARG  19  20.377  -3.628  20.592
  139   HH21  ARG  19          HH21      ARG  19  20.603  -1.484  23.272
  140   HH22  ARG  19          HH22      ARG  19  20.751  -3.119  22.699
  141    H    ARG  20           H        ARG  20  20.790   1.207  17.005
  142    HA   ARG  20           HA       ARG  20  20.721   3.796  15.519
  143    HB2  ARG  20           HB2      ARG  20  21.137   2.624  13.439
  144    HB3  ARG  20           HB3      ARG  20  22.449   2.343  14.580
  145    HG2  ARG  20           HG2      ARG  20  21.534   0.095  15.108
  146    HG3  ARG  20           HG3      ARG  20  20.252   0.346  13.903
  147    HD2  ARG  20           HD2      ARG  20  21.906   0.542  12.119
  148    HD3  ARG  20           HD3      ARG  20  23.235   0.484  13.295
  149    HE   ARG  20           HE       ARG  20  21.679  -1.865  13.630
  150   HH11  ARG  20          HH11      ARG  20  23.818  -0.547  11.189
  151   HH12  ARG  20          HH12      ARG  20  24.350  -2.126  10.674
  152   HH21  ARG  20          HH21      ARG  20  22.410  -3.844  12.932
  153   HH22  ARG  20          HH22      ARG  20  23.566  -3.938  11.637
  154    H    CYS  21           H        CYS  21  19.032   4.083  14.049
  155    HA   CYS  21           HA       CYS  21  16.501   2.724  14.877
  156    HB2  CYS  21           HB2      CYS  21  16.801   5.050  15.613
  157    HB3  CYS  21           HB3      CYS  21  17.041   5.554  13.935
  158    H    SER  22           H        SER  22  15.662   1.455  13.425
  159    HA   SER  22           HA       SER  22  16.615   1.054  10.806
  160    HB2  SER  22           HB2      SER  22  15.397  -0.555  12.361
  161    HB3  SER  22           HB3      SER  22  13.888   0.215  11.851
  162    HG   SER  22           HG       SER  22  15.787  -1.205  10.253
  163    H    GLN  23           H        GLN  23  14.402   3.480  11.807
  164    HA   GLN  23           HA       GLN  23  13.491   3.959   8.991
  165    HB2  GLN  23           HB2      GLN  23  12.129   4.623  11.625
  166    HB3  GLN  23           HB3      GLN  23  11.582   5.176  10.038
  167    HG2  GLN  23           HG2      GLN  23  11.385   2.786   9.298
  168    HG3  GLN  23           HG3      GLN  23  11.773   2.273  10.943
  169   HE21  GLN  23          HE21      GLN  23  10.134   2.513  12.603
  170   HE22  GLN  23          HE22      GLN  23   8.494   2.984  12.178
  171    H    CYS  24           H        CYS  24  15.719   5.155  11.187
  172    HA   CYS  24           HA       CYS  24  15.541   7.920  10.040
  173    HB2  CYS  24           HB2      CYS  24  16.534   7.243  12.812
  174    HB3  CYS  24           HB3      CYS  24  16.203   8.828  12.125
  175    H    GLY  25           H        GLY  25  17.710   5.253  10.892
  176    HA2  GLY  25           HA2      GLY  25  19.802   4.755  10.126
  177    HA3  GLY  25           HA3      GLY  25  19.748   6.178   9.089
  178    H    ILE  26           H        ILE  26  19.297   7.404  12.126
  179    HA   ILE  26           HA       ILE  26  22.070   8.274  12.458
  180    HB   ILE  26           HB       ILE  26  20.185   9.797  12.738
  181   HG12  ILE  26          HG12      ILE  26  21.631   9.496  15.396
  182   HG13  ILE  26          HG13      ILE  26  22.376  10.136  13.926
  183   HG21  ILE  26          HG21      ILE  26  18.675   9.712  14.659
  184   HG22  ILE  26          HG22      ILE  26  18.509   8.244  13.710
  185   HG23  ILE  26          HG23      ILE  26  19.421   8.205  15.226
  186   HD11  ILE  26          HD11      ILE  26  20.033  11.350  15.444
  187   HD12  ILE  26          HD12      ILE  26  21.682  11.976  15.313
  188   HD13  ILE  26          HD13      ILE  26  20.640  11.943  13.877
  189    H    LEU  27           H        LEU  27  23.290   8.038  14.443
  190    HA   LEU  27           HA       LEU  27  22.708   5.579  16.033
  191    HB2  LEU  27           HB2      LEU  27  25.400   6.573  14.997
  192    HB3  LEU  27           HB3      LEU  27  25.195   5.395  16.282
  193    HG   LEU  27           HG       LEU  27  23.829   4.004  14.588
  194   HD11  LEU  27          HD11      LEU  27  25.396   5.774  12.658
  195   HD12  LEU  27          HD12      LEU  27  23.631   5.614  12.737
  196   HD13  LEU  27          HD13      LEU  27  24.602   4.241  12.231
  197   HD21  LEU  27          HD21      LEU  27  26.033   3.365  15.460
  198   HD22  LEU  27          HD22      LEU  27  26.828   4.390  14.242
  199   HD23  LEU  27          HD23      LEU  27  25.898   2.955  13.747
  200    H    LEU  28           H        LEU  28  22.674   5.841  18.173
  201    HA   LEU  28           HA       LEU  28  23.793   8.327  19.422
  202    HB2  LEU  28           HB2      LEU  28  21.187   6.912  20.128
  203    HB3  LEU  28           HB3      LEU  28  21.893   8.245  21.002
  204    HG   LEU  28           HG       LEU  28  20.143   9.186  19.886
  205   HD11  LEU  28          HD11      LEU  28  22.269  10.475  19.602
  206   HD12  LEU  28          HD12      LEU  28  21.008  10.829  18.404
  207   HD13  LEU  28          HD13      LEU  28  22.388   9.819  17.959
  208   HD21  LEU  28          HD21      LEU  28  19.636   7.350  18.323
  209   HD22  LEU  28          HD22      LEU  28  20.917   7.928  17.240
  210   HD23  LEU  28          HD23      LEU  28  19.517   8.954  17.586
  211    HA   PRO  29           HA       PRO  29  25.729   5.407  22.163
  212    HB2  PRO  29           HB2      PRO  29  26.350   6.937  24.353
  213    HB3  PRO  29           HB3      PRO  29  27.155   7.088  22.766
  214    HG2  PRO  29           HG2      PRO  29  24.907   8.788  23.872
  215    HG3  PRO  29           HG3      PRO  29  26.401   9.321  23.049
  216    HD2  PRO  29           HD2      PRO  29  24.009   9.082  21.742
  217    HD3  PRO  29           HD3      PRO  29  25.565   8.728  20.940
  218    H    LEU  30           H        LEU  30  23.693   7.405  24.354
  219    HA   LEU  30           HA       LEU  30  21.861   5.299  25.036
  220    HB2  LEU  30           HB2      LEU  30  23.640   4.254  26.197
  221    HB3  LEU  30           HB3      LEU  30  24.229   5.754  26.870
  222    HG   LEU  30           HG       LEU  30  22.236   5.869  28.363
  223   HD11  LEU  30          HD11      LEU  30  21.552   3.131  27.196
  224   HD12  LEU  30          HD12      LEU  30  20.584   4.609  27.008
  225   HD13  LEU  30          HD13      LEU  30  20.780   3.887  28.607
  226   HD21  LEU  30          HD21      LEU  30  24.323   4.767  29.092
  227   HD22  LEU  30          HD22      LEU  30  23.722   3.214  28.472
  228   HD23  LEU  30          HD23      LEU  30  22.895   4.020  29.824
  229    HA   PRO  31           HA       PRO  31  20.701   8.960  27.756
  230    HB2  PRO  31           HB2      PRO  31  22.212  11.259  27.972
  231    HB3  PRO  31           HB3      PRO  31  22.348   9.834  29.042
  232    HG2  PRO  31           HG2      PRO  31  24.065  10.545  26.661
  233    HG3  PRO  31           HG3      PRO  31  24.580   9.957  28.269
  234    HD2  PRO  31           HD2      PRO  31  24.380   8.279  26.142
  235    HD3  PRO  31           HD3      PRO  31  23.938   7.761  27.794
  236    H    ILE  32           H        ILE  32  22.434  10.120  24.820
  237    HA   ILE  32           HA       ILE  32  20.357  12.025  24.105
  238    HB   ILE  32           HB       ILE  32  22.525  10.824  22.337
  239   HG12  ILE  32          HG12      ILE  32  23.272  13.446  22.859
  240   HG13  ILE  32          HG13      ILE  32  22.547  13.011  24.395
  241   HG21  ILE  32          HG21      ILE  32  20.745  11.847  20.982
  242   HG22  ILE  32          HG22      ILE  32  20.803  13.317  21.977
  243   HG23  ILE  32          HG23      ILE  32  22.181  12.857  20.951
  244   HD11  ILE  32          HD11      ILE  32  24.111  11.011  24.465
  245   HD12  ILE  32          HD12      ILE  32  24.839  11.597  22.957
  246   HD13  ILE  32          HD13      ILE  32  24.943  12.576  24.433
  247    H    LEU  33           H        LEU  33  20.707   8.562  23.610
  248    HA   LEU  33           HA       LEU  33  18.885   8.181  21.464
  249    HB2  LEU  33           HB2      LEU  33  20.383   6.419  22.431
  250    HB3  LEU  33           HB3      LEU  33  19.379   6.412  23.880
  251    HG   LEU  33           HG       LEU  33  17.428   5.653  22.533
  252   HD11  LEU  33          HD11      LEU  33  18.103   6.421  20.281
  253   HD12  LEU  33          HD12      LEU  33  17.838   4.676  20.294
  254   HD13  LEU  33          HD13      LEU  33  19.492   5.312  20.313
  255   HD21  LEU  33          HD21      LEU  33  18.811   4.096  23.802
  256   HD22  LEU  33          HD22      LEU  33  19.891   3.892  22.408
  257   HD23  LEU  33          HD23      LEU  33  18.190   3.355  22.326
  258    H    ASN  34           H        ASN  34  18.230   8.916  24.885
  259    HA   ASN  34           HA       ASN  34  15.466   8.269  24.962
  260    HB2  ASN  34           HB2      ASN  34  16.999  10.523  26.331
  261    HB3  ASN  34           HB3      ASN  34  15.360  10.040  26.744
  262   HD21  ASN  34          HD21      ASN  34  18.170   9.886  28.118
  263   HD22  ASN  34          HD22      ASN  34  18.102   8.270  28.815
  264    H    GLN  35           H        GLN  35  17.036  11.282  23.764
  265    HA   GLN  35           HA       GLN  35  14.576  12.661  23.183
  266    HB2  GLN  35           HB2      GLN  35  16.798  13.758  23.423
  267    HB3  GLN  35           HB3      GLN  35  17.326  13.005  21.909
  268    HG2  GLN  35           HG2      GLN  35  15.529  14.212  20.682
  269    HG3  GLN  35           HG3      GLN  35  14.958  14.916  22.197
  270   HE21  GLN  35          HE21      GLN  35  16.135  16.723  23.088
  271   HE22  GLN  35          HE22      GLN  35  17.453  17.470  22.195
  272    H    HIS  36           H        HIS  36  16.663  10.489  21.197
  273    HA   HIS  36           HA       HIS  36  15.064  10.731  18.820
  274    HB2  HIS  36           HB2      HIS  36  17.399   9.719  18.956
  275    HB3  HIS  36           HB3      HIS  36  16.646   8.250  19.586
  276    HD1  HIS  36           HD1      HIS  36  16.921  10.350  16.416
  277    HD2  HIS  36           HD2      HIS  36  14.981   6.889  17.797
  278    HE1  HIS  36           HE1      HIS  36  15.870   9.290  14.381
  279    H    GLN  37           H        GLN  37  14.967   8.312  21.499
  280    HA   GLN  37           HA       GLN  37  12.865   6.722  20.516
  281    HB2  GLN  37           HB2      GLN  37  13.733   7.414  23.343
  282    HB3  GLN  37           HB3      GLN  37  12.433   6.276  23.025
  283    HG2  GLN  37           HG2      GLN  37  15.240   5.981  21.885
  284    HG3  GLN  37           HG3      GLN  37  14.717   5.236  23.391
  285   HE21  GLN  37          HE21      GLN  37  15.703   3.843  21.008
  286   HE22  GLN  37          HE22      GLN  37  14.375   2.821  20.479
  287    H    GLU  38           H        GLU  38  12.540   9.697  22.573
  288    HA   GLU  38           HA       GLU  38   9.668   9.583  22.604
  289    HB2  GLU  38           HB2      GLU  38  11.499  12.000  22.896
  290    HB3  GLU  38           HB3      GLU  38   9.766  11.966  23.217
  291    HG2  GLU  38           HG2      GLU  38  10.664   9.826  24.754
  292    HG3  GLU  38           HG3      GLU  38  12.009  10.953  24.870
  293    H    LYS  39           H        LYS  39  11.859  11.396  20.378
  294    HA   LYS  39           HA       LYS  39   9.682  12.637  18.949
  295    HB2  LYS  39           HB2      LYS  39  12.050  13.442  19.206
  296    HB3  LYS  39           HB3      LYS  39  12.573  12.239  18.042
  297    HG2  LYS  39           HG2      LYS  39  10.401  14.291  17.414
  298    HG3  LYS  39           HG3      LYS  39  12.099  14.721  17.329
  299    HD2  LYS  39           HD2      LYS  39  10.801  12.548  15.635
  300    HD3  LYS  39           HD3      LYS  39  11.148  14.201  15.131
  301    HE2  LYS  39           HE2      LYS  39  13.579  13.811  15.633
  302    HE3  LYS  39           HE3      LYS  39  13.209  12.117  15.982
  303    HZ1  LYS  39           HZ1      LYS  39  12.436  11.876  13.686
  304    HZ2  LYS  39           HZ2      LYS  39  13.963  12.442  13.684
  305    HZ3  LYS  39           HZ3      LYS  39  12.729  13.455  13.369
  306    H    CYS  40           H        CYS  40  11.683   9.803  18.183
  307    HA   CYS  40           HA       CYS  40  10.546   9.172  15.651
  308    HB2  CYS  40           HB2      CYS  40  12.745   8.502  16.852
  309    HB3  CYS  40           HB3      CYS  40  11.804   7.223  17.619
  310    H    ARG  41           H        ARG  41   9.736   8.043  18.987
  311    HA   ARG  41           HA       ARG  41   7.471   6.410  18.331
  312    HB2  ARG  41           HB2      ARG  41   8.522   6.343  20.516
  313    HB3  ARG  41           HB3      ARG  41   8.129   8.046  20.811
  314    HG2  ARG  41           HG2      ARG  41   5.750   7.544  20.947
  315    HG3  ARG  41           HG3      ARG  41   6.037   5.875  20.426
  316    HD2  ARG  41           HD2      ARG  41   5.678   5.936  22.824
  317    HD3  ARG  41           HD3      ARG  41   7.341   5.441  22.467
  318    HE   ARG  41           HE       ARG  41   7.137   8.304  22.933
  319   HH11  ARG  41          HH11      ARG  41   7.255   5.275  24.686
  320   HH12  ARG  41          HH12      ARG  41   7.927   6.014  26.112
  321   HH21  ARG  41          HH21      ARG  41   7.979   9.200  24.834
  322   HH22  ARG  41          HH22      ARG  41   8.334   8.162  26.170
  323    H    TRP  42           H        TRP  42   7.586   9.931  19.137
  324    HA   TRP  42           HA       TRP  42   4.788  10.333  18.925
  325    HB2  TRP  42           HB2      TRP  42   6.634  11.902  19.827
  326    HB3  TRP  42           HB3      TRP  42   6.812  12.457  18.169
  327    HD1  TRP  42           HD1      TRP  42   4.774  12.820  21.254
  328    HE1  TRP  42           HE1      TRP  42   2.801  14.430  20.938
  329    HE3  TRP  42           HE3      TRP  42   4.969  13.371  16.150
  330    HZ2  TRP  42           HZ2      TRP  42   1.422  15.708  18.759
  331    HZ3  TRP  42           HZ3      TRP  42   3.280  14.768  14.985
  332    HH2  TRP  42           HH2      TRP  42   1.503  15.932  16.270
  333    H    LEU  43           H        LEU  43   7.303  10.712  16.377
  334    HA   LEU  43           HA       LEU  43   5.509  11.298  14.231
  335    HB2  LEU  43           HB2      LEU  43   8.263  10.010  14.358
  336    HB3  LEU  43           HB3      LEU  43   7.421  10.232  12.831
  337    HG   LEU  43           HG       LEU  43   8.240  12.485  14.713
  338   HD11  LEU  43          HD11      LEU  43  10.108  11.339  13.519
  339   HD12  LEU  43          HD12      LEU  43   9.867  13.005  12.939
  340   HD13  LEU  43          HD13      LEU  43   9.289  11.630  11.974
  341   HD21  LEU  43          HD21      LEU  43   6.199  13.057  13.381
  342   HD22  LEU  43          HD22      LEU  43   7.063  12.608  11.905
  343   HD23  LEU  43          HD23      LEU  43   7.596  13.983  12.886
  344    H    ALA  44           H        ALA  44   6.794   8.064  15.221
  345    HA   ALA  44           HA       ALA  44   5.375   6.619  13.247
  346    HB1  ALA  44           HB1      ALA  44   5.847   4.667  14.681
  347    HB2  ALA  44           HB2      ALA  44   7.262   5.728  14.547
  348    HB3  ALA  44           HB3      ALA  44   6.274   5.747  16.027
  349    H    SER  45           H        SER  45   4.302   7.604  16.511
  350    HA   SER  45           HA       SER  45   1.746   6.274  16.444
  351    HB2  SER  45           HB2      SER  45   2.912   7.084  18.496
  352    HB3  SER  45           HB3      SER  45   2.621   8.752  17.982
  353    HG   SER  45           HG       SER  45   0.707   6.755  18.689
  354    H    SER  46           H        SER  46   2.751   9.618  15.583
  355    HA   SER  46           HA       SER  46   0.157  10.585  14.851
  356    HB2  SER  46           HB2      SER  46   2.110  11.973  15.451
  357    HB3  SER  46           HB3      SER  46   2.917  11.509  13.946
  358    HG   SER  46           HG       SER  46   1.387  12.636  12.787
  359    H    LYS  47           H        LYS  47   2.649   8.913  12.969
  360    HA   LYS  47           HA       LYS  47   1.429   9.258  10.371
  361    HB2  LYS  47           HB2      LYS  47   3.878   8.976  10.929
  362    HB3  LYS  47           HB3      LYS  47   3.569   7.259  11.207
  363    HG2  LYS  47           HG2      LYS  47   2.790   7.073   8.824
  364    HG3  LYS  47           HG3      LYS  47   3.079   8.810   8.615
  365    HD2  LYS  47           HD2      LYS  47   5.490   8.439   9.214
  366    HD3  LYS  47           HD3      LYS  47   5.190   6.699   9.277
  367    HE2  LYS  47           HE2      LYS  47   4.772   8.491   6.835
  368    HE3  LYS  47           HE3      LYS  47   6.214   7.518   7.133
  369    HZ1  LYS  47           HZ1      LYS  47   3.480   6.418   6.757
  370    HZ2  LYS  47           HZ2      LYS  47   4.816   5.523   7.060
  371    HZ3  LYS  47           HZ3      LYS  47   4.688   6.359   5.666
  372    H    GLY  48           H        GLY  48  -0.684   8.557  11.467
  373    HA2  GLY  48           HA2      GLY  48  -1.247   5.629  11.056
  374    HA3  GLY  48           HA3      GLY  48  -2.031   6.649  12.260
  375    H    LYS  49           H        LYS  49  -1.661   6.068   8.795
  376    HA   LYS  49           HA       LYS  49  -4.338   7.290   8.246
  377    HB2  LYS  49           HB2      LYS  49  -3.558   8.131   6.131
  378    HB3  LYS  49           HB3      LYS  49  -2.567   8.748   7.435
  379    HG2  LYS  49           HG2      LYS  49  -0.928   8.288   5.904
  380    HG3  LYS  49           HG3      LYS  49  -0.915   6.807   6.831
  381    HD2  LYS  49           HD2      LYS  49  -0.859   5.908   4.758
  382    HD3  LYS  49           HD3      LYS  49  -2.602   5.973   4.892
  383    HE2  LYS  49           HE2      LYS  49  -0.830   8.056   3.528
  384    HE3  LYS  49           HE3      LYS  49  -1.668   6.744   2.703
  385    HZ1  LYS  49           HZ1      LYS  49  -2.935   8.765   2.525
  386    HZ2  LYS  49           HZ2      LYS  49  -2.996   8.981   4.134
  387    HZ3  LYS  49           HZ3      LYS  49  -3.789   7.722   3.435
  388    H    GLN  50           H        GLN  50  -5.488   6.445   6.447
  389    HA   GLN  50           HA       GLN  50  -6.695   4.741   5.633
  390    HB2  GLN  50           HB2      GLN  50  -4.700   4.933   4.071
  391    HB3  GLN  50           HB3      GLN  50  -4.038   3.498   4.839
  392    HG2  GLN  50           HG2      GLN  50  -5.150   3.008   2.696
  393    HG3  GLN  50           HG3      GLN  50  -5.915   2.151   4.013
  394   HE21  GLN  50          HE21      GLN  50  -8.051   1.956   3.259
  395   HE22  GLN  50          HE22      GLN  50  -9.026   3.341   2.785
  396    H    VAL  51           H        VAL  51  -5.959   4.489   8.464
  397    HA   VAL  51           HA       VAL  51  -5.538   1.698   9.110
  398    HB   VAL  51           HB       VAL  51  -6.077   2.323  11.406
  399   HG11  VAL  51          HG11      VAL  51  -4.252   4.388  10.111
  400   HG12  VAL  51          HG12      VAL  51  -4.221   3.838  11.796
  401   HG13  VAL  51          HG13      VAL  51  -3.798   2.714  10.493
  402   HG21  VAL  51          HG21      VAL  51  -6.680   5.127  10.359
  403   HG22  VAL  51          HG22      VAL  51  -7.842   4.011  11.109
  404   HG23  VAL  51          HG23      VAL  51  -6.507   4.659  12.060
  405    H    ARG  52           H        ARG  52  -6.957   0.128   9.748
  406    HA   ARG  52           HA       ARG  52  -9.811   0.635  10.144
  407    HB2  ARG  52           HB2      ARG  52  -9.580   0.505   7.647
  408    HB3  ARG  52           HB3      ARG  52  -8.938  -1.131   7.805
  409    HG2  ARG  52           HG2      ARG  52 -11.059  -1.938   8.691
  410    HG3  ARG  52           HG3      ARG  52 -11.660  -0.286   8.894
  411    HD2  ARG  52           HD2      ARG  52 -12.700  -1.262   6.930
  412    HD3  ARG  52           HD3      ARG  52 -11.647   0.064   6.464
  413    HE   ARG  52           HE       ARG  52 -10.206  -1.401   5.365
  414   HH11  ARG  52          HH11      ARG  52 -12.581  -3.345   7.063
  415   HH12  ARG  52          HH12      ARG  52 -12.143  -4.792   6.195
  416   HH21  ARG  52          HH21      ARG  52  -9.705  -3.278   4.302
  417   HH22  ARG  52          HH22      ARG  52 -10.557  -4.747   4.676
  418    H    ASN  53           H        ASN  53 -10.331  -0.552  11.839
  419    HA   ASN  53           HA       ASN  53  -9.799  -3.401  11.984
  420    HB2  ASN  53           HB2      ASN  53  -8.765  -3.206  14.328
  421    HB3  ASN  53           HB3      ASN  53  -7.734  -2.913  12.946
  422   HD21  ASN  53          HD21      ASN  53  -6.538  -1.044  12.915
  423   HD22  ASN  53          HD22      ASN  53  -6.792   0.285  14.036
  424    H    PHE  54           H        PHE  54 -11.481  -4.383  12.826
  425    HA   PHE  54           HA       PHE  54 -13.112  -3.340  15.009
  426    HB2  PHE  54           HB2      PHE  54 -14.161  -3.543  12.158
  427    HB3  PHE  54           HB3      PHE  54 -15.230  -3.772  13.525
  428    HD1  PHE  54           HD1      PHE  54 -15.131  -1.915  15.423
  429    HD2  PHE  54           HD2      PHE  54 -14.027  -1.323  11.294
  430    HE1  PHE  54           HE1      PHE  54 -15.531   0.522  15.667
  431    HE2  PHE  54           HE2      PHE  54 -14.438   1.116  11.541
  432    HZ   PHE  54           HZ       PHE  54 -15.186   2.041  13.726
  433    H    SER  55           H        SER  55 -14.748  -4.907  15.676
  434    HA   SER  55           HA       SER  55 -13.864  -7.734  15.376
  435    HB2  SER  55           HB2      SER  55 -15.751  -6.423  17.372
  436    HB3  SER  55           HB3      SER  55 -15.245  -8.124  17.375
  437    HG   SER  55           HG       SER  55 -13.927  -6.822  18.779
  Start of MODEL    2
    1    H1   GLY   1           H1       GLY   1   4.072  11.992  -1.461
    2    H2   GLY   1           H2       GLY   1   2.971  12.206  -2.656
    3    H3   GLY   1           H3       GLY   1   2.975  13.203  -1.356
    4    HA2  GLY   1           HA2      GLY   1   3.924  14.320  -3.270
    5    HA3  GLY   1           HA3      GLY   1   5.104  14.125  -1.962
    6    H    SER   2           H        SER   2   6.994  13.152  -2.437
    7    HA   SER   2           HA       SER   2   7.247  11.209  -4.657
    8    HB2  SER   2           HB2      SER   2   9.189  12.430  -5.580
    9    HB3  SER   2           HB3      SER   2   7.683  13.342  -5.732
   10    HG   SER   2           HG       SER   2   9.360  14.679  -4.983
   11    H    GLU   3           H        GLU   3   9.557  10.332  -4.702
   12    HA   GLU   3           HA       GLU   3  10.535   9.845  -1.909
   13    HB2  GLU   3           HB2      GLU   3   9.799   7.813  -4.045
   14    HB3  GLU   3           HB3      GLU   3  10.735   7.443  -2.589
   15    HG2  GLU   3           HG2      GLU   3   8.871   8.156  -1.156
   16    HG3  GLU   3           HG3      GLU   3   7.915   8.603  -2.571
   17    H    PHE   4           H        PHE   4  12.368  10.961  -2.037
   18    HA   PHE   4           HA       PHE   4  14.468  10.132  -3.996
   19    HB2  PHE   4           HB2      PHE   4  15.188  12.496  -4.028
   20    HB3  PHE   4           HB3      PHE   4  13.581  12.253  -4.670
   21    HD1  PHE   4           HD1      PHE   4  15.507  13.659  -1.808
   22    HD2  PHE   4           HD2      PHE   4  11.616  13.221  -3.621
   23    HE1  PHE   4           HE1      PHE   4  14.602  15.402  -0.292
   24    HE2  PHE   4           HE2      PHE   4  10.718  14.973  -2.112
   25    HZ   PHE   4           HZ       PHE   4  12.208  16.066  -0.441
   26    H    THR   5           H        THR   5  13.853   9.315  -1.142
   27    HA   THR   5           HA       THR   5  15.652  10.344   0.731
   28    HB   THR   5           HB       THR   5  13.830   8.832   1.277
   29    HG1  THR   5           HG1      THR   5  14.975   7.684   2.833
   30   HG21  THR   5          HG21      THR   5  14.112   7.123  -0.549
   31   HG22  THR   5          HG22      THR   5  13.971   6.428   1.070
   32   HG23  THR   5          HG23      THR   5  15.559   6.522   0.287
   33    H    SER   6           H        SER   6  17.724  10.103   1.285
   34    HA   SER   6           HA       SER   6  19.442   7.996   0.275
   35    HB2  SER   6           HB2      SER   6  21.121   9.549  -0.742
   36    HB3  SER   6           HB3      SER   6  19.638   9.354  -1.679
   37    HG   SER   6           HG       SER   6  18.914  11.352  -0.921
   38    H    SER   7           H        SER   7  21.002   7.563   1.681
   39    HA   SER   7           HA       SER   7  21.998   9.499   3.679
   40    HB2  SER   7           HB2      SER   7  20.463   6.953   4.376
   41    HB3  SER   7           HB3      SER   7  21.500   7.816   5.520
   42    HG   SER   7           HG       SER   7  19.316   8.448   5.726
   43    HA   PRO   8           HA       PRO   8  25.605   6.902   3.146
   44    HB2  PRO   8           HB2      PRO   8  27.058   7.384   5.411
   45    HB3  PRO   8           HB3      PRO   8  26.788   8.622   4.149
   46    HG2  PRO   8           HG2      PRO   8  25.236   8.237   6.732
   47    HG3  PRO   8           HG3      PRO   8  25.955   9.749   6.088
   48    HD2  PRO   8           HD2      PRO   8  23.331   9.131   5.715
   49    HD3  PRO   8           HD3      PRO   8  24.278   9.956   4.443
   50    H    ARG   9           H        ARG   9  26.713   5.048   3.952
   51    HA   ARG   9           HA       ARG   9  25.115   2.980   5.111
   52    HB2  ARG   9           HB2      ARG   9  27.130   1.608   4.913
   53    HB3  ARG   9           HB3      ARG   9  26.863   2.579   3.467
   54    HG2  ARG   9           HG2      ARG   9  28.569   4.249   4.371
   55    HG3  ARG   9           HG3      ARG   9  28.921   3.089   5.663
   56    HD2  ARG   9           HD2      ARG   9  29.668   1.435   4.040
   57    HD3  ARG   9           HD3      ARG   9  29.099   2.449   2.697
   58    HE   ARG   9           HE       ARG   9  31.051   3.793   4.402
   59   HH11  ARG   9          HH11      ARG   9  30.819   1.648   1.640
   60   HH12  ARG   9          HH12      ARG   9  32.339   2.189   0.980
   61   HH21  ARG   9          HH21      ARG   9  32.972   4.440   3.503
   62   HH22  ARG   9          HH22      ARG   9  33.526   3.721   2.020
   63    H    GLY  10           H        GLY  10  26.927   5.370   6.774
   64    HA2  GLY  10           HA2      GLY  10  27.191   5.776   9.020
   65    HA3  GLY  10           HA3      GLY  10  26.028   4.485   9.334
   66    H    ASP  11           H        ASP  11  29.197   4.096   7.734
   67    HA   ASP  11           HA       ASP  11  29.999   1.849   9.270
   68    HB2  ASP  11           HB2      ASP  11  30.878   2.324   7.048
   69    HB3  ASP  11           HB3      ASP  11  31.638   3.810   7.624
   70    H    LYS  12           H        LYS  12  30.532   1.721  11.315
   71    HA   LYS  12           HA       LYS  12  32.208   3.746  12.695
   72    HB2  LYS  12           HB2      LYS  12  29.691   4.295  12.932
   73    HB3  LYS  12           HB3      LYS  12  29.525   2.768  13.781
   74    HG2  LYS  12           HG2      LYS  12  29.717   4.281  15.517
   75    HG3  LYS  12           HG3      LYS  12  31.359   3.682  15.401
   76    HD2  LYS  12           HD2      LYS  12  31.594   6.004  15.657
   77    HD3  LYS  12           HD3      LYS  12  31.819   5.779  13.915
   78    HE2  LYS  12           HE2      LYS  12  29.426   6.396  13.545
   79    HE3  LYS  12           HE3      LYS  12  29.198   6.556  15.290
   80    HZ1  LYS  12           HZ1      LYS  12  30.835   8.371  15.267
   81    HZ2  LYS  12           HZ2      LYS  12  29.588   8.715  14.275
   82    HZ3  LYS  12           HZ3      LYS  12  31.016   8.239  13.648
   83    H    ALA  13           H        ALA  13  33.480   2.848  14.272
   84    HA   ALA  13           HA       ALA  13  33.836  -0.019  14.285
   85    HB1  ALA  13           HB1      ALA  13  35.812   0.522  15.634
   86    HB2  ALA  13           HB2      ALA  13  35.686   1.622  14.254
   87    HB3  ALA  13           HB3      ALA  13  35.221   2.180  15.880
   88    H    ALA  14           H        ALA  14  31.367   1.313  15.789
   89    HA   ALA  14           HA       ALA  14  31.472  -0.487  18.140
   90    HB1  ALA  14           HB1      ALA  14  30.787   2.486  18.257
   91    HB2  ALA  14           HB2      ALA  14  30.606   1.329  19.592
   92    HB3  ALA  14           HB3      ALA  14  32.221   1.711  18.965
   93    H    TYR  15           H        TYR  15  29.634  -1.516  18.476
   94    HA   TYR  15           HA       TYR  15  27.016  -0.480  17.534
   95    HB2  TYR  15           HB2      TYR  15  26.510  -2.652  16.446
   96    HB3  TYR  15           HB3      TYR  15  27.785  -1.753  15.658
   97    HD1  TYR  15           HD1      TYR  15  27.026  -4.758  17.708
   98    HD2  TYR  15           HD2      TYR  15  30.070  -2.585  15.551
   99    HE1  TYR  15           HE1      TYR  15  28.514  -6.750  17.799
  100    HE2  TYR  15           HE2      TYR  15  31.560  -4.581  15.652
  101    HH   TYR  15           HH       TYR  15  30.550  -7.640  17.226
  102    H    ASP  16           H        ASP  16  28.790  -2.125  19.961
  103    HA   ASP  16           HA       ASP  16  26.526  -3.539  21.162
  104    HB2  ASP  16           HB2      ASP  16  28.834  -4.371  21.330
  105    HB3  ASP  16           HB3      ASP  16  29.332  -2.897  22.157
  106    H    ILE  17           H        ILE  17  28.415  -0.568  21.967
  107    HA   ILE  17           HA       ILE  17  26.504   0.176  24.074
  108    HB   ILE  17           HB       ILE  17  28.809   0.554  24.463
  109   HG12  ILE  17          HG12      ILE  17  26.995   2.104  25.370
  110   HG13  ILE  17          HG13      ILE  17  28.681   2.541  25.555
  111   HG21  ILE  17          HG21      ILE  17  30.188   2.231  23.355
  112   HG22  ILE  17          HG22      ILE  17  29.738   0.941  22.243
  113   HG23  ILE  17          HG23      ILE  17  28.933   2.524  22.147
  114   HD11  ILE  17          HD11      ILE  17  28.529   4.241  23.819
  115   HD12  ILE  17          HD12      ILE  17  26.855   3.779  23.452
  116   HD13  ILE  17          HD13      ILE  17  27.258   4.481  25.022
  117    H    LEU  18           H        LEU  18  27.405   1.444  20.837
  118    HA   LEU  18           HA       LEU  18  25.406   3.520  20.818
  119    HB2  LEU  18           HB2      LEU  18  26.742   2.101  18.472
  120    HB3  LEU  18           HB3      LEU  18  25.807   3.588  18.384
  121    HG   LEU  18           HG       LEU  18  28.521   3.214  19.704
  122   HD11  LEU  18          HD11      LEU  18  29.248   4.795  17.991
  123   HD12  LEU  18          HD12      LEU  18  27.583   4.956  17.387
  124   HD13  LEU  18          HD13      LEU  18  28.442   3.409  17.234
  125   HD21  LEU  18          HD21      LEU  18  27.376   4.787  21.109
  126   HD22  LEU  18          HD22      LEU  18  26.699   5.656  19.702
  127   HD23  LEU  18          HD23      LEU  18  28.442   5.711  20.053
  128    H    ARG  19           H        ARG  19  23.475   3.642  19.699
  129    HA   ARG  19           HA       ARG  19  22.142   1.094  18.864
  130    HB2  ARG  19           HB2      ARG  19  21.566   2.745  21.162
  131    HB3  ARG  19           HB3      ARG  19  20.237   2.947  20.033
  132    HG2  ARG  19           HG2      ARG  19  21.278   0.212  20.878
  133    HG3  ARG  19           HG3      ARG  19  20.048   1.097  21.788
  134    HD2  ARG  19           HD2      ARG  19  18.555   1.148  19.865
  135    HD3  ARG  19           HD3      ARG  19  19.757   0.320  18.858
  136    HE   ARG  19           HE       ARG  19  19.443  -1.386  21.005
  137   HH11  ARG  19          HH11      ARG  19  17.100  -0.034  18.767
  138   HH12  ARG  19          HH12      ARG  19  16.014  -1.383  18.962
  139   HH21  ARG  19          HH21      ARG  19  18.039  -3.091  21.155
  140   HH22  ARG  19          HH22      ARG  19  16.545  -3.071  20.266
  141    H    ARG  20           H        ARG  20  20.954   1.199  17.072
  142    HA   ARG  20           HA       ARG  20  20.786   3.788  15.608
  143    HB2  ARG  20           HB2      ARG  20  20.876   2.538  13.544
  144    HB3  ARG  20           HB3      ARG  20  22.313   2.292  14.497
  145    HG2  ARG  20           HG2      ARG  20  20.086   0.212  14.546
  146    HG3  ARG  20           HG3      ARG  20  21.199   0.338  13.199
  147    HD2  ARG  20           HD2      ARG  20  22.388  -1.169  14.327
  148    HD3  ARG  20           HD3      ARG  20  23.070   0.265  15.086
  149    HE   ARG  20           HE       ARG  20  20.734  -1.090  16.369
  150   HH11  ARG  20          HH11      ARG  20  24.224  -0.751  16.405
  151   HH12  ARG  20          HH12      ARG  20  24.365  -1.448  18.005
  152   HH21  ARG  20          HH21      ARG  20  21.018  -2.026  18.393
  153   HH22  ARG  20          HH22      ARG  20  22.622  -2.127  19.064
  154    H    CYS  21           H        CYS  21  19.064   4.210  14.263
  155    HA   CYS  21           HA       CYS  21  16.459   3.055  15.150
  156    HB2  CYS  21           HB2      CYS  21  16.856   5.442  15.587
  157    HB3  CYS  21           HB3      CYS  21  17.170   5.709  13.866
  158    H    SER  22           H        SER  22  15.558   1.669  13.824
  159    HA   SER  22           HA       SER  22  16.483   0.973  11.237
  160    HB2  SER  22           HB2      SER  22  15.211  -0.433  12.930
  161    HB3  SER  22           HB3      SER  22  13.730   0.364  12.369
  162    HG   SER  22           HG       SER  22  14.173  -1.646  11.300
  163    H    GLN  23           H        GLN  23  14.376   3.560  12.084
  164    HA   GLN  23           HA       GLN  23  13.350   3.820   9.280
  165    HB2  GLN  23           HB2      GLN  23  12.189   4.799  11.911
  166    HB3  GLN  23           HB3      GLN  23  11.540   5.186  10.311
  167    HG2  GLN  23           HG2      GLN  23  11.233   2.755   9.855
  168    HG3  GLN  23           HG3      GLN  23  11.749   2.384  11.501
  169   HE21  GLN  23          HE21      GLN  23   9.103   1.876  10.161
  170   HE22  GLN  23          HE22      GLN  23   7.944   2.665  11.223
  171    H    CYS  24           H        CYS  24  15.679   5.174  11.306
  172    HA   CYS  24           HA       CYS  24  15.579   7.800   9.861
  173    HB2  CYS  24           HB2      CYS  24  16.530   7.349  12.701
  174    HB3  CYS  24           HB3      CYS  24  16.326   8.884  11.866
  175    H    GLY  25           H        GLY  25  17.664   5.147  10.928
  176    HA2  GLY  25           HA2      GLY  25  19.738   4.532  10.181
  177    HA3  GLY  25           HA3      GLY  25  19.763   5.923   9.100
  178    H    ILE  26           H        ILE  26  19.280   7.385  11.969
  179    HA   ILE  26           HA       ILE  26  22.010   8.190  12.431
  180    HB   ILE  26           HB       ILE  26  20.035   9.618  12.783
  181   HG12  ILE  26          HG12      ILE  26  21.608   9.304  15.367
  182   HG13  ILE  26          HG13      ILE  26  22.229  10.062  13.898
  183   HG21  ILE  26          HG21      ILE  26  19.427   7.886  15.220
  184   HG22  ILE  26          HG22      ILE  26  18.595   9.381  14.762
  185   HG23  ILE  26          HG23      ILE  26  18.470   7.959  13.739
  186   HD11  ILE  26          HD11      ILE  26  19.893  11.037  15.590
  187   HD12  ILE  26          HD12      ILE  26  21.487  11.779  15.411
  188   HD13  ILE  26          HD13      ILE  26  20.376  11.746  14.028
  189    H    LEU  27           H        LEU  27  23.266   7.888  14.357
  190    HA   LEU  27           HA       LEU  27  22.656   5.488  16.033
  191    HB2  LEU  27           HB2      LEU  27  25.370   6.449  15.012
  192    HB3  LEU  27           HB3      LEU  27  25.147   5.356  16.365
  193    HG   LEU  27           HG       LEU  27  23.902   3.793  14.765
  194   HD11  LEU  27          HD11      LEU  27  24.662   3.922  12.389
  195   HD12  LEU  27          HD12      LEU  27  25.360   5.523  12.713
  196   HD13  LEU  27          HD13      LEU  27  23.607   5.262  12.811
  197   HD21  LEU  27          HD21      LEU  27  26.033   2.817  13.979
  198   HD22  LEU  27          HD22      LEU  27  26.138   3.341  15.663
  199   HD23  LEU  27          HD23      LEU  27  26.874   4.331  14.382
  200    H    LEU  28           H        LEU  28  22.573   5.895  18.163
  201    HA   LEU  28           HA       LEU  28  23.718   8.439  19.262
  202    HB2  LEU  28           HB2      LEU  28  21.119   7.066  20.063
  203    HB3  LEU  28           HB3      LEU  28  21.848   8.414  20.894
  204    HG   LEU  28           HG       LEU  28  20.089   9.341  19.772
  205   HD11  LEU  28          HD11      LEU  28  22.344   9.896  17.827
  206   HD12  LEU  28          HD12      LEU  28  22.213  10.611  19.445
  207   HD13  LEU  28          HD13      LEU  28  20.965  10.931  18.226
  208   HD21  LEU  28          HD21      LEU  28  19.547   7.478  18.263
  209   HD22  LEU  28          HD22      LEU  28  20.847   7.986  17.171
  210   HD23  LEU  28          HD23      LEU  28  19.466   9.057  17.465
  211    HA   PRO  29           HA       PRO  29  25.729   5.704  22.118
  212    HB2  PRO  29           HB2      PRO  29  26.242   7.329  24.280
  213    HB3  PRO  29           HB3      PRO  29  27.095   7.423  22.715
  214    HG2  PRO  29           HG2      PRO  29  24.776   9.130  23.665
  215    HG3  PRO  29           HG3      PRO  29  26.289   9.651  22.866
  216    HD2  PRO  29           HD2      PRO  29  23.968   9.317  21.478
  217    HD3  PRO  29           HD3      PRO  29  25.551   8.908  20.763
  218    H    LEU  30           H        LEU  30  23.651   7.662  24.305
  219    HA   LEU  30           HA       LEU  30  21.862   5.508  24.968
  220    HB2  LEU  30           HB2      LEU  30  24.416   5.563  26.371
  221    HB3  LEU  30           HB3      LEU  30  23.132   5.885  27.519
  222    HG   LEU  30           HG       LEU  30  23.011   3.510  25.617
  223   HD11  LEU  30          HD11      LEU  30  24.096   3.622  28.459
  224   HD12  LEU  30          HD12      LEU  30  25.043   3.330  26.982
  225   HD13  LEU  30          HD13      LEU  30  23.826   2.150  27.495
  226   HD21  LEU  30          HD21      LEU  30  20.865   4.198  26.664
  227   HD22  LEU  30          HD22      LEU  30  21.624   4.092  28.268
  228   HD23  LEU  30          HD23      LEU  30  21.429   2.634  27.270
  229    HA   PRO  31           HA       PRO  31  20.720   9.188  27.760
  230    HB2  PRO  31           HB2      PRO  31  22.221  11.500  27.816
  231    HB3  PRO  31           HB3      PRO  31  22.458  10.115  28.922
  232    HG2  PRO  31           HG2      PRO  31  23.982  10.749  26.381
  233    HG3  PRO  31           HG3      PRO  31  24.635  10.278  27.981
  234    HD2  PRO  31           HD2      PRO  31  24.340   8.468  25.998
  235    HD3  PRO  31           HD3      PRO  31  23.994   8.034  27.693
  236    H    ILE  32           H        ILE  32  22.370  10.159  24.746
  237    HA   ILE  32           HA       ILE  32  20.348  12.087  23.948
  238    HB   ILE  32           HB       ILE  32  22.406  10.719  22.181
  239   HG12  ILE  32          HG12      ILE  32  22.736  13.268  23.833
  240   HG13  ILE  32          HG13      ILE  32  23.537  11.733  24.158
  241   HG21  ILE  32          HG21      ILE  32  20.997  13.421  21.941
  242   HG22  ILE  32          HG22      ILE  32  22.189  12.768  20.798
  243   HG23  ILE  32          HG23      ILE  32  20.634  11.985  20.965
  244   HD11  ILE  32          HD11      ILE  32  24.050  13.536  21.781
  245   HD12  ILE  32          HD12      ILE  32  25.135  13.123  23.112
  246   HD13  ILE  32          HD13      ILE  32  24.682  11.875  21.934
  247    H    LEU  33           H        LEU  33  20.735   8.593  23.519
  248    HA   LEU  33           HA       LEU  33  18.935   8.171  21.366
  249    HB2  LEU  33           HB2      LEU  33  20.467   6.433  22.330
  250    HB3  LEU  33           HB3      LEU  33  19.460   6.391  23.775
  251    HG   LEU  33           HG       LEU  33  17.512   5.625  22.365
  252   HD11  LEU  33          HD11      LEU  33  18.255   6.426  20.145
  253   HD12  LEU  33          HD12      LEU  33  17.973   4.685  20.140
  254   HD13  LEU  33          HD13      LEU  33  19.635   5.303  20.202
  255   HD21  LEU  33          HD21      LEU  33  20.032   3.946  22.395
  256   HD22  LEU  33          HD22      LEU  33  18.391   3.322  22.078
  257   HD23  LEU  33          HD23      LEU  33  18.783   4.039  23.648
  258    H    ASN  34           H        ASN  34  18.252   8.707  24.830
  259    HA   ASN  34           HA       ASN  34  15.522   7.979  24.838
  260    HB2  ASN  34           HB2      ASN  34  16.920   8.475  26.839
  261    HB3  ASN  34           HB3      ASN  34  16.926  10.187  26.409
  262   HD21  ASN  34          HD21      ASN  34  14.823   7.477  27.427
  263   HD22  ASN  34          HD22      ASN  34  13.556   8.521  28.055
  264    H    GLN  35           H        GLN  35  16.999  11.072  23.794
  265    HA   GLN  35           HA       GLN  35  14.499  12.452  23.345
  266    HB2  GLN  35           HB2      GLN  35  16.706  13.581  23.654
  267    HB3  GLN  35           HB3      GLN  35  17.230  12.946  22.087
  268    HG2  GLN  35           HG2      GLN  35  15.341  14.180  20.985
  269    HG3  GLN  35           HG3      GLN  35  14.851  14.801  22.562
  270   HE21  GLN  35          HE21      GLN  35  15.736  16.813  23.125
  271   HE22  GLN  35          HE22      GLN  35  17.148  17.499  22.332
  272    H    HIS  36           H        HIS  36  16.708  10.594  21.127
  273    HA   HIS  36           HA       HIS  36  15.011  10.981  18.834
  274    HB2  HIS  36           HB2      HIS  36  17.391  10.158  18.722
  275    HB3  HIS  36           HB3      HIS  36  16.826   8.582  19.289
  276    HD1  HIS  36           HD1      HIS  36  16.614  10.922  16.258
  277    HD2  HIS  36           HD2      HIS  36  15.280   7.136  17.501
  278    HE1  HIS  36           HE1      HIS  36  15.595   9.838  14.209
  279    H    GLN  37           H        GLN  37  15.132   8.345  21.274
  280    HA   GLN  37           HA       GLN  37  13.242   6.649  20.130
  281    HB2  GLN  37           HB2      GLN  37  14.764   6.142  22.044
  282    HB3  GLN  37           HB3      GLN  37  13.759   7.136  23.095
  283    HG2  GLN  37           HG2      GLN  37  13.274   4.752  23.382
  284    HG3  GLN  37           HG3      GLN  37  11.855   5.604  22.776
  285   HE21  GLN  37          HE21      GLN  37  14.774   3.929  21.344
  286   HE22  GLN  37          HE22      GLN  37  13.820   3.068  20.145
  287    H    GLU  38           H        GLU  38  12.534   9.256  22.581
  288    HA   GLU  38           HA       GLU  38   9.705   8.754  22.420
  289    HB2  GLU  38           HB2      GLU  38   9.379  10.606  23.832
  290    HB3  GLU  38           HB3      GLU  38  10.798   9.743  24.352
  291    HG2  GLU  38           HG2      GLU  38  11.478  11.900  24.636
  292    HG3  GLU  38           HG3      GLU  38  12.184  11.513  23.077
  293    H    LYS  39           H        LYS  39  11.751  11.114  20.643
  294    HA   LYS  39           HA       LYS  39   9.523  12.436  19.384
  295    HB2  LYS  39           HB2      LYS  39  11.870  13.294  19.748
  296    HB3  LYS  39           HB3      LYS  39  12.414  12.303  18.406
  297    HG2  LYS  39           HG2      LYS  39  10.179  14.377  18.182
  298    HG3  LYS  39           HG3      LYS  39  11.871  14.818  18.050
  299    HD2  LYS  39           HD2      LYS  39  10.419  12.945  16.135
  300    HD3  LYS  39           HD3      LYS  39  10.802  14.640  15.869
  301    HE2  LYS  39           HE2      LYS  39  13.241  14.110  16.144
  302    HE3  LYS  39           HE3      LYS  39  12.827  12.393  16.261
  303    HZ1  LYS  39           HZ1      LYS  39  13.439  13.025  13.989
  304    HZ2  LYS  39           HZ2      LYS  39  12.247  14.132  13.918
  305    HZ3  LYS  39           HZ3      LYS  39  11.880  12.541  14.016
  306    H    CYS  40           H        CYS  40  11.692   9.869  18.199
  307    HA   CYS  40           HA       CYS  40  10.593   9.542  15.606
  308    HB2  CYS  40           HB2      CYS  40  12.815   8.841  16.604
  309    HB3  CYS  40           HB3      CYS  40  11.985   7.497  17.392
  310    H    ARG  41           H        ARG  41   9.914   7.776  18.677
  311    HA   ARG  41           HA       ARG  41   7.767   6.132  17.762
  312    HB2  ARG  41           HB2      ARG  41   8.981   5.807  19.848
  313    HB3  ARG  41           HB3      ARG  41   8.362   7.315  20.511
  314    HG2  ARG  41           HG2      ARG  41   6.521   5.013  19.738
  315    HG3  ARG  41           HG3      ARG  41   7.366   5.087  21.284
  316    HD2  ARG  41           HD2      ARG  41   6.299   7.460  21.549
  317    HD3  ARG  41           HD3      ARG  41   5.210   6.951  20.262
  318    HE   ARG  41           HE       ARG  41   4.155   5.458  21.695
  319   HH11  ARG  41          HH11      ARG  41   7.008   6.645  23.364
  320   HH12  ARG  41          HH12      ARG  41   6.483   6.002  24.896
  321   HH21  ARG  41          HH21      ARG  41   3.559   4.671  23.685
  322   HH22  ARG  41          HH22      ARG  41   4.590   4.915  25.063
  323    H    TRP  42           H        TRP  42   7.615   9.441  19.207
  324    HA   TRP  42           HA       TRP  42   4.778   9.661  19.076
  325    HB2  TRP  42           HB2      TRP  42   6.272  11.136  20.388
  326    HB3  TRP  42           HB3      TRP  42   6.856  11.874  18.901
  327    HD1  TRP  42           HD1      TRP  42   3.949  11.827  21.309
  328    HE1  TRP  42           HE1      TRP  42   2.274  13.694  20.764
  329    HE3  TRP  42           HE3      TRP  42   5.911  13.409  16.837
  330    HZ2  TRP  42           HZ2      TRP  42   1.803  15.581  18.637
  331    HZ3  TRP  42           HZ3      TRP  42   4.803  15.228  15.561
  332    HH2  TRP  42           HH2      TRP  42   2.752  16.316  16.445
  333    H    LEU  43           H        LEU  43   7.241  10.770  16.678
  334    HA   LEU  43           HA       LEU  43   5.378  11.807  14.809
  335    HB2  LEU  43           HB2      LEU  43   7.998  12.005  15.047
  336    HB3  LEU  43           HB3      LEU  43   8.047  10.582  14.031
  337    HG   LEU  43           HG       LEU  43   8.433  12.559  12.740
  338   HD11  LEU  43          HD11      LEU  43   5.586  11.792  12.030
  339   HD12  LEU  43          HD12      LEU  43   7.015  10.803  11.633
  340   HD13  LEU  43          HD13      LEU  43   6.844  12.439  10.972
  341   HD21  LEU  43          HD21      LEU  43   5.736  13.651  13.629
  342   HD22  LEU  43          HD22      LEU  43   6.895  14.416  12.527
  343   HD23  LEU  43          HD23      LEU  43   7.319  14.189  14.231
  344    H    ALA  44           H        ALA  44   6.837   8.525  15.007
  345    HA   ALA  44           HA       ALA  44   5.519   7.397  12.763
  346    HB1  ALA  44           HB1      ALA  44   7.431   6.353  13.920
  347    HB2  ALA  44           HB2      ALA  44   6.435   6.087  15.365
  348    HB3  ALA  44           HB3      ALA  44   6.053   5.238  13.853
  349    H    SER  45           H        SER  45   4.479   7.459  16.211
  350    HA   SER  45           HA       SER  45   2.032   6.053  15.887
  351    HB2  SER  45           HB2      SER  45   3.202   6.487  18.042
  352    HB3  SER  45           HB3      SER  45   2.758   8.197  17.925
  353    HG   SER  45           HG       SER  45   1.036   5.935  18.204
  354    H    SER  46           H        SER  46   2.642   9.607  15.842
  355    HA   SER  46           HA       SER  46  -0.088  10.335  15.257
  356    HB2  SER  46           HB2      SER  46   2.549  11.824  14.954
  357    HB3  SER  46           HB3      SER  46   0.961  12.561  14.683
  358    HG   SER  46           HG       SER  46   0.404  12.132  16.824
  359    H    LYS  47           H        LYS  47   2.368   9.068  13.191
  360    HA   LYS  47           HA       LYS  47   2.668   8.907  10.939
  361    HB2  LYS  47           HB2      LYS  47   0.509   7.599  11.499
  362    HB3  LYS  47           HB3      LYS  47  -0.364   8.951  10.812
  363    HG2  LYS  47           HG2      LYS  47  -0.353   7.559   9.037
  364    HG3  LYS  47           HG3      LYS  47   1.108   8.445   8.645
  365    HD2  LYS  47           HD2      LYS  47   1.008   5.725  10.040
  366    HD3  LYS  47           HD3      LYS  47   1.211   5.977   8.316
  367    HE2  LYS  47           HE2      LYS  47   3.395   5.987   8.601
  368    HE3  LYS  47           HE3      LYS  47   3.235   7.579   9.332
  369    HZ1  LYS  47           HZ1      LYS  47   3.197   4.976  10.789
  370    HZ2  LYS  47           HZ2      LYS  47   3.044   6.423  11.530
  371    HZ3  LYS  47           HZ3      LYS  47   4.441   6.026  10.773
  372    H    GLY  48           H        GLY  48   2.861  11.525  11.870
  373    HA2  GLY  48           HA2      GLY  48   1.305  13.418  10.360
  374    HA3  GLY  48           HA3      GLY  48   2.710  13.772  11.365
  375    H    LYS  49           H        LYS  49   4.129  11.689   9.455
  376    HA   LYS  49           HA       LYS  49   4.317  13.193   6.927
  377    HB2  LYS  49           HB2      LYS  49   6.096  13.979   8.743
  378    HB3  LYS  49           HB3      LYS  49   6.872  12.445   8.389
  379    HG2  LYS  49           HG2      LYS  49   7.961  14.040   7.045
  380    HG3  LYS  49           HG3      LYS  49   6.903  13.183   5.922
  381    HD2  LYS  49           HD2      LYS  49   5.265  15.070   6.037
  382    HD3  LYS  49           HD3      LYS  49   6.282  15.860   7.245
  383    HE2  LYS  49           HE2      LYS  49   6.751  16.961   5.212
  384    HE3  LYS  49           HE3      LYS  49   8.153  15.949   5.559
  385    HZ1  LYS  49           HZ1      LYS  49   5.972  15.248   3.657
  386    HZ2  LYS  49           HZ2      LYS  49   7.308  14.339   3.930
  387    HZ3  LYS  49           HZ3      LYS  49   7.445  15.802   3.227
  388    H    GLN  50           H        GLN  50   5.213  11.949   5.240
  389    HA   GLN  50           HA       GLN  50   5.219   8.994   5.648
  390    HB2  GLN  50           HB2      GLN  50   3.772   8.774   3.695
  391    HB3  GLN  50           HB3      GLN  50   3.005   9.606   5.028
  392    HG2  GLN  50           HG2      GLN  50   4.201  11.097   2.648
  393    HG3  GLN  50           HG3      GLN  50   2.550  10.492   2.680
  394   HE21  GLN  50          HE21      GLN  50   1.019  11.408   4.295
  395   HE22  GLN  50          HE22      GLN  50   1.356  13.007   4.941
  396    H    VAL  51           H        VAL  51   7.574  10.350   5.491
  397    HA   VAL  51           HA       VAL  51   8.805  10.294   2.886
  398    HB   VAL  51           HB       VAL  51  10.941  10.383   4.073
  399   HG11  VAL  51          HG11      VAL  51   9.589  12.445   3.773
  400   HG12  VAL  51          HG12      VAL  51   8.931  12.217   5.413
  401   HG13  VAL  51          HG13      VAL  51  10.664  12.496   5.181
  402   HG21  VAL  51          HG21      VAL  51  11.057  10.460   6.526
  403   HG22  VAL  51          HG22      VAL  51   9.335  10.048   6.648
  404   HG23  VAL  51          HG23      VAL  51  10.503   8.880   5.971
  405    H    ARG  52           H        ARG  52   7.623   7.673   4.540
  406    HA   ARG  52           HA       ARG  52   9.371   5.770   3.089
  407    HB2  ARG  52           HB2      ARG  52   9.486   4.255   4.980
  408    HB3  ARG  52           HB3      ARG  52  10.306   5.759   5.320
  409    HG2  ARG  52           HG2      ARG  52   7.463   5.273   6.322
  410    HG3  ARG  52           HG3      ARG  52   8.869   4.596   7.141
  411    HD2  ARG  52           HD2      ARG  52   9.831   6.943   7.256
  412    HD3  ARG  52           HD3      ARG  52   8.230   7.539   6.769
  413    HE   ARG  52           HE       ARG  52   7.682   5.860   8.887
  414   HH11  ARG  52          HH11      ARG  52   9.766   8.666   8.613
  415   HH12  ARG  52          HH12      ARG  52   9.719   8.978  10.324
  416   HH21  ARG  52          HH21      ARG  52   7.804   6.242  11.083
  417   HH22  ARG  52          HH22      ARG  52   8.614   7.659  11.667
  418    H    ASN  53           H        ASN  53   8.485   3.660   2.843
  419    HA   ASN  53           HA       ASN  53   5.527   3.396   2.909
  420    HB2  ASN  53           HB2      ASN  53   6.034   4.504   0.769
  421    HB3  ASN  53           HB3      ASN  53   7.301   3.329   0.419
  422   HD21  ASN  53          HD21      ASN  53   3.761   3.731   0.733
  423   HD22  ASN  53          HD22      ASN  53   3.388   2.286  -0.194
  424    H    PHE  54           H        PHE  54   4.832   1.300   3.043
  425    HA   PHE  54           HA       PHE  54   6.534  -0.990   2.483
  426    HB2  PHE  54           HB2      PHE  54   6.534  -1.939   4.688
  427    HB3  PHE  54           HB3      PHE  54   7.288  -0.367   4.761
  428    HD1  PHE  54           HD2      PHE  54   5.942   1.622   5.709
  429    HD2  PHE  54           HD1      PHE  54   4.686  -2.488   6.098
  430    HE1  PHE  54           HE2      PHE  54   4.453   2.253   7.593
  431    HE2  PHE  54           HE1      PHE  54   3.218  -1.855   7.996
  432    HZ   PHE  54           HZ       PHE  54   3.094   0.514   8.744
  433    H    SER  55           H        SER  55   5.310  -3.062   3.017
  434    HA   SER  55           HA       SER  55   2.415  -2.771   2.268
  435    HB2  SER  55           HB2      SER  55   4.394  -4.967   1.551
  436    HB3  SER  55           HB3      SER  55   2.666  -4.959   1.160
  437    HG   SER  55           HG       SER  55   4.610  -3.028   0.315
  Start of MODEL    3
    1    H1   GLY   1           H1       GLY   1  38.588  32.242   0.098
    2    H2   GLY   1           H2       GLY   1  39.734  33.393  -0.184
    3    H3   GLY   1           H3       GLY   1  40.058  31.814  -0.537
    4    HA2  GLY   1           HA2      GLY   1  38.023  33.506  -1.888
    5    HA3  GLY   1           HA3      GLY   1  39.614  33.075  -2.552
    6    H    SER   2           H        SER   2  36.424  31.842  -1.672
    7    HA   SER   2           HA       SER   2  35.234  30.000  -2.217
    8    HB2  SER   2           HB2      SER   2  36.671  30.350  -4.866
    9    HB3  SER   2           HB3      SER   2  35.094  29.581  -4.616
   10    HG   SER   2           HG       SER   2  34.252  31.564  -3.946
   11    H    GLU   3           H        GLU   3  37.838  29.173  -1.017
   12    HA   GLU   3           HA       GLU   3  38.578  26.673  -2.362
   13    HB2  GLU   3           HB2      GLU   3  40.217  28.062  -1.149
   14    HB3  GLU   3           HB3      GLU   3  39.339  27.794   0.369
   15    HG2  GLU   3           HG2      GLU   3  39.828  25.387   0.270
   16    HG3  GLU   3           HG3      GLU   3  40.512  25.564  -1.358
   17    H    PHE   4           H        PHE   4  37.749  24.708  -2.021
   18    HA   PHE   4           HA       PHE   4  36.254  24.030   0.454
   19    HB2  PHE   4           HB2      PHE   4  35.204  23.868  -2.391
   20    HB3  PHE   4           HB3      PHE   4  34.663  22.742  -1.166
   21    HD1  PHE   4           HD1      PHE   4  34.634  26.324  -2.156
   22    HD2  PHE   4           HD2      PHE   4  33.153  23.358   0.604
   23    HE1  PHE   4           HE1      PHE   4  32.920  27.933  -1.344
   24    HE2  PHE   4           HE2      PHE   4  31.430  24.959   1.400
   25    HZ   PHE   4           HZ       PHE   4  31.315  27.250   0.433
   26    H    THR   5           H        THR   5  36.579  22.009   1.140
   27    HA   THR   5           HA       THR   5  37.820  19.894  -0.510
   28    HB   THR   5           HB       THR   5  39.115  20.800   2.101
   29    HG1  THR   5           HG1      THR   5  39.848  21.354  -0.575
   30   HG21  THR   5          HG21      THR   5  41.035  19.421   1.279
   31   HG22  THR   5          HG22      THR   5  40.028  18.864  -0.076
   32   HG23  THR   5          HG23      THR   5  39.593  18.461   1.602
   33    H    SER   6           H        SER   6  37.452  17.800   0.401
   34    HA   SER   6           HA       SER   6  35.173  17.481   2.102
   35    HB2  SER   6           HB2      SER   6  35.907  15.060   2.119
   36    HB3  SER   6           HB3      SER   6  35.612  15.783   0.531
   37    HG   SER   6           HG       SER   6  37.555  14.559   0.574
   38    H    SER   7           H        SER   7  34.929  17.101   4.233
   39    HA   SER   7           HA       SER   7  36.932  17.821   6.130
   40    HB2  SER   7           HB2      SER   7  34.336  16.268   6.509
   41    HB3  SER   7           HB3      SER   7  35.283  17.025   7.804
   42    HG   SER   7           HG       SER   7  33.578  18.386   7.105
   43    HA   PRO   8           HA       PRO   8  39.054  13.948   6.813
   44    HB2  PRO   8           HB2      PRO   8  39.760  14.080   9.467
   45    HB3  PRO   8           HB3      PRO   8  40.520  15.072   8.185
   46    HG2  PRO   8           HG2      PRO   8  38.277  15.862  10.069
   47    HG3  PRO   8           HG3      PRO   8  39.769  16.777   9.676
   48    HD2  PRO   8           HD2      PRO   8  37.404  17.310   8.452
   49    HD3  PRO   8           HD3      PRO   8  38.944  17.382   7.545
   50    H    ARG   9           H        ARG   9  38.700  11.875   7.494
   51    HA   ARG   9           HA       ARG   9  36.531  11.158   9.397
   52    HB2  ARG   9           HB2      ARG   9  36.662  10.066   6.543
   53    HB3  ARG   9           HB3      ARG   9  35.515   9.594   7.800
   54    HG2  ARG   9           HG2      ARG   9  34.604  11.946   7.783
   55    HG3  ARG   9           HG3      ARG   9  35.692  12.308   6.428
   56    HD2  ARG   9           HD2      ARG   9  34.636  10.410   5.153
   57    HD3  ARG   9           HD3      ARG   9  33.431  10.269   6.433
   58    HE   ARG   9           HE       ARG   9  33.626  12.308   4.346
   59   HH11  ARG   9          HH11      ARG   9  32.235  11.772   7.521
   60   HH12  ARG   9          HH12      ARG   9  31.045  13.027   7.303
   61   HH21  ARG   9          HH21      ARG   9  32.075  13.870   4.134
   62   HH22  ARG   9          HH22      ARG   9  30.962  14.177   5.435
   63    H    GLY  10           H        GLY  10  36.854   9.133  10.365
   64    HA2  GLY  10           HA2      GLY  10  38.384   6.967   9.697
   65    HA3  GLY  10           HA3      GLY  10  39.617   8.112  10.225
   66    H    ASP  11           H        ASP  11  36.421   6.874  11.393
   67    HA   ASP  11           HA       ASP  11  37.653   6.194  13.997
   68    HB2  ASP  11           HB2      ASP  11  36.799   8.542  14.196
   69    HB3  ASP  11           HB3      ASP  11  35.185   7.967  13.748
   70    H    LYS  12           H        LYS  12  36.408   4.751  15.274
   71    HA   LYS  12           HA       LYS  12  34.055   3.401  14.140
   72    HB2  LYS  12           HB2      LYS  12  36.179   2.391  13.056
   73    HB3  LYS  12           HB3      LYS  12  36.614   1.812  14.654
   74    HG2  LYS  12           HG2      LYS  12  35.616   0.017  13.466
   75    HG3  LYS  12           HG3      LYS  12  34.445   0.496  14.698
   76    HD2  LYS  12           HD2      LYS  12  33.098   1.680  13.040
   77    HD3  LYS  12           HD3      LYS  12  34.326   1.455  11.791
   78    HE2  LYS  12           HE2      LYS  12  32.838  -0.832  13.163
   79    HE3  LYS  12           HE3      LYS  12  32.302  -0.066  11.664
   80    HZ1  LYS  12           HZ1      LYS  12  34.403  -0.737  10.629
   81    HZ2  LYS  12           HZ2      LYS  12  33.595  -2.041  11.182
   82    HZ3  LYS  12           HZ3      LYS  12  34.891  -1.485  12.001
   83    H    ALA  13           H        ALA  13  32.748   2.904  15.763
   84    HA   ALA  13           HA       ALA  13  33.775   2.416  18.528
   85    HB1  ALA  13           HB1      ALA  13  31.662   4.454  17.690
   86    HB2  ALA  13           HB2      ALA  13  32.163   4.094  19.359
   87    HB3  ALA  13           HB3      ALA  13  33.316   4.824  18.230
   88    H    ALA  14           H        ALA  14  32.581   0.630  16.477
   89    HA   ALA  14           HA       ALA  14  29.859   0.005  17.121
   90    HB1  ALA  14           HB1      ALA  14  30.219  -1.797  15.489
   91    HB2  ALA  14           HB2      ALA  14  30.919  -0.283  14.900
   92    HB3  ALA  14           HB3      ALA  14  31.975  -1.550  15.570
   93    H    TYR  15           H        TYR  15  31.424  -0.126  19.549
   94    HA   TYR  15           HA       TYR  15  32.017  -2.862  20.293
   95    HB2  TYR  15           HB2      TYR  15  33.052  -0.605  21.084
   96    HB3  TYR  15           HB3      TYR  15  31.694  -0.512  22.184
   97    HD1  TYR  15           HD1      TYR  15  34.620  -2.589  21.134
   98    HD2  TYR  15           HD2      TYR  15  31.772  -1.752  24.270
   99    HE1  TYR  15           HE1      TYR  15  35.927  -4.016  22.709
  100    HE2  TYR  15           HE2      TYR  15  33.076  -3.180  25.837
  101    HH   TYR  15           HH       TYR  15  34.911  -4.526  26.112
  102    H    ASP  16           H        ASP  16  29.280  -2.547  19.404
  103    HA   ASP  16           HA       ASP  16  27.106  -2.840  19.826
  104    HB2  ASP  16           HB2      ASP  16  28.194  -5.036  20.418
  105    HB3  ASP  16           HB3      ASP  16  28.015  -4.603  22.116
  106    H    ILE  17           H        ILE  17  28.550  -0.732  21.668
  107    HA   ILE  17           HA       ILE  17  26.550  -0.331  23.773
  108    HB   ILE  17           HB       ILE  17  28.863   0.076  24.203
  109   HG12  ILE  17          HG12      ILE  17  26.973   1.426  25.304
  110   HG13  ILE  17          HG13      ILE  17  28.650   1.856  25.577
  111   HG21  ILE  17          HG21      ILE  17  29.714   0.806  22.022
  112   HG22  ILE  17          HG22      ILE  17  28.858   2.350  22.178
  113   HG23  ILE  17          HG23      ILE  17  30.159   1.932  23.303
  114   HD11  ILE  17          HD11      ILE  17  26.856   3.355  23.621
  115   HD12  ILE  17          HD12      ILE  17  27.179   3.829  25.296
  116   HD13  ILE  17          HD13      ILE  17  28.502   3.790  24.123
  117    H    LEU  18           H        LEU  18  27.358   1.195  20.649
  118    HA   LEU  18           HA       LEU  18  25.408   3.309  20.783
  119    HB2  LEU  18           HB2      LEU  18  26.585   1.905  18.343
  120    HB3  LEU  18           HB3      LEU  18  25.730   3.443  18.335
  121    HG   LEU  18           HG       LEU  18  28.446   2.906  19.614
  122   HD11  LEU  18          HD11      LEU  18  27.618   4.577  17.195
  123   HD12  LEU  18          HD12      LEU  18  28.453   2.997  17.146
  124   HD13  LEU  18          HD13      LEU  18  29.267   4.409  17.851
  125   HD21  LEU  18          HD21      LEU  18  28.517   5.408  19.891
  126   HD22  LEU  18          HD22      LEU  18  27.360   4.594  20.945
  127   HD23  LEU  18          HD23      LEU  18  26.781   5.462  19.492
  128    H    ARG  19           H        ARG  19  23.413   3.510  19.750
  129    HA   ARG  19           HA       ARG  19  22.022   1.013  18.826
  130    HB2  ARG  19           HB2      ARG  19  21.457   1.905  21.199
  131    HB3  ARG  19           HB3      ARG  19  20.671   3.245  20.384
  132    HG2  ARG  19           HG2      ARG  19  19.959   0.291  20.025
  133    HG3  ARG  19           HG3      ARG  19  19.188   1.384  21.169
  134    HD2  ARG  19           HD2      ARG  19  18.532   2.848  19.182
  135    HD3  ARG  19           HD3      ARG  19  19.020   1.515  18.142
  136    HE   ARG  19           HE       ARG  19  16.647   1.669  19.837
  137   HH11  ARG  19          HH11      ARG  19  18.657  -0.586  18.040
  138   HH12  ARG  19          HH12      ARG  19  17.383  -1.770  17.945
  139   HH21  ARG  19          HH21      ARG  19  15.067   0.132  19.622
  140   HH22  ARG  19          HH22      ARG  19  15.416  -1.367  18.810
  141    H    ARG  20           H        ARG  20  20.930   1.221  16.957
  142    HA   ARG  20           HA       ARG  20  20.857   3.888  15.607
  143    HB2  ARG  20           HB2      ARG  20  21.578   2.914  13.598
  144    HB3  ARG  20           HB3      ARG  20  22.610   2.229  14.853
  145    HG2  ARG  20           HG2      ARG  20  20.964   0.192  14.822
  146    HG3  ARG  20           HG3      ARG  20  20.382   0.887  13.302
  147    HD2  ARG  20           HD2      ARG  20  22.033  -0.705  12.696
  148    HD3  ARG  20           HD3      ARG  20  22.804   0.881  12.499
  149    HE   ARG  20           HE       ARG  20  23.242  -0.268  15.145
  150   HH11  ARG  20          HH11      ARG  20  24.491  -0.466  11.878
  151   HH12  ARG  20          HH12      ARG  20  26.033  -1.078  12.414
  152   HH21  ARG  20          HH21      ARG  20  25.212  -1.061  15.755
  153   HH22  ARG  20          HH22      ARG  20  26.418  -1.412  14.553
  154    H    CYS  21           H        CYS  21  19.128   4.471  14.414
  155    HA   CYS  21           HA       CYS  21  16.595   3.041  14.932
  156    HB2  CYS  21           HB2      CYS  21  16.877   5.502  15.229
  157    HB3  CYS  21           HB3      CYS  21  17.179   5.645  13.487
  158    H    SER  22           H        SER  22  15.752   1.628  13.542
  159    HA   SER  22           HA       SER  22  16.925   0.911  11.031
  160    HB2  SER  22           HB2      SER  22  15.548  -0.528  12.625
  161    HB3  SER  22           HB3      SER  22  14.104   0.239  11.936
  162    HG   SER  22           HG       SER  22  14.682  -1.752  10.897
  163    H    GLN  23           H        GLN  23  14.737   3.462  11.762
  164    HA   GLN  23           HA       GLN  23  13.892   3.739   8.892
  165    HB2  GLN  23           HB2      GLN  23  12.578   4.709  11.455
  166    HB3  GLN  23           HB3      GLN  23  12.037   5.113   9.816
  167    HG2  GLN  23           HG2      GLN  23  11.664   2.713   9.324
  168    HG3  GLN  23           HG3      GLN  23  12.184   2.281  10.958
  169   HE21  GLN  23          HE21      GLN  23   9.754   1.339  10.321
  170   HE22  GLN  23          HE22      GLN  23   8.494   2.308  11.088
  171    H    CYS  24           H        CYS  24  15.388   5.487  11.633
  172    HA   CYS  24           HA       CYS  24  15.556   7.948  10.014
  173    HB2  CYS  24           HB2      CYS  24  16.493   7.520  12.857
  174    HB3  CYS  24           HB3      CYS  24  16.154   9.039  12.032
  175    H    GLY  25           H        GLY  25  17.691   5.321  10.933
  176    HA2  GLY  25           HA2      GLY  25  19.759   4.780  10.130
  177    HA3  GLY  25           HA3      GLY  25  19.759   6.253   9.160
  178    H    ILE  26           H        ILE  26  19.383   7.654  12.007
  179    HA   ILE  26           HA       ILE  26  22.154   8.282  12.494
  180    HB   ILE  26           HB       ILE  26  20.332   9.871  12.831
  181   HG12  ILE  26          HG12      ILE  26  20.865  10.823  15.023
  182   HG13  ILE  26          HG13      ILE  26  21.684   9.333  15.519
  183   HG21  ILE  26          HG21      ILE  26  19.432   8.153  15.209
  184   HG22  ILE  26          HG22      ILE  26  18.774   9.756  14.707
  185   HG23  ILE  26          HG23      ILE  26  18.550   8.329  13.642
  186   HD11  ILE  26          HD11      ILE  26  22.534  11.178  13.211
  187   HD12  ILE  26          HD12      ILE  26  23.272  11.103  14.846
  188   HD13  ILE  26          HD13      ILE  26  23.417   9.697  13.749
  189    H    LEU  27           H        LEU  27  23.401   7.917  14.389
  190    HA   LEU  27           HA       LEU  27  22.731   5.475  16.016
  191    HB2  LEU  27           HB2      LEU  27  25.456   6.479  15.045
  192    HB3  LEU  27           HB3      LEU  27  25.211   5.291  16.312
  193    HG   LEU  27           HG       LEU  27  23.923   3.903  14.564
  194   HD11  LEU  27          HD11      LEU  27  23.750   5.532  12.734
  195   HD12  LEU  27          HD12      LEU  27  24.749   4.172  12.233
  196   HD13  LEU  27          HD13      LEU  27  25.519   5.708  12.694
  197   HD21  LEU  27          HD21      LEU  27  26.029   2.887  13.771
  198   HD22  LEU  27          HD22      LEU  27  26.106   3.280  15.494
  199   HD23  LEU  27          HD23      LEU  27  26.926   4.328  14.310
  200    H    LEU  28           H        LEU  28  22.661   5.806  18.161
  201    HA   LEU  28           HA       LEU  28  23.773   8.330  19.336
  202    HB2  LEU  28           HB2      LEU  28  21.189   6.893  20.075
  203    HB3  LEU  28           HB3      LEU  28  21.881   8.245  20.935
  204    HG   LEU  28           HG       LEU  28  20.128   9.160  19.793
  205   HD11  LEU  28          HD11      LEU  28  20.996  10.780  18.279
  206   HD12  LEU  28          HD12      LEU  28  22.401   9.776  17.892
  207   HD13  LEU  28          HD13      LEU  28  22.230  10.469  19.515
  208   HD21  LEU  28          HD21      LEU  28  19.629   7.306  18.259
  209   HD22  LEU  28          HD22      LEU  28  20.928   7.847  17.182
  210   HD23  LEU  28          HD23      LEU  28  19.532   8.895  17.483
  211    HA   PRO  29           HA       PRO  29  25.853   5.571  22.109
  212    HB2  PRO  29           HB2      PRO  29  26.374   7.174  24.289
  213    HB3  PRO  29           HB3      PRO  29  27.203   7.300  22.712
  214    HG2  PRO  29           HG2      PRO  29  24.876   8.962  23.722
  215    HG3  PRO  29           HG3      PRO  29  26.370   9.514  22.906
  216    HD2  PRO  29           HD2      PRO  29  24.030   9.166  21.550
  217    HD3  PRO  29           HD3      PRO  29  25.607   8.789  20.804
  218    H    LEU  30           H        LEU  30  23.750   7.480  24.329
  219    HA   LEU  30           HA       LEU  30  22.044   5.256  25.000
  220    HB2  LEU  30           HB2      LEU  30  24.574   5.459  26.432
  221    HB3  LEU  30           HB3      LEU  30  23.259   5.733  27.558
  222    HG   LEU  30           HG       LEU  30  23.298   3.324  25.693
  223   HD11  LEU  30          HD11      LEU  30  25.301   3.273  27.117
  224   HD12  LEU  30          HD12      LEU  30  24.133   2.042  27.619
  225   HD13  LEU  30          HD13      LEU  30  24.300   3.543  28.563
  226   HD21  LEU  30          HD21      LEU  30  21.816   3.879  28.302
  227   HD22  LEU  30          HD22      LEU  30  21.724   2.395  27.328
  228   HD23  LEU  30          HD23      LEU  30  21.090   3.916  26.679
  229    HA   PRO  31           HA       PRO  31  20.634   8.912  27.652
  230    HB2  PRO  31           HB2      PRO  31  22.034  11.260  27.874
  231    HB3  PRO  31           HB3      PRO  31  22.297   9.839  28.928
  232    HG2  PRO  31           HG2      PRO  31  23.884  10.655  26.480
  233    HG3  PRO  31           HG3      PRO  31  24.497  10.148  28.083
  234    HD2  PRO  31           HD2      PRO  31  24.346   8.413  25.999
  235    HD3  PRO  31           HD3      PRO  31  24.011   7.893  27.671
  236    H    ILE  32           H        ILE  32  22.456  10.120  24.797
  237    HA   ILE  32           HA       ILE  32  20.509  12.062  23.982
  238    HB   ILE  32           HB       ILE  32  22.501  10.623  22.196
  239   HG12  ILE  32          HG12      ILE  32  22.931  13.128  23.893
  240   HG13  ILE  32          HG13      ILE  32  23.668  11.553  24.187
  241   HG21  ILE  32          HG21      ILE  32  20.799  11.984  20.983
  242   HG22  ILE  32          HG22      ILE  32  21.229  13.393  21.974
  243   HG23  ILE  32          HG23      ILE  32  22.392  12.689  20.831
  244   HD11  ILE  32          HD11      ILE  32  25.325  12.900  23.176
  245   HD12  ILE  32          HD12      ILE  32  24.824  11.703  21.964
  246   HD13  ILE  32          HD13      ILE  32  24.259  13.392  21.854
  247    H    LEU  33           H        LEU  33  20.717   8.584  23.468
  248    HA   LEU  33           HA       LEU  33  18.845   8.245  21.370
  249    HB2  LEU  33           HB2      LEU  33  20.342   6.469  22.341
  250    HB3  LEU  33           HB3      LEU  33  19.338   6.476  23.791
  251    HG   LEU  33           HG       LEU  33  17.374   5.748  22.404
  252   HD11  LEU  33          HD11      LEU  33  17.754   4.802  20.190
  253   HD12  LEU  33          HD12      LEU  33  19.460   5.305  20.226
  254   HD13  LEU  33          HD13      LEU  33  18.158   6.514  20.172
  255   HD21  LEU  33          HD21      LEU  33  18.636   4.146  23.698
  256   HD22  LEU  33          HD22      LEU  33  19.834   3.976  22.400
  257   HD23  LEU  33          HD23      LEU  33  18.154   3.424  22.155
  258    H    ASN  34           H        ASN  34  18.260   9.017  24.793
  259    HA   ASN  34           HA       ASN  34  15.535   8.287  24.978
  260    HB2  ASN  34           HB2      ASN  34  17.149   9.008  26.807
  261    HB3  ASN  34           HB3      ASN  34  16.903  10.676  26.294
  262   HD21  ASN  34          HD21      ASN  34  15.722   8.150  28.291
  263   HD22  ASN  34          HD22      ASN  34  14.219   8.948  28.747
  264    H    GLN  35           H        GLN  35  16.977  11.315  23.710
  265    HA   GLN  35           HA       GLN  35  14.494  12.646  23.123
  266    HB2  GLN  35           HB2      GLN  35  16.682  13.787  23.331
  267    HB3  GLN  35           HB3      GLN  35  17.236  12.997  21.844
  268    HG2  GLN  35           HG2      GLN  35  15.461  14.145  20.554
  269    HG3  GLN  35           HG3      GLN  35  14.817  14.854  22.039
  270   HE21  GLN  35          HE21      GLN  35  17.590  14.906  19.760
  271   HE22  GLN  35          HE22      GLN  35  18.170  16.477  20.301
  272    H    HIS  36           H        HIS  36  16.558  10.395  21.201
  273    HA   HIS  36           HA       HIS  36  14.937  10.608  18.821
  274    HB2  HIS  36           HB2      HIS  36  17.305   9.596  18.996
  275    HB3  HIS  36           HB3      HIS  36  16.507   8.120  19.557
  276    HD1  HIS  36           HD1      HIS  36  16.835  10.363  16.479
  277    HD2  HIS  36           HD2      HIS  36  14.923   6.817  17.675
  278    HE1  HIS  36           HE1      HIS  36  15.834   9.384  14.384
  279    H    GLN  37           H        GLN  37  14.848   8.327  21.624
  280    HA   GLN  37           HA       GLN  37  12.818   6.653  20.626
  281    HB2  GLN  37           HB2      GLN  37  13.308   7.388  23.542
  282    HB3  GLN  37           HB3      GLN  37  12.338   6.042  22.950
  283    HG2  GLN  37           HG2      GLN  37  14.813   5.677  21.655
  284    HG3  GLN  37           HG3      GLN  37  15.249   6.254  23.264
  285   HE21  GLN  37          HE21      GLN  37  14.486   3.462  21.490
  286   HE22  GLN  37          HE22      GLN  37  14.146   2.424  22.870
  287    H    GLU  38           H        GLU  38  12.361   9.683  22.577
  288    HA   GLU  38           HA       GLU  38   9.483   9.451  22.415
  289    HB2  GLU  38           HB2      GLU  38   9.326  11.637  23.317
  290    HB3  GLU  38           HB3      GLU  38  10.528  10.707  24.204
  291    HG2  GLU  38           HG2      GLU  38  12.340  11.914  23.062
  292    HG3  GLU  38           HG3      GLU  38  11.170  12.817  22.096
  293    H    LYS  39           H        LYS  39  11.810  11.235  20.296
  294    HA   LYS  39           HA       LYS  39   9.723  12.483  18.744
  295    HB2  LYS  39           HB2      LYS  39  11.923  13.452  18.720
  296    HB3  LYS  39           HB3      LYS  39  12.665  11.934  18.216
  297    HG2  LYS  39           HG2      LYS  39  12.621  13.496  16.360
  298    HG3  LYS  39           HG3      LYS  39  11.645  12.083  16.008
  299    HD2  LYS  39           HD2      LYS  39   9.642  13.648  16.876
  300    HD3  LYS  39           HD3      LYS  39  10.774  14.942  16.499
  301    HE2  LYS  39           HE2      LYS  39   9.837  12.727  14.605
  302    HE3  LYS  39           HE3      LYS  39   9.173  14.363  14.651
  303    HZ1  LYS  39           HZ1      LYS  39  11.345  15.215  13.977
  304    HZ2  LYS  39           HZ2      LYS  39  10.823  14.114  12.886
  305    HZ3  LYS  39           HZ3      LYS  39  11.990  13.709  13.954
  306    H    CYS  40           H        CYS  40  11.635   9.540  18.121
  307    HA   CYS  40           HA       CYS  40  10.496   8.904  15.601
  308    HB2  CYS  40           HB2      CYS  40  12.625   8.107  17.009
  309    HB3  CYS  40           HB3      CYS  40  11.560   6.786  17.480
  310    H    ARG  41           H        ARG  41   9.633   7.837  18.929
  311    HA   ARG  41           HA       ARG  41   7.277   6.324  18.322
  312    HB2  ARG  41           HB2      ARG  41   8.338   6.242  20.508
  313    HB3  ARG  41           HB3      ARG  41   8.059   7.976  20.754
  314    HG2  ARG  41           HG2      ARG  41   5.640   7.627  20.848
  315    HG3  ARG  41           HG3      ARG  41   5.849   5.891  20.531
  316    HD2  ARG  41           HD2      ARG  41   6.992   5.574  22.629
  317    HD3  ARG  41           HD3      ARG  41   7.149   7.326  22.881
  318    HE   ARG  41           HE       ARG  41   4.388   6.786  22.668
  319   HH11  ARG  41          HH11      ARG  41   6.944   5.981  24.929
  320   HH12  ARG  41          HH12      ARG  41   5.858   5.979  26.295
  321   HH21  ARG  41          HH21      ARG  41   3.065   6.795  24.451
  322   HH22  ARG  41          HH22      ARG  41   3.720   6.428  26.023
  323    H    TRP  42           H        TRP  42   7.546   9.846  19.140
  324    HA   TRP  42           HA       TRP  42   4.774  10.357  19.008
  325    HB2  TRP  42           HB2      TRP  42   6.504  11.879  19.953
  326    HB3  TRP  42           HB3      TRP  42   7.018  12.292  18.319
  327    HD1  TRP  42           HD1      TRP  42   4.427  12.999  20.942
  328    HE1  TRP  42           HE1      TRP  42   2.822  14.860  20.198
  329    HE3  TRP  42           HE3      TRP  42   5.882  13.430  16.036
  330    HZ2  TRP  42           HZ2      TRP  42   2.186  16.284  17.776
  331    HZ3  TRP  42           HZ3      TRP  42   4.730  15.030  14.528
  332    HH2  TRP  42           HH2      TRP  42   2.883  16.458  15.382
  333    H    LEU  43           H        LEU  43   7.196  10.641  16.361
  334    HA   LEU  43           HA       LEU  43   5.298  11.480  14.390
  335    HB2  LEU  43           HB2      LEU  43   7.916  11.570  14.479
  336    HB3  LEU  43           HB3      LEU  43   7.861   9.961  13.797
  337    HG   LEU  43           HG       LEU  43   8.270  11.635  12.114
  338   HD11  LEU  43          HD11      LEU  43   6.842   9.682  11.445
  339   HD12  LEU  43          HD12      LEU  43   6.652  11.127  10.439
  340   HD13  LEU  43          HD13      LEU  43   5.414  10.731  11.634
  341   HD21  LEU  43          HD21      LEU  43   7.154  13.556  13.239
  342   HD22  LEU  43          HD22      LEU  43   5.576  12.907  12.740
  343   HD23  LEU  43          HD23      LEU  43   6.757  13.416  11.520
  344    H    ALA  44           H        ALA  44   6.596   8.189  15.152
  345    HA   ALA  44           HA       ALA  44   5.054   6.790  13.214
  346    HB1  ALA  44           HB1      ALA  44   7.019   5.857  14.363
  347    HB2  ALA  44           HB2      ALA  44   6.133   5.852  15.907
  348    HB3  ALA  44           HB3      ALA  44   5.605   4.807  14.569
  349    H    SER  45           H        SER  45   4.154   7.822  16.517
  350    HA   SER  45           HA       SER  45   1.578   6.474  16.523
  351    HB2  SER  45           HB2      SER  45   2.895   7.177  18.540
  352    HB3  SER  45           HB3      SER  45   2.505   8.863  18.173
  353    HG   SER  45           HG       SER  45   0.315   8.387  18.501
  354    H    SER  46           H        SER  46   2.666   9.778  15.693
  355    HA   SER  46           HA       SER  46   0.092  10.916  15.161
  356    HB2  SER  46           HB2      SER  46   2.121  12.214  15.647
  357    HB3  SER  46           HB3      SER  46   2.862  11.657  14.135
  358    HG   SER  46           HG       SER  46   1.855  13.765  14.028
  359    H    LYS  47           H        LYS  47   2.315   9.068  13.126
  360    HA   LYS  47           HA       LYS  47   2.302   8.328  10.983
  361    HB2  LYS  47           HB2      LYS  47  -0.721   8.389  11.340
  362    HB3  LYS  47           HB3      LYS  47   0.091   7.598  10.011
  363    HG2  LYS  47           HG2      LYS  47   0.537   6.868  12.927
  364    HG3  LYS  47           HG3      LYS  47  -0.671   6.106  11.916
  365    HD2  LYS  47           HD2      LYS  47   2.269   6.057  11.103
  366    HD3  LYS  47           HD3      LYS  47   1.604   4.944  12.285
  367    HE2  LYS  47           HE2      LYS  47   1.563   3.756  10.288
  368    HE3  LYS  47           HE3      LYS  47  -0.109   4.177  10.651
  369    HZ1  LYS  47           HZ1      LYS  47   0.455   4.518   8.304
  370    HZ2  LYS  47           HZ2      LYS  47   1.624   5.592   8.683
  371    HZ3  LYS  47           HZ3      LYS  47   0.047   5.944   8.978
  372    H    GLY  48           H        GLY  48   2.367  11.226  11.410
  373    HA2  GLY  48           HA2      GLY  48   0.932  12.598   9.337
  374    HA3  GLY  48           HA3      GLY  48   2.296  13.227  10.251
  375    H    LYS  49           H        LYS  49   1.912  13.874   7.623
  376    HA   LYS  49           HA       LYS  49   3.481  12.203   5.813
  377    HB2  LYS  49           HB2      LYS  49   1.395  13.464   5.241
  378    HB3  LYS  49           HB3      LYS  49   2.296  14.965   5.310
  379    HG2  LYS  49           HG2      LYS  49   3.019  12.593   3.505
  380    HG3  LYS  49           HG3      LYS  49   1.878  13.837   3.026
  381    HD2  LYS  49           HD2      LYS  49   4.843  14.282   3.562
  382    HD3  LYS  49           HD3      LYS  49   4.045  14.205   1.996
  383    HE2  LYS  49           HE2      LYS  49   2.677  16.187   2.524
  384    HE3  LYS  49           HE3      LYS  49   3.397  16.282   4.144
  385    HZ1  LYS  49           HZ1      LYS  49   4.462  17.804   2.563
  386    HZ2  LYS  49           HZ2      LYS  49   4.939  16.556   1.614
  387    HZ3  LYS  49           HZ3      LYS  49   5.542  16.718   3.140
  388    H    GLN  50           H        GLN  50   5.431  12.136   6.971
  389    HA   GLN  50           HA       GLN  50   7.271  14.437   6.914
  390    HB2  GLN  50           HB2      GLN  50   7.286  12.582   8.610
  391    HB3  GLN  50           HB3      GLN  50   7.818  11.466   7.349
  392    HG2  GLN  50           HG2      GLN  50   9.936  12.642   7.139
  393    HG3  GLN  50           HG3      GLN  50   9.349  13.991   8.126
  394   HE21  GLN  50          HE21      GLN  50  10.030  10.430   8.308
  395   HE22  GLN  50          HE22      GLN  50  10.510  10.498   9.998
  396    H    VAL  51           H        VAL  51   9.403  14.141   5.674
  397    HA   VAL  51           HA       VAL  51   9.019  12.949   2.949
  398    HB   VAL  51           HB       VAL  51  10.412  14.772   2.047
  399   HG11  VAL  51          HG11      VAL  51   7.890  15.773   3.424
  400   HG12  VAL  51          HG12      VAL  51   8.676  16.476   1.992
  401   HG13  VAL  51          HG13      VAL  51   7.950  14.862   1.896
  402   HG21  VAL  51          HG21      VAL  51  11.557  15.529   4.126
  403   HG22  VAL  51          HG22      VAL  51  10.759  16.853   3.268
  404   HG23  VAL  51          HG23      VAL  51  10.013  16.177   4.727
  405    H    ARG  52           H        ARG  52  10.948  12.271   1.853
  406    HA   ARG  52           HA       ARG  52  13.372  11.761   3.459
  407    HB2  ARG  52           HB2      ARG  52  13.218   9.367   3.416
  408    HB3  ARG  52           HB3      ARG  52  11.780  10.013   4.158
  409    HG2  ARG  52           HG2      ARG  52  10.979   8.270   2.889
  410    HG3  ARG  52           HG3      ARG  52  10.587   9.662   1.885
  411    HD2  ARG  52           HD2      ARG  52  12.345   9.139   0.328
  412    HD3  ARG  52           HD3      ARG  52  13.127   8.034   1.482
  413    HE   ARG  52           HE       ARG  52  10.520   7.056   0.953
  414   HH11  ARG  52          HH11      ARG  52  13.539   7.392  -0.812
  415   HH12  ARG  52          HH12      ARG  52  13.256   5.943  -1.734
  416   HH21  ARG  52          HH21      ARG  52  10.222   5.241  -0.289
  417   HH22  ARG  52          HH22      ARG  52  11.423   4.777  -1.458
  418    H    ASN  53           H        ASN  53  14.960  10.401   2.255
  419    HA   ASN  53           HA       ASN  53  14.826  10.748  -0.716
  420    HB2  ASN  53           HB2      ASN  53  17.162  11.512  -0.711
  421    HB3  ASN  53           HB3      ASN  53  16.099  12.599   0.168
  422   HD21  ASN  53          HD21      ASN  53  16.928  13.309   2.114
  423   HD22  ASN  53          HD22      ASN  53  18.108  12.415   3.066
  424    H    PHE  54           H        PHE  54  15.755   8.593   1.887
  425    HA   PHE  54           HA       PHE  54  16.416   6.521  -0.155
  426    HB2  PHE  54           HB2      PHE  54  18.497   7.675   0.605
  427    HB3  PHE  54           HB3      PHE  54  18.141   7.192   2.257
  428    HD1  PHE  54           HD2      PHE  54  18.701   5.787  -1.193
  429    HD2  PHE  54           HD1      PHE  54  19.000   5.121   3.059
  430    HE1  PHE  54           HE2      PHE  54  19.909   3.655  -1.610
  431    HE2  PHE  54           HE1      PHE  54  20.215   2.995   2.638
  432    HZ   PHE  54           HZ       PHE  54  20.668   2.258   0.305
  433    H    SER  55           H        SER  55  15.011   7.225   2.972
  434    HA   SER  55           HA       SER  55  14.368   4.335   3.421
  435    HB2  SER  55           HB2      SER  55  15.284   6.358   5.505
  436    HB3  SER  55           HB3      SER  55  14.744   4.705   5.831
  437    HG   SER  55           HG       SER  55  16.505   3.939   4.555
  Start of MODEL    4
    1    H1   GLY   1           H1       GLY   1   9.891   4.382   1.583
    2    H2   GLY   1           H2       GLY   1   8.554   3.481   1.868
    3    H3   GLY   1           H3       GLY   1   8.685   4.334   0.475
    4    HA2  GLY   1           HA2      GLY   1   9.087   2.052  -0.034
    5    HA3  GLY   1           HA3      GLY   1  10.588   2.981  -0.203
    6    H    SER   2           H        SER   2  11.329   0.648   0.007
    7    HA   SER   2           HA       SER   2  11.995   0.009   2.857
    8    HB2  SER   2           HB2      SER   2  11.429  -1.953   0.606
    9    HB3  SER   2           HB3      SER   2  12.042  -2.376   2.214
   10    HG   SER   2           HG       SER   2  10.117  -1.622   3.124
   11    H    GLU   3           H        GLU   3  14.025   0.572   3.107
   12    HA   GLU   3           HA       GLU   3  15.768   0.961   0.814
   13    HB2  GLU   3           HB2      GLU   3  16.288   1.564   3.746
   14    HB3  GLU   3           HB3      GLU   3  17.141   2.227   2.350
   15    HG2  GLU   3           HG2      GLU   3  14.275   2.776   3.219
   16    HG3  GLU   3           HG3      GLU   3  15.629   3.889   3.235
   17    H    PHE   4           H        PHE   4  15.506  -1.685   0.885
   18    HA   PHE   4           HA       PHE   4  16.861  -3.426   2.460
   19    HB2  PHE   4           HB2      PHE   4  16.528  -3.391  -0.555
   20    HB3  PHE   4           HB3      PHE   4  17.319  -4.725   0.253
   21    HD1  PHE   4           HD1      PHE   4  16.129  -6.229   1.791
   22    HD2  PHE   4           HD2      PHE   4  14.074  -3.166  -0.444
   23    HE1  PHE   4           HE1      PHE   4  13.972  -7.400   2.168
   24    HE2  PHE   4           HE2      PHE   4  11.916  -4.332  -0.050
   25    HZ   PHE   4           HZ       PHE   4  11.862  -6.450   1.252
   26    H    THR   5           H        THR   5  18.505  -1.752  -0.241
   27    HA   THR   5           HA       THR   5  21.159  -2.190   1.073
   28    HB   THR   5           HB       THR   5  22.109  -2.664  -1.208
   29    HG1  THR   5           HG1      THR   5  20.515  -1.955  -2.565
   30   HG21  THR   5          HG21      THR   5  21.488  -4.983  -1.300
   31   HG22  THR   5          HG22      THR   5  20.007  -4.693  -0.370
   32   HG23  THR   5          HG23      THR   5  21.596  -4.500   0.400
   33    H    SER   6           H        SER   6  19.150   0.168   0.359
   34    HA   SER   6           HA       SER   6  20.854   1.877  -1.328
   35    HB2  SER   6           HB2      SER   6  18.322   1.530  -1.562
   36    HB3  SER   6           HB3      SER   6  18.155   2.625  -0.180
   37    HG   SER   6           HG       SER   6  18.098   3.656  -2.286
   38    H    SER   7           H        SER   7  22.227   1.415   0.918
   39    HA   SER   7           HA       SER   7  22.283   4.009   2.378
   40    HB2  SER   7           HB2      SER   7  22.238   1.260   3.703
   41    HB3  SER   7           HB3      SER   7  22.571   2.779   4.541
   42    HG   SER   7           HG       SER   7  20.460   3.493   3.900
   43    HA   PRO   8           HA       PRO   8  26.680   3.500   1.902
   44    HB2  PRO   8           HB2      PRO   8  27.704   4.894   4.038
   45    HB3  PRO   8           HB3      PRO   8  26.916   5.674   2.634
   46    HG2  PRO   8           HG2      PRO   8  25.674   4.982   5.314
   47    HG3  PRO   8           HG3      PRO   8  25.592   6.536   4.424
   48    HD2  PRO   8           HD2      PRO   8  23.590   4.717   4.289
   49    HD3  PRO   8           HD3      PRO   8  24.068   5.657   2.845
   50    H    ARG   9           H        ARG   9  28.467   2.305   2.651
   51    HA   ARG   9           HA       ARG   9  27.894  -0.053   4.177
   52    HB2  ARG   9           HB2      ARG   9  30.509   1.199   3.226
   53    HB3  ARG   9           HB3      ARG   9  30.448  -0.347   4.059
   54    HG2  ARG   9           HG2      ARG   9  29.033   0.233   1.418
   55    HG3  ARG   9           HG3      ARG   9  30.592  -0.574   1.607
   56    HD2  ARG   9           HD2      ARG   9  29.356  -2.275   3.124
   57    HD3  ARG   9           HD3      ARG   9  27.864  -1.559   2.520
   58    HE   ARG   9           HE       ARG   9  28.194  -2.550   0.441
   59   HH11  ARG   9          HH11      ARG   9  31.139  -3.022   2.292
   60   HH12  ARG   9          HH12      ARG   9  31.768  -4.186   1.159
   61   HH21  ARG   9          HH21      ARG   9  29.061  -4.047  -0.953
   62   HH22  ARG   9          HH22      ARG   9  30.620  -4.745  -0.623
   63    H    GLY  10           H        GLY  10  29.531   2.926   5.170
   64    HA2  GLY  10           HA2      GLY  10  30.352   3.651   7.212
   65    HA3  GLY  10           HA3      GLY  10  28.950   2.835   7.899
   66    H    ASP  11           H        ASP  11  29.701   1.791   9.657
   67    HA   ASP  11           HA       ASP  11  31.490  -0.485   9.253
   68    HB2  ASP  11           HB2      ASP  11  32.973  -0.047  11.068
   69    HB3  ASP  11           HB3      ASP  11  33.046   1.318   9.970
   70    H    LYS  12           H        LYS  12  31.493  -1.955  11.153
   71    HA   LYS  12           HA       LYS  12  28.739  -2.433  11.939
   72    HB2  LYS  12           HB2      LYS  12  30.485  -4.161  11.134
   73    HB3  LYS  12           HB3      LYS  12  31.151  -4.087  12.756
   74    HG2  LYS  12           HG2      LYS  12  29.663  -5.890  12.916
   75    HG3  LYS  12           HG3      LYS  12  28.698  -4.569  13.557
   76    HD2  LYS  12           HD2      LYS  12  27.237  -5.718  12.102
   77    HD3  LYS  12           HD3      LYS  12  27.738  -4.311  11.156
   78    HE2  LYS  12           HE2      LYS  12  29.515  -5.762  10.073
   79    HE3  LYS  12           HE3      LYS  12  28.881  -7.138  10.979
   80    HZ1  LYS  12           HZ1      LYS  12  27.950  -7.066   8.750
   81    HZ2  LYS  12           HZ2      LYS  12  27.358  -5.564   8.970
   82    HZ3  LYS  12           HZ3      LYS  12  26.748  -6.818   9.823
   83    H    ALA  13           H        ALA  13  28.504  -0.499  13.194
   84    HA   ALA  13           HA       ALA  13  29.680   0.031  15.691
   85    HB1  ALA  13           HB1      ALA  13  27.723   1.495  16.003
   86    HB2  ALA  13           HB2      ALA  13  28.332   1.601  14.341
   87    HB3  ALA  13           HB3      ALA  13  26.864   0.656  14.699
   88    H    ALA  14           H        ALA  14  27.814  -2.701  15.109
   89    HA   ALA  14           HA       ALA  14  26.246  -2.950  17.488
   90    HB1  ALA  14           HB1      ALA  14  25.859  -5.217  16.635
   91    HB2  ALA  14           HB2      ALA  14  25.727  -4.030  15.327
   92    HB3  ALA  14           HB3      ALA  14  27.190  -5.034  15.474
   93    H    TYR  15           H        TYR  15  28.358  -2.214  18.745
   94    HA   TYR  15           HA       TYR  15  29.639  -4.631  19.960
   95    HB2  TYR  15           HB2      TYR  15  31.072  -3.164  18.450
   96    HB3  TYR  15           HB3      TYR  15  30.924  -1.900  19.655
   97    HD1  TYR  15           HD1      TYR  15  32.038  -5.440  19.122
   98    HD2  TYR  15           HD2      TYR  15  32.434  -1.881  21.531
   99    HE1  TYR  15           HE1      TYR  15  33.964  -6.467  20.331
  100    HE2  TYR  15           HE2      TYR  15  34.353  -2.908  22.738
  101    HH   TYR  15           HH       TYR  15  35.703  -4.748  22.955
  102    H    ASP  16           H        ASP  16  27.155  -3.420  20.784
  103    HA   ASP  16           HA       ASP  16  26.008  -2.575  22.531
  104    HB2  ASP  16           HB2      ASP  16  26.885  -4.773  23.319
  105    HB3  ASP  16           HB3      ASP  16  28.173  -3.925  24.173
  106    H    ILE  17           H        ILE  17  27.550  -0.652  21.434
  107    HA   ILE  17           HA       ILE  17  28.270   1.189  23.681
  108    HB   ILE  17           HB       ILE  17  30.275   0.330  22.647
  109   HG12  ILE  17          HG12      ILE  17  29.801   3.223  21.801
  110   HG13  ILE  17          HG13      ILE  17  30.181   2.682  23.439
  111   HG21  ILE  17          HG21      ILE  17  30.867   0.629  20.306
  112   HG22  ILE  17          HG22      ILE  17  29.357  -0.257  20.388
  113   HG23  ILE  17          HG23      ILE  17  29.343   1.464  19.969
  114   HD11  ILE  17          HD11      ILE  17  31.983   2.501  20.992
  115   HD12  ILE  17          HD12      ILE  17  32.177   3.542  22.407
  116   HD13  ILE  17          HD13      ILE  17  32.367   1.785  22.579
  117    H    LEU  18           H        LEU  18  26.755   0.867  20.527
  118    HA   LEU  18           HA       LEU  18  25.397   3.489  20.854
  119    HB2  LEU  18           HB2      LEU  18  26.553   2.388  18.257
  120    HB3  LEU  18           HB3      LEU  18  25.587   3.846  18.406
  121    HG   LEU  18           HG       LEU  18  28.386   3.492  19.559
  122   HD11  LEU  18          HD11      LEU  18  28.339   3.530  17.091
  123   HD12  LEU  18          HD12      LEU  18  29.085   4.986  17.757
  124   HD13  LEU  18          HD13      LEU  18  27.422   5.054  17.132
  125   HD21  LEU  18          HD21      LEU  18  27.239   5.154  20.860
  126   HD22  LEU  18          HD22      LEU  18  26.561   5.927  19.404
  127   HD23  LEU  18          HD23      LEU  18  28.305   5.996  19.750
  128    H    ARG  19           H        ARG  19  23.394   3.564  19.606
  129    HA   ARG  19           HA       ARG  19  22.333   0.961  18.593
  130    HB2  ARG  19           HB2      ARG  19  21.330   1.391  20.825
  131    HB3  ARG  19           HB3      ARG  19  20.864   3.010  20.306
  132    HG2  ARG  19           HG2      ARG  19  18.918   1.569  20.271
  133    HG3  ARG  19           HG3      ARG  19  19.315   2.054  18.630
  134    HD2  ARG  19           HD2      ARG  19  20.580  -0.235  18.474
  135    HD3  ARG  19           HD3      ARG  19  19.738  -0.634  19.978
  136    HE   ARG  19           HE       ARG  19  18.055   0.348  17.757
  137   HH11  ARG  19          HH11      ARG  19  19.417  -2.577  19.134
  138   HH12  ARG  19          HH12      ARG  19  18.222  -3.594  18.378
  139   HH21  ARG  19          HH21      ARG  19  16.528  -0.996  16.889
  140   HH22  ARG  19          HH22      ARG  19  16.629  -2.716  17.140
  141    H    ARG  20           H        ARG  20  21.335   1.082  16.677
  142    HA   ARG  20           HA       ARG  20  21.057   3.728  15.338
  143    HB2  ARG  20           HB2      ARG  20  21.118   2.586  13.239
  144    HB3  ARG  20           HB3      ARG  20  22.506   2.089  14.203
  145    HG2  ARG  20           HG2      ARG  20  21.363  -0.064  14.745
  146    HG3  ARG  20           HG3      ARG  20  19.967   0.456  13.790
  147    HD2  ARG  20           HD2      ARG  20  21.181  -0.969  12.378
  148    HD3  ARG  20           HD3      ARG  20  21.494   0.650  11.779
  149    HE   ARG  20           HE       ARG  20  23.364  -1.117  13.325
  150   HH11  ARG  20          HH11      ARG  20  23.086   1.747  11.313
  151   HH12  ARG  20          HH12      ARG  20  24.797   1.778  10.987
  152   HH21  ARG  20          HH21      ARG  20  25.499  -1.046  12.801
  153   HH22  ARG  20          HH22      ARG  20  26.120   0.243  11.808
  154    H    CYS  21           H        CYS  21  19.223   4.297  14.219
  155    HA   CYS  21           HA       CYS  21  16.670   3.030  15.096
  156    HB2  CYS  21           HB2      CYS  21  17.055   5.446  15.509
  157    HB3  CYS  21           HB3      CYS  21  17.254   5.695  13.767
  158    H    SER  22           H        SER  22  15.685   1.673  13.734
  159    HA   SER  22           HA       SER  22  16.660   1.081  11.092
  160    HB2  SER  22           HB2      SER  22  14.735  -0.513  11.037
  161    HB3  SER  22           HB3      SER  22  15.788  -0.689  12.447
  162    HG   SER  22           HG       SER  22  13.479  -0.697  12.908
  163    H    GLN  23           H        GLN  23  14.600   3.559  12.053
  164    HA   GLN  23           HA       GLN  23  13.338   3.775   9.338
  165    HB2  GLN  23           HB2      GLN  23  12.300   4.622  12.069
  166    HB3  GLN  23           HB3      GLN  23  11.532   5.034  10.531
  167    HG2  GLN  23           HG2      GLN  23  11.216   2.634  10.015
  168    HG3  GLN  23           HG3      GLN  23  11.972   2.192  11.549
  169   HE21  GLN  23          HE21      GLN  23   9.092   3.799  10.119
  170   HE22  GLN  23          HE22      GLN  23   8.114   3.607  11.568
  171    H    CYS  24           H        CYS  24  15.685   5.190  11.294
  172    HA   CYS  24           HA       CYS  24  15.412   7.856   9.954
  173    HB2  CYS  24           HB2      CYS  24  16.443   7.339  12.756
  174    HB3  CYS  24           HB3      CYS  24  16.151   8.896  11.993
  175    H    GLY  25           H        GLY  25  17.643   5.271  10.893
  176    HA2  GLY  25           HA2      GLY  25  19.722   4.780  10.073
  177    HA3  GLY  25           HA3      GLY  25  19.679   6.231   9.075
  178    H    ILE  26           H        ILE  26  19.173   7.519  12.019
  179    HA   ILE  26           HA       ILE  26  21.892   8.375  12.497
  180    HB   ILE  26           HB       ILE  26  19.861   9.738  12.886
  181   HG12  ILE  26          HG12      ILE  26  21.522   9.438  15.416
  182   HG13  ILE  26          HG13      ILE  26  22.055  10.256  13.946
  183   HG21  ILE  26          HG21      ILE  26  19.368   7.965  15.322
  184   HG22  ILE  26          HG22      ILE  26  18.467   9.423  14.878
  185   HG23  ILE  26          HG23      ILE  26  18.382   7.999  13.854
  186   HD11  ILE  26          HD11      ILE  26  20.161  11.866  14.181
  187   HD12  ILE  26          HD12      ILE  26  19.723  11.087  15.723
  188   HD13  ILE  26          HD13      ILE  26  21.288  11.891  15.552
  189    H    LEU  27           H        LEU  27  23.153   8.033  14.427
  190    HA   LEU  27           HA       LEU  27  22.575   5.568  16.013
  191    HB2  LEU  27           HB2      LEU  27  25.269   6.538  14.954
  192    HB3  LEU  27           HB3      LEU  27  25.076   5.413  16.285
  193    HG   LEU  27           HG       LEU  27  23.792   3.884  14.704
  194   HD11  LEU  27          HD11      LEU  27  24.484   4.088  12.289
  195   HD12  LEU  27          HD12      LEU  27  25.103   5.715  12.639
  196   HD13  LEU  27          HD13      LEU  27  23.371   5.351  12.793
  197   HD21  LEU  27          HD21      LEU  27  26.118   3.498  15.479
  198   HD22  LEU  27          HD22      LEU  27  26.725   4.443  14.101
  199   HD23  LEU  27          HD23      LEU  27  25.857   2.915  13.832
  200    H    LEU  28           H        LEU  28  22.520   5.881  18.150
  201    HA   LEU  28           HA       LEU  28  23.760   8.321  19.376
  202    HB2  LEU  28           HB2      LEU  28  21.081   7.060  20.099
  203    HB3  LEU  28           HB3      LEU  28  21.874   8.335  20.983
  204    HG   LEU  28           HG       LEU  28  20.163   9.386  19.906
  205   HD11  LEU  28          HD11      LEU  28  22.418   9.931  17.962
  206   HD12  LEU  28          HD12      LEU  28  22.357  10.561  19.621
  207   HD13  LEU  28          HD13      LEU  28  21.102  11.007  18.448
  208   HD21  LEU  28          HD21      LEU  28  20.850   8.099  17.252
  209   HD22  LEU  28          HD22      LEU  28  19.533   9.235  17.583
  210   HD23  LEU  28          HD23      LEU  28  19.520   7.627  18.325
  211    HA   PRO  29           HA       PRO  29  25.535   5.274  22.084
  212    HB2  PRO  29           HB2      PRO  29  26.207   6.715  24.318
  213    HB3  PRO  29           HB3      PRO  29  27.039   6.858  22.745
  214    HG2  PRO  29           HG2      PRO  29  24.862   8.641  23.859
  215    HG3  PRO  29           HG3      PRO  29  26.394   9.121  23.071
  216    HD2  PRO  29           HD2      PRO  29  24.022   9.042  21.718
  217    HD3  PRO  29           HD3      PRO  29  25.566   8.602  20.933
  218    H    LEU  30           H        LEU  30  23.620   7.279  24.365
  219    HA   LEU  30           HA       LEU  30  21.743   5.164  24.997
  220    HB2  LEU  30           HB2      LEU  30  24.287   5.256  26.439
  221    HB3  LEU  30           HB3      LEU  30  22.963   5.532  27.556
  222    HG   LEU  30           HG       LEU  30  22.860   3.197  25.619
  223   HD11  LEU  30          HD11      LEU  30  24.983   3.077  26.932
  224   HD12  LEU  30          HD12      LEU  30  23.849   1.776  27.293
  225   HD13  LEU  30          HD13      LEU  30  24.027   3.132  28.424
  226   HD21  LEU  30          HD21      LEU  30  20.772   3.830  26.818
  227   HD22  LEU  30          HD22      LEU  30  21.628   3.666  28.368
  228   HD23  LEU  30          HD23      LEU  30  21.385   2.246  27.328
  229    HA   PRO  31           HA       PRO  31  20.527   8.840  27.663
  230    HB2  PRO  31           HB2      PRO  31  22.053  11.089  28.020
  231    HB3  PRO  31           HB3      PRO  31  22.186   9.611  29.020
  232    HG2  PRO  31           HG2      PRO  31  23.913  10.437  26.680
  233    HG3  PRO  31           HG3      PRO  31  24.427   9.798  28.268
  234    HD2  PRO  31           HD2      PRO  31  24.235   8.198  26.070
  235    HD3  PRO  31           HD3      PRO  31  23.832   7.612  27.706
  236    H    ILE  32           H        ILE  32  22.423  10.059  24.831
  237    HA   ILE  32           HA       ILE  32  20.421  12.026  24.099
  238    HB   ILE  32           HB       ILE  32  22.542  10.779  22.308
  239   HG12  ILE  32          HG12      ILE  32  23.426  13.333  22.899
  240   HG13  ILE  32          HG13      ILE  32  22.667  12.913  24.423
  241   HG21  ILE  32          HG21      ILE  32  20.944  13.368  22.047
  242   HG22  ILE  32          HG22      ILE  32  22.281  12.865  20.988
  243   HG23  ILE  32          HG23      ILE  32  20.792  11.935  21.009
  244   HD11  ILE  32          HD11      ILE  32  24.892  11.408  22.972
  245   HD12  ILE  32          HD12      ILE  32  25.033  12.344  24.473
  246   HD13  ILE  32          HD13      ILE  32  24.119  10.824  24.461
  247    H    LEU  33           H        LEU  33  20.684   8.562  23.546
  248    HA   LEU  33           HA       LEU  33  18.823   8.295  21.415
  249    HB2  LEU  33           HB2      LEU  33  20.309   6.467  22.311
  250    HB3  LEU  33           HB3      LEU  33  19.281   6.399  23.740
  251    HG   LEU  33           HG       LEU  33  17.338   5.735  22.324
  252   HD11  LEU  33          HD11      LEU  33  17.709   4.932  20.041
  253   HD12  LEU  33          HD12      LEU  33  19.401   5.458  20.093
  254   HD13  LEU  33          HD13      LEU  33  18.079   6.653  20.128
  255   HD21  LEU  33          HD21      LEU  33  18.112   3.446  21.930
  256   HD22  LEU  33          HD22      LEU  33  18.706   4.068  23.477
  257   HD23  LEU  33          HD23      LEU  33  19.803   3.982  22.088
  258    H    ASN  34           H        ASN  34  18.208   8.988  24.871
  259    HA   ASN  34           HA       ASN  34  15.431   8.323  24.867
  260    HB2  ASN  34           HB2      ASN  34  16.962  10.441  26.443
  261    HB3  ASN  34           HB3      ASN  34  15.287  10.000  26.743
  262   HD21  ASN  34          HD21      ASN  34  14.890   7.549  27.126
  263   HD22  ASN  34          HD22      ASN  34  16.107   6.766  28.122
  264    H    GLN  35           H        GLN  35  17.065  11.315  23.750
  265    HA   GLN  35           HA       GLN  35  14.627  12.782  23.246
  266    HB2  GLN  35           HB2      GLN  35  16.902  13.817  23.491
  267    HB3  GLN  35           HB3      GLN  35  17.354  13.119  21.928
  268    HG2  GLN  35           HG2      GLN  35  15.404  14.389  20.888
  269    HG3  GLN  35           HG3      GLN  35  15.131  15.147  22.456
  270   HE21  GLN  35          HE21      GLN  35  17.194  15.060  19.584
  271   HE22  GLN  35          HE22      GLN  35  18.145  16.468  20.029
  272    H    HIS  36           H        HIS  36  16.740  10.738  21.111
  273    HA   HIS  36           HA       HIS  36  15.047  11.090  18.809
  274    HB2  HIS  36           HB2      HIS  36  17.402  10.194  18.723
  275    HB3  HIS  36           HB3      HIS  36  16.791   8.659  19.354
  276    HD1  HIS  36           HD1      HIS  36  16.427  10.965  16.279
  277    HD2  HIS  36           HD2      HIS  36  15.409   7.105  17.589
  278    HE1  HIS  36           HE1      HIS  36  15.421   9.797  14.272
  279    H    GLN  37           H        GLN  37  15.085   8.566  21.371
  280    HA   GLN  37           HA       GLN  37  13.127   6.892  20.314
  281    HB2  GLN  37           HB2      GLN  37  14.636   6.426  22.259
  282    HB3  GLN  37           HB3      GLN  37  13.641   7.483  23.258
  283    HG2  GLN  37           HG2      GLN  37  13.073   5.150  23.650
  284    HG3  GLN  37           HG3      GLN  37  11.697   5.974  22.921
  285   HE21  GLN  37          HE21      GLN  37  14.653   4.138  21.803
  286   HE22  GLN  37          HE22      GLN  37  13.763   3.230  20.591
  287    H    GLU  38           H        GLU  38  12.520   9.675  22.610
  288    HA   GLU  38           HA       GLU  38   9.677   9.266  22.502
  289    HB2  GLU  38           HB2      GLU  38   9.398  11.335  23.600
  290    HB3  GLU  38           HB3      GLU  38  10.760  10.489  24.322
  291    HG2  GLU  38           HG2      GLU  38  12.326  11.977  23.086
  292    HG3  GLU  38           HG3      GLU  38  10.957  12.825  22.367
  293    H    LYS  39           H        LYS  39  11.781  11.343  20.469
  294    HA   LYS  39           HA       LYS  39   9.569  12.611  19.111
  295    HB2  LYS  39           HB2      LYS  39  11.989  13.402  19.448
  296    HB3  LYS  39           HB3      LYS  39  12.438  12.388  18.089
  297    HG2  LYS  39           HG2      LYS  39  10.276  14.546  17.982
  298    HG3  LYS  39           HG3      LYS  39  11.969  14.910  17.720
  299    HD2  LYS  39           HD2      LYS  39  10.344  13.000  16.003
  300    HD3  LYS  39           HD3      LYS  39  10.624  14.683  15.622
  301    HE2  LYS  39           HE2      LYS  39  12.868  12.642  15.976
  302    HE3  LYS  39           HE3      LYS  39  12.101  13.002  14.429
  303    HZ1  LYS  39           HZ1      LYS  39  12.807  15.316  14.663
  304    HZ2  LYS  39           HZ2      LYS  39  14.098  14.325  14.705
  305    HZ3  LYS  39           HZ3      LYS  39  13.548  14.999  16.085
  306    H    CYS  40           H        CYS  40  11.721   9.947  18.161
  307    HA   CYS  40           HA       CYS  40  10.627   9.361  15.614
  308    HB2  CYS  40           HB2      CYS  40  12.843   8.761  16.703
  309    HB3  CYS  40           HB3      CYS  40  12.003   7.495  17.595
  310    H    ARG  41           H        ARG  41   9.882   7.973  18.870
  311    HA   ARG  41           HA       ARG  41   7.738   6.252  18.066
  312    HB2  ARG  41           HB2      ARG  41   8.920   6.096  20.188
  313    HB3  ARG  41           HB3      ARG  41   8.292   7.655  20.715
  314    HG2  ARG  41           HG2      ARG  41   6.473   5.292  20.096
  315    HG3  ARG  41           HG3      ARG  41   7.274   5.508  21.650
  316    HD2  ARG  41           HD2      ARG  41   6.194   7.888  21.671
  317    HD3  ARG  41           HD3      ARG  41   5.139   7.258  20.409
  318    HE   ARG  41           HE       ARG  41   4.065   5.880  21.942
  319   HH11  ARG  41          HH11      ARG  41   6.841   7.283  23.572
  320   HH12  ARG  41          HH12      ARG  41   6.289   6.765  25.141
  321   HH21  ARG  41          HH21      ARG  41   3.433   5.253  23.977
  322   HH22  ARG  41          HH22      ARG  41   4.418   5.647  25.356
  323    H    TRP  42           H        TRP  42   7.595   9.667  19.247
  324    HA   TRP  42           HA       TRP  42   4.759   9.872  19.058
  325    HB2  TRP  42           HB2      TRP  42   6.296  11.410  20.300
  326    HB3  TRP  42           HB3      TRP  42   6.787  12.117  18.763
  327    HD1  TRP  42           HD1      TRP  42   4.106  12.152  21.381
  328    HE1  TRP  42           HE1      TRP  42   2.286  13.883  20.850
  329    HE3  TRP  42           HE3      TRP  42   5.528  13.394  16.609
  330    HZ2  TRP  42           HZ2      TRP  42   1.485  15.514  18.613
  331    HZ3  TRP  42           HZ3      TRP  42   4.184  15.015  15.289
  332    HH2  TRP  42           HH2      TRP  42   2.164  16.072  16.273
  333    H    LEU  43           H        LEU  43   7.277  10.664  16.592
  334    HA   LEU  43           HA       LEU  43   5.381  11.418  14.553
  335    HB2  LEU  43           HB2      LEU  43   8.214  10.318  14.422
  336    HB3  LEU  43           HB3      LEU  43   7.282  10.727  12.986
  337    HG   LEU  43           HG       LEU  43   8.055  12.701  15.175
  338   HD11  LEU  43          HD11      LEU  43   9.046  12.355  12.308
  339   HD12  LEU  43          HD12      LEU  43   9.949  11.909  13.771
  340   HD13  LEU  43          HD13      LEU  43   9.562  13.613  13.450
  341   HD21  LEU  43          HD21      LEU  43   5.969  13.440  14.116
  342   HD22  LEU  43          HD22      LEU  43   6.654  13.145  12.502
  343   HD23  LEU  43          HD23      LEU  43   7.308  14.429  13.543
  344    H    ALA  44           H        ALA  44   6.879   8.186  15.257
  345    HA   ALA  44           HA       ALA  44   5.596   6.821  13.169
  346    HB1  ALA  44           HB1      ALA  44   6.418   5.777  15.911
  347    HB2  ALA  44           HB2      ALA  44   6.084   4.787  14.475
  348    HB3  ALA  44           HB3      ALA  44   7.459   5.906  14.473
  349    H    SER  45           H        SER  45   4.258   7.483  16.465
  350    HA   SER  45           HA       SER  45   1.787   6.041  15.889
  351    HB2  SER  45           HB2      SER  45   0.977   6.928  17.983
  352    HB3  SER  45           HB3      SER  45   2.600   6.249  18.169
  353    HG   SER  45           HG       SER  45   2.313   8.292  19.224
  354    H    SER  46           H        SER  46   2.794   9.449  15.557
  355    HA   SER  46           HA       SER  46   0.146  10.416  14.871
  356    HB2  SER  46           HB2      SER  46   2.031  11.767  15.851
  357    HB3  SER  46           HB3      SER  46   2.830  11.714  14.270
  358    HG   SER  46           HG       SER  46   0.933  12.748  13.405
  359    H    LYS  47           H        LYS  47   2.711   8.971  12.968
  360    HA   LYS  47           HA       LYS  47   1.912   9.893  10.372
  361    HB2  LYS  47           HB2      LYS  47   4.194   9.140  11.154
  362    HB3  LYS  47           HB3      LYS  47   3.621   7.480  11.118
  363    HG2  LYS  47           HG2      LYS  47   4.988   8.002   9.201
  364    HG3  LYS  47           HG3      LYS  47   3.352   7.679   8.641
  365    HD2  LYS  47           HD2      LYS  47   2.940  10.081   8.311
  366    HD3  LYS  47           HD3      LYS  47   4.462  10.481   9.118
  367    HE2  LYS  47           HE2      LYS  47   4.765  10.719   6.738
  368    HE3  LYS  47           HE3      LYS  47   5.746   9.380   7.330
  369    HZ1  LYS  47           HZ1      LYS  47   4.052   7.844   6.483
  370    HZ2  LYS  47           HZ2      LYS  47   4.595   8.793   5.279
  371    HZ3  LYS  47           HZ3      LYS  47   3.131   9.084   5.944
  372    H    GLY  48           H        GLY  48  -0.430   9.095  11.396
  373    HA2  GLY  48           HA2      GLY  48  -1.275   6.414  10.657
  374    HA3  GLY  48           HA3      GLY  48  -2.297   7.744  11.194
  375    H    LYS  49           H        LYS  49  -0.176   7.251   8.358
  376    HA   LYS  49           HA       LYS  49  -0.373   7.826   6.157
  377    HB2  LYS  49           HB2      LYS  49  -1.521   5.562   6.604
  378    HB3  LYS  49           HB3      LYS  49  -3.023   6.359   6.225
  379    HG2  LYS  49           HG2      LYS  49  -0.536   6.146   4.462
  380    HG3  LYS  49           HG3      LYS  49  -1.930   5.096   4.333
  381    HD2  LYS  49           HD2      LYS  49  -2.032   8.088   3.733
  382    HD3  LYS  49           HD3      LYS  49  -1.647   6.856   2.564
  383    HE2  LYS  49           HE2      LYS  49  -3.938   7.496   2.300
  384    HE3  LYS  49           HE3      LYS  49  -3.830   5.802   2.774
  385    HZ1  LYS  49           HZ1      LYS  49  -4.564   6.378   4.963
  386    HZ2  LYS  49           HZ2      LYS  49  -5.581   7.146   3.946
  387    HZ3  LYS  49           HZ3      LYS  49  -4.392   7.981   4.712
  388    H    GLN  50           H        GLN  50  -0.550  10.063   6.933
  389    HA   GLN  50           HA       GLN  50  -2.963  11.438   5.849
  390    HB2  GLN  50           HB2      GLN  50  -3.001  12.905   7.817
  391    HB3  GLN  50           HB3      GLN  50  -3.342  11.225   8.198
  392    HG2  GLN  50           HG2      GLN  50  -1.129  10.906   9.175
  393    HG3  GLN  50           HG3      GLN  50  -0.609  12.503   8.636
  394   HE21  GLN  50          HE21      GLN  50  -0.719  14.095  10.214
  395   HE22  GLN  50          HE22      GLN  50  -1.813  14.032  11.589
  396    H    VAL  51           H        VAL  51  -0.828  11.227   4.264
  397    HA   VAL  51           HA       VAL  51   0.476  13.925   4.271
  398    HB   VAL  51           HB       VAL  51   2.511  12.865   3.342
  399   HG11  VAL  51          HG11      VAL  51   1.802  11.797   6.101
  400   HG12  VAL  51          HG12      VAL  51   3.425  12.096   5.434
  401   HG13  VAL  51          HG13      VAL  51   2.334  13.454   5.745
  402   HG21  VAL  51          HG21      VAL  51   1.489  10.708   2.560
  403   HG22  VAL  51          HG22      VAL  51   2.935  10.492   3.550
  404   HG23  VAL  51          HG23      VAL  51   1.326  10.202   4.251
  405    H    ARG  52           H        ARG  52   1.217  14.700   2.237
  406    HA   ARG  52           HA       ARG  52  -0.688  14.239   0.069
  407    HB2  ARG  52           HB2      ARG  52   0.079  16.492   0.918
  408    HB3  ARG  52           HB3      ARG  52   1.648  16.188   0.169
  409    HG2  ARG  52           HG2      ARG  52   0.471  15.984  -2.063
  410    HG3  ARG  52           HG3      ARG  52  -1.060  16.333  -1.252
  411    HD2  ARG  52           HD2      ARG  52  -0.242  18.564  -0.609
  412    HD3  ARG  52           HD3      ARG  52   1.363  18.179  -1.227
  413    HE   ARG  52           HE       ARG  52   0.670  18.497  -3.413
  414   HH11  ARG  52          HH11      ARG  52  -2.203  18.682  -1.405
  415   HH12  ARG  52          HH12      ARG  52  -3.184  19.267  -2.722
  416   HH21  ARG  52          HH21      ARG  52  -0.639  19.232  -5.032
  417   HH22  ARG  52          HH22      ARG  52  -2.315  19.569  -4.717
  418    H    ASN  53           H        ASN  53   0.388  11.933   0.177
  419    HA   ASN  53           HA       ASN  53   2.182  11.694  -2.220
  420    HB2  ASN  53           HB2      ASN  53   2.415  10.231   0.446
  421    HB3  ASN  53           HB3      ASN  53   3.246   9.727  -1.016
  422   HD21  ASN  53          HD21      ASN  53   5.029  10.942  -1.808
  423   HD22  ASN  53          HD22      ASN  53   5.764  12.193  -0.817
  424    H    PHE  54           H        PHE  54  -0.843  10.917  -1.018
  425    HA   PHE  54           HA       PHE  54  -1.177   8.808  -3.070
  426    HB2  PHE  54           HB2      PHE  54  -0.791   7.739  -0.807
  427    HB3  PHE  54           HB3      PHE  54  -2.273   8.498  -0.249
  428    HD1  PHE  54           HD1      PHE  54  -4.490   7.808  -1.274
  429    HD2  PHE  54           HD2      PHE  54  -0.787   5.838  -2.289
  430    HE1  PHE  54           HE1      PHE  54  -5.762   5.934  -2.292
  431    HE2  PHE  54           HE2      PHE  54  -2.065   3.960  -3.295
  432    HZ   PHE  54           HZ       PHE  54  -4.553   4.010  -3.307
  433    H    SER  55           H        SER  55  -2.518   9.720  -4.426
  434    HA   SER  55           HA       SER  55  -5.016  11.112  -3.585
  435    HB2  SER  55           HB2      SER  55  -2.876  12.267  -5.423
  436    HB3  SER  55           HB3      SER  55  -4.501  12.938  -5.197
  437    HG   SER  55           HG       SER  55  -2.861  13.928  -3.835
  Start of MODEL    5
    1    H1   GLY   1           H1       GLY   1  30.569   5.739  34.051
    2    H2   GLY   1           H2       GLY   1  30.264   5.766  35.667
    3    H3   GLY   1           H3       GLY   1  29.133   5.196  34.628
    4    HA2  GLY   1           HA2      GLY   1  30.047   3.283  35.578
    5    HA3  GLY   1           HA3      GLY   1  30.737   3.424  33.951
    6    H    SER   2           H        SER   2  32.914   3.631  33.745
    7    HA   SER   2           HA       SER   2  34.660   4.399  35.998
    8    HB2  SER   2           HB2      SER   2  34.059   1.937  36.276
    9    HB3  SER   2           HB3      SER   2  34.948   1.620  34.782
   10    HG   SER   2           HG       SER   2  36.801   2.554  35.827
   11    H    GLU   3           H        GLU   3  33.937   5.252  33.286
   12    HA   GLU   3           HA       GLU   3  35.728   4.652  31.216
   13    HB2  GLU   3           HB2      GLU   3  34.187   7.223  31.791
   14    HB3  GLU   3           HB3      GLU   3  34.965   6.834  30.266
   15    HG2  GLU   3           HG2      GLU   3  32.608   6.433  30.058
   16    HG3  GLU   3           HG3      GLU   3  33.477   4.907  29.931
   17    H    PHE   4           H        PHE   4  37.452   5.810  30.272
   18    HA   PHE   4           HA       PHE   4  39.044   7.593  32.079
   19    HB2  PHE   4           HB2      PHE   4  41.027   6.396  31.505
   20    HB3  PHE   4           HB3      PHE   4  39.847   5.247  32.101
   21    HD1  PHE   4           HD1      PHE   4  38.762   3.611  30.545
   22    HD2  PHE   4           HD2      PHE   4  41.816   6.343  29.193
   23    HE1  PHE   4           HE1      PHE   4  39.046   2.274  28.470
   24    HE2  PHE   4           HE2      PHE   4  42.102   5.000  27.125
   25    HZ   PHE   4           HZ       PHE   4  40.714   2.966  26.758
   26    H    THR   5           H        THR   5  37.390   7.633  29.281
   27    HA   THR   5           HA       THR   5  38.867   9.885  28.157
   28    HB   THR   5           HB       THR   5  39.972   7.956  27.083
   29    HG1  THR   5           HG1      THR   5  39.935   9.659  25.795
   30   HG21  THR   5          HG21      THR   5  38.824   6.540  25.466
   31   HG22  THR   5          HG22      THR   5  37.256   7.258  25.889
   32   HG23  THR   5          HG23      THR   5  38.153   6.288  27.082
   33    H    SER   6           H        SER   6  37.553  11.094  26.651
   34    HA   SER   6           HA       SER   6  34.621  10.721  27.114
   35    HB2  SER   6           HB2      SER   6  35.822  12.832  27.887
   36    HB3  SER   6           HB3      SER   6  36.054  13.222  26.175
   37    HG   SER   6           HG       SER   6  33.678  13.081  27.706
   38    H    SER   7           H        SER   7  33.195  11.476  25.353
   39    HA   SER   7           HA       SER   7  34.199  10.910  22.594
   40    HB2  SER   7           HB2      SER   7  31.743   9.632  23.839
   41    HB3  SER   7           HB3      SER   7  32.264   9.484  22.149
   42    HG   SER   7           HG       SER   7  32.968   7.706  23.389
   43    HA   PRO   8           HA       PRO   8  31.350  14.635  22.657
   44    HB2  PRO   8           HB2      PRO   8  33.073  16.630  22.017
   45    HB3  PRO   8           HB3      PRO   8  32.951  15.989  23.683
   46    HG2  PRO   8           HG2      PRO   8  34.965  15.202  21.543
   47    HG3  PRO   8           HG3      PRO   8  35.294  15.721  23.228
   48    HD2  PRO   8           HD2      PRO   8  35.138  13.086  22.533
   49    HD3  PRO   8           HD3      PRO   8  34.542  13.689  24.109
   50    H    ARG   9           H        ARG   9  33.108  12.843  20.456
   51    HA   ARG   9           HA       ARG   9  31.829  14.069  18.047
   52    HB2  ARG   9           HB2      ARG   9  34.690  13.017  18.283
   53    HB3  ARG   9           HB3      ARG   9  33.894  13.458  16.771
   54    HG2  ARG   9           HG2      ARG   9  33.645  15.804  17.595
   55    HG3  ARG   9           HG3      ARG   9  34.561  15.364  19.052
   56    HD2  ARG   9           HD2      ARG   9  36.478  14.669  17.658
   57    HD3  ARG   9           HD3      ARG   9  35.594  15.079  16.191
   58    HE   ARG   9           HE       ARG   9  36.928  16.903  18.053
   59   HH11  ARG   9          HH11      ARG   9  34.521  16.809  15.500
   60   HH12  ARG   9          HH12      ARG   9  34.727  18.499  15.128
   61   HH21  ARG   9          HH21      ARG   9  37.143  19.041  17.513
   62   HH22  ARG   9          HH22      ARG   9  36.173  19.721  16.240
   63    H    GLY  10           H        GLY  10  31.845  12.498  16.194
   64    HA2  GLY  10           HA2      GLY  10  30.453  10.117  16.763
   65    HA3  GLY  10           HA3      GLY  10  31.245  10.483  15.234
   66    H    ASP  11           H        ASP  11  30.957   7.965  16.798
   67    HA   ASP  11           HA       ASP  11  33.496   7.245  17.946
   68    HB2  ASP  11           HB2      ASP  11  31.007   5.673  17.198
   69    HB3  ASP  11           HB3      ASP  11  32.397   4.944  17.991
   70    H    LYS  12           H        LYS  12  34.610   5.230  17.388
   71    HA   LYS  12           HA       LYS  12  35.486   5.261  14.538
   72    HB2  LYS  12           HB2      LYS  12  37.526   4.099  15.529
   73    HB3  LYS  12           HB3      LYS  12  37.274   5.796  15.927
   74    HG2  LYS  12           HG2      LYS  12  36.605   5.321  18.165
   75    HG3  LYS  12           HG3      LYS  12  36.360   3.608  17.832
   76    HD2  LYS  12           HD2      LYS  12  38.349   3.909  19.144
   77    HD3  LYS  12           HD3      LYS  12  38.763   3.261  17.551
   78    HE2  LYS  12           HE2      LYS  12  39.450   5.525  16.802
   79    HE3  LYS  12           HE3      LYS  12  38.982   6.198  18.371
   80    HZ1  LYS  12           HZ1      LYS  12  41.110   4.160  17.966
   81    HZ2  LYS  12           HZ2      LYS  12  40.686   4.803  19.407
   82    HZ3  LYS  12           HZ3      LYS  12  41.372   5.742  18.264
   83    H    ALA  13           H        ALA  13  34.846   2.831  17.059
   84    HA   ALA  13           HA       ALA  13  33.962   0.845  15.042
   85    HB1  ALA  13           HB1      ALA  13  36.336   0.430  16.912
   86    HB2  ALA  13           HB2      ALA  13  35.628  -0.797  15.840
   87    HB3  ALA  13           HB3      ALA  13  36.416   0.627  15.146
   88    H    ALA  14           H        ALA  14  33.495   2.208  18.091
   89    HA   ALA  14           HA       ALA  14  32.768  -0.130  19.618
   90    HB1  ALA  14           HB1      ALA  14  32.287   1.531  21.351
   91    HB2  ALA  14           HB2      ALA  14  33.821   1.912  20.560
   92    HB3  ALA  14           HB3      ALA  14  32.356   2.844  20.158
   93    H    TYR  15           H        TYR  15  31.187   0.115  17.155
   94    HA   TYR  15           HA       TYR  15  28.605   1.193  17.540
   95    HB2  TYR  15           HB2      TYR  15  29.507  -1.110  15.776
   96    HB3  TYR  15           HB3      TYR  15  27.990  -0.234  15.615
   97    HD1  TYR  15           HD2      TYR  15  28.021   2.249  15.110
   98    HD2  TYR  15           HD1      TYR  15  31.520  -0.243  14.746
   99    HE1  TYR  15           HE2      TYR  15  29.130   4.010  13.728
  100    HE2  TYR  15           HE1      TYR  15  32.619   1.512  13.354
  101    HH   TYR  15           HH       TYR  15  32.450   3.595  12.439
  102    H    ASP  16           H        ASP  16  29.882  -1.659  19.010
  103    HA   ASP  16           HA       ASP  16  27.445  -3.126  19.455
  104    HB2  ASP  16           HB2      ASP  16  30.080  -3.046  20.978
  105    HB3  ASP  16           HB3      ASP  16  28.786  -4.203  21.278
  106    H    ILE  17           H        ILE  17  28.935  -0.412  21.287
  107    HA   ILE  17           HA       ILE  17  26.900  -0.665  23.430
  108    HB   ILE  17           HB       ILE  17  28.979  -0.109  24.246
  109   HG12  ILE  17          HG12      ILE  17  26.954   1.162  25.161
  110   HG13  ILE  17          HG13      ILE  17  28.569   1.614  25.656
  111   HG21  ILE  17          HG21      ILE  17  30.250   0.709  22.448
  112   HG22  ILE  17          HG22      ILE  17  29.227   2.157  22.255
  113   HG23  ILE  17          HG23      ILE  17  30.268   1.957  23.682
  114   HD11  ILE  17          HD11      ILE  17  27.113   3.574  25.288
  115   HD12  ILE  17          HD12      ILE  17  28.555   3.610  24.269
  116   HD13  ILE  17          HD13      ILE  17  26.985   3.178  23.571
  117    H    LEU  18           H        LEU  18  27.467   1.252  20.530
  118    HA   LEU  18           HA       LEU  18  25.425   3.226  20.975
  119    HB2  LEU  18           HB2      LEU  18  26.408   2.130  18.309
  120    HB3  LEU  18           HB3      LEU  18  25.567   3.648  18.587
  121    HG   LEU  18           HG       LEU  18  28.416   2.954  19.376
  122   HD11  LEU  18          HD11      LEU  18  27.166   5.042  17.540
  123   HD12  LEU  18          HD12      LEU  18  28.087   3.606  17.047
  124   HD13  LEU  18          HD13      LEU  18  28.892   4.919  17.916
  125   HD21  LEU  18          HD21      LEU  18  26.865   5.484  20.045
  126   HD22  LEU  18          HD22      LEU  18  28.608   5.235  20.277
  127   HD23  LEU  18          HD23      LEU  18  27.473   4.278  21.217
  128    H    ARG  19           H        ARG  19  23.492   3.488  19.719
  129    HA   ARG  19           HA       ARG  19  22.048   1.022  18.820
  130    HB2  ARG  19           HB2      ARG  19  21.263   3.067  20.880
  131    HB3  ARG  19           HB3      ARG  19  19.993   2.540  19.789
  132    HG2  ARG  19           HG2      ARG  19  21.691   0.458  21.188
  133    HG3  ARG  19           HG3      ARG  19  20.415   1.278  22.081
  134    HD2  ARG  19           HD2      ARG  19  19.890  -0.080  19.408
  135    HD3  ARG  19           HD3      ARG  19  19.802  -0.950  20.931
  136    HE   ARG  19           HE       ARG  19  17.909   1.065  19.920
  137   HH11  ARG  19          HH11      ARG  19  18.846  -0.782  22.746
  138   HH12  ARG  19          HH12      ARG  19  17.348  -0.456  23.573
  139   HH21  ARG  19          HH21      ARG  19  16.024   1.469  21.053
  140   HH22  ARG  19          HH22      ARG  19  15.803   0.778  22.633
  141    H    ARG  20           H        ARG  20  20.608   1.351  17.146
  142    HA   ARG  20           HA       ARG  20  20.812   3.946  15.685
  143    HB2  ARG  20           HB2      ARG  20  21.226   2.849  13.618
  144    HB3  ARG  20           HB3      ARG  20  22.424   2.288  14.785
  145    HG2  ARG  20           HG2      ARG  20  21.164   0.174  15.088
  146    HG3  ARG  20           HG3      ARG  20  19.988   0.693  13.871
  147    HD2  ARG  20           HD2      ARG  20  22.973   0.385  13.360
  148    HD3  ARG  20           HD3      ARG  20  21.763  -0.865  13.024
  149    HE   ARG  20           HE       ARG  20  20.848   1.429  11.703
  150   HH11  ARG  20          HH11      ARG  20  23.662  -0.643  11.416
  151   HH12  ARG  20          HH12      ARG  20  23.839  -0.316   9.714
  152   HH21  ARG  20          HH21      ARG  20  21.133   1.795   9.528
  153   HH22  ARG  20          HH22      ARG  20  22.442   1.026   8.682
  154    H    CYS  21           H        CYS  21  19.066   4.661  14.621
  155    HA   CYS  21           HA       CYS  21  16.482   3.398  15.235
  156    HB2  CYS  21           HB2      CYS  21  16.831   5.836  15.383
  157    HB3  CYS  21           HB3      CYS  21  17.174   5.882  13.640
  158    H    SER  22           H        SER  22  15.753   1.782  14.031
  159    HA   SER  22           HA       SER  22  16.681   1.037  11.427
  160    HB2  SER  22           HB2      SER  22  15.516  -0.377  13.260
  161    HB3  SER  22           HB3      SER  22  13.997   0.233  12.578
  162    HG   SER  22           HG       SER  22  14.573  -1.732  11.599
  163    H    GLN  23           H        GLN  23  14.620   3.610  12.251
  164    HA   GLN  23           HA       GLN  23  13.351   3.658   9.545
  165    HB2  GLN  23           HB2      GLN  23  11.976   3.439  11.801
  166    HB3  GLN  23           HB3      GLN  23  12.309   5.159  11.940
  167    HG2  GLN  23           HG2      GLN  23  10.213   5.065  10.932
  168    HG3  GLN  23           HG3      GLN  23  11.261   5.366   9.558
  169   HE21  GLN  23          HE21      GLN  23   8.571   3.652  10.352
  170   HE22  GLN  23          HE22      GLN  23   8.820   2.251   9.318
  171    H    CYS  24           H        CYS  24  15.537   5.369  11.632
  172    HA   CYS  24           HA       CYS  24  15.436   7.780   9.868
  173    HB2  CYS  24           HB2      CYS  24  16.419   7.631  12.727
  174    HB3  CYS  24           HB3      CYS  24  16.128   9.067  11.761
  175    H    GLY  25           H        GLY  25  17.576   5.218  10.909
  176    HA2  GLY  25           HA2      GLY  25  19.642   4.644  10.099
  177    HA3  GLY  25           HA3      GLY  25  19.650   6.090   9.091
  178    H    ILE  26           H        ILE  26  19.224   7.568  11.876
  179    HA   ILE  26           HA       ILE  26  21.950   8.283  12.384
  180    HB   ILE  26           HB       ILE  26  19.971   9.732  12.705
  181   HG12  ILE  26          HG12      ILE  26  21.575   9.490  15.278
  182   HG13  ILE  26          HG13      ILE  26  22.198  10.179  13.774
  183   HG21  ILE  26          HG21      ILE  26  18.442   8.064  13.760
  184   HG22  ILE  26          HG22      ILE  26  19.414   8.119  15.237
  185   HG23  ILE  26          HG23      ILE  26  18.546   9.559  14.680
  186   HD11  ILE  26          HD11      ILE  26  21.477  11.951  15.256
  187   HD12  ILE  26          HD12      ILE  26  20.410  11.909  13.841
  188   HD13  ILE  26          HD13      ILE  26  19.860  11.255  15.404
  189    H    LEU  27           H        LEU  27  23.174   8.018  14.346
  190    HA   LEU  27           HA       LEU  27  22.549   5.619  16.005
  191    HB2  LEU  27           HB2      LEU  27  25.297   6.502  15.006
  192    HB3  LEU  27           HB3      LEU  27  24.988   5.300  16.247
  193    HG   LEU  27           HG       LEU  27  23.514   4.152  14.352
  194   HD11  LEU  27          HD11      LEU  27  25.656   5.585  12.718
  195   HD12  LEU  27          HD12      LEU  27  23.916   5.910  12.621
  196   HD13  LEU  27          HD13      LEU  27  24.535   4.332  12.137
  197   HD21  LEU  27          HD21      LEU  27  25.454   3.141  15.494
  198   HD22  LEU  27          HD22      LEU  27  26.554   4.039  14.424
  199   HD23  LEU  27          HD23      LEU  27  25.481   2.785  13.761
  200    H    LEU  28           H        LEU  28  22.686   5.889  18.146
  201    HA   LEU  28           HA       LEU  28  23.811   8.411  19.296
  202    HB2  LEU  28           HB2      LEU  28  21.179   7.054  20.031
  203    HB3  LEU  28           HB3      LEU  28  21.940   8.317  20.961
  204    HG   LEU  28           HG       LEU  28  20.223   9.379  19.908
  205   HD11  LEU  28          HD11      LEU  28  21.145  11.050  18.479
  206   HD12  LEU  28          HD12      LEU  28  22.497  10.010  18.011
  207   HD13  LEU  28          HD13      LEU  28  22.377  10.610  19.678
  208   HD21  LEU  28          HD21      LEU  28  19.594   7.674  18.273
  209   HD22  LEU  28          HD22      LEU  28  20.929   8.177  17.219
  210   HD23  LEU  28          HD23      LEU  28  19.609   9.301  17.573
  211    HA   PRO  29           HA       PRO  29  25.808   5.560  22.042
  212    HB2  PRO  29           HB2      PRO  29  26.425   7.098  24.222
  213    HB3  PRO  29           HB3      PRO  29  27.197   7.278  22.621
  214    HG2  PRO  29           HG2      PRO  29  24.920   8.907  23.770
  215    HG3  PRO  29           HG3      PRO  29  26.387   9.488  22.931
  216    HD2  PRO  29           HD2      PRO  29  23.982   9.188  21.659
  217    HD3  PRO  29           HD3      PRO  29  25.536   8.888  20.829
  218    H    LEU  30           H        LEU  30  23.872   7.475  24.394
  219    HA   LEU  30           HA       LEU  30  22.078   5.270  24.967
  220    HB2  LEU  30           HB2      LEU  30  24.589   5.467  26.447
  221    HB3  LEU  30           HB3      LEU  30  23.240   5.696  27.546
  222    HG   LEU  30           HG       LEU  30  23.437   3.325  25.642
  223   HD11  LEU  30          HD11      LEU  30  24.159   3.518  28.594
  224   HD12  LEU  30          HD12      LEU  30  25.297   3.293  27.245
  225   HD13  LEU  30          HD13      LEU  30  24.115   2.030  27.617
  226   HD21  LEU  30          HD21      LEU  30  21.701   3.822  28.101
  227   HD22  LEU  30          HD22      LEU  30  21.739   2.340  27.121
  228   HD23  LEU  30          HD23      LEU  30  21.132   3.843  26.419
  229    HA   PRO  31           HA       PRO  31  20.619   8.834  27.667
  230    HB2  PRO  31           HB2      PRO  31  21.966  11.213  27.952
  231    HB3  PRO  31           HB3      PRO  31  22.213   9.775  28.986
  232    HG2  PRO  31           HG2      PRO  31  23.869  10.683  26.629
  233    HG3  PRO  31           HG3      PRO  31  24.428  10.092  28.220
  234    HD2  PRO  31           HD2      PRO  31  24.341   8.476  26.025
  235    HD3  PRO  31           HD3      PRO  31  24.003   7.863  27.665
  236    H    ILE  32           H        ILE  32  22.360  10.188  24.803
  237    HA   ILE  32           HA       ILE  32  20.204  11.985  24.087
  238    HB   ILE  32           HB       ILE  32  22.411  10.916  22.284
  239   HG12  ILE  32          HG12      ILE  32  23.112  13.524  22.930
  240   HG13  ILE  32          HG13      ILE  32  22.414  12.997  24.449
  241   HG21  ILE  32          HG21      ILE  32  20.635  13.388  22.060
  242   HG22  ILE  32          HG22      ILE  32  22.015  13.011  21.004
  243   HG23  ILE  32          HG23      ILE  32  20.604  11.968  20.992
  244   HD11  ILE  32          HD11      ILE  32  24.710  11.699  22.912
  245   HD12  ILE  32          HD12      ILE  32  24.818  12.601  24.436
  246   HD13  ILE  32          HD13      ILE  32  24.012  11.022  24.395
  247    H    LEU  33           H        LEU  33  20.725   8.562  23.512
  248    HA   LEU  33           HA       LEU  33  18.957   8.100  21.347
  249    HB2  LEU  33           HB2      LEU  33  20.508   6.420  22.390
  250    HB3  LEU  33           HB3      LEU  33  19.456   6.389  23.804
  251    HG   LEU  33           HG       LEU  33  17.582   5.534  22.357
  252   HD11  LEU  33          HD11      LEU  33  18.162   4.517  20.192
  253   HD12  LEU  33          HD12      LEU  33  19.806   5.174  20.304
  254   HD13  LEU  33          HD13      LEU  33  18.410   6.265  20.138
  255   HD21  LEU  33          HD21      LEU  33  20.150   3.947  22.605
  256   HD22  LEU  33          HD22      LEU  33  18.563   3.241  22.197
  257   HD23  LEU  33          HD23      LEU  33  18.811   4.035  23.759
  258    H    ASN  34           H        ASN  34  18.213   8.689  24.789
  259    HA   ASN  34           HA       ASN  34  15.459   7.986  24.745
  260    HB2  ASN  34           HB2      ASN  34  16.821   8.404  26.784
  261    HB3  ASN  34           HB3      ASN  34  16.909  10.119  26.374
  262   HD21  ASN  34          HD21      ASN  34  14.583   7.499  27.188
  263   HD22  ASN  34          HD22      ASN  34  13.401   8.602  27.873
  264    H    GLN  35           H        GLN  35  17.058  11.037  23.761
  265    HA   GLN  35           HA       GLN  35  14.624  12.525  23.308
  266    HB2  GLN  35           HB2      GLN  35  16.932  13.511  23.620
  267    HB3  GLN  35           HB3      GLN  35  17.346  12.930  22.001
  268    HG2  GLN  35           HG2      GLN  35  15.390  14.286  21.101
  269    HG3  GLN  35           HG3      GLN  35  15.167  14.940  22.722
  270   HE21  GLN  35          HE21      GLN  35  16.885  15.300  19.738
  271   HE22  GLN  35          HE22      GLN  35  17.998  16.537  20.304
  272    H    HIS  36           H        HIS  36  16.740  10.535  21.129
  273    HA   HIS  36           HA       HIS  36  15.091  10.997  18.809
  274    HB2  HIS  36           HB2      HIS  36  17.431  10.057  18.723
  275    HB3  HIS  36           HB3      HIS  36  16.780   8.510  19.284
  276    HD1  HIS  36           HD1      HIS  36  16.644  10.895  16.274
  277    HD2  HIS  36           HD2      HIS  36  15.209   7.134  17.475
  278    HE1  HIS  36           HE1      HIS  36  15.559   9.882  14.224
  279    H    GLN  37           H        GLN  37  15.089   8.337  21.240
  280    HA   GLN  37           HA       GLN  37  13.049   6.765  20.154
  281    HB2  GLN  37           HB2      GLN  37  13.947   7.284  23.003
  282    HB3  GLN  37           HB3      GLN  37  12.599   6.207  22.674
  283    HG2  GLN  37           HG2      GLN  37  15.360   5.865  21.433
  284    HG3  GLN  37           HG3      GLN  37  14.835   5.056  22.906
  285   HE21  GLN  37          HE21      GLN  37  15.386   4.297  19.810
  286   HE22  GLN  37          HE22      GLN  37  14.057   3.180  19.529
  287    H    GLU  38           H        GLU  38  12.499   9.449  22.583
  288    HA   GLU  38           HA       GLU  38   9.671   9.073  22.454
  289    HB2  GLU  38           HB2      GLU  38   9.401  11.081  23.658
  290    HB3  GLU  38           HB3      GLU  38  10.781  10.213  24.316
  291    HG2  GLU  38           HG2      GLU  38  12.325  11.776  23.188
  292    HG3  GLU  38           HG3      GLU  38  10.967  12.612  22.435
  293    H    LYS  39           H        LYS  39  11.738  11.215  20.465
  294    HA   LYS  39           HA       LYS  39   9.482  12.525  19.194
  295    HB2  LYS  39           HB2      LYS  39  11.865  13.379  19.518
  296    HB3  LYS  39           HB3      LYS  39  12.351  12.384  18.157
  297    HG2  LYS  39           HG2      LYS  39  10.096  14.445  18.018
  298    HG3  LYS  39           HG3      LYS  39  11.771  14.908  17.821
  299    HD2  LYS  39           HD2      LYS  39  10.273  12.980  15.998
  300    HD3  LYS  39           HD3      LYS  39  10.575  14.669  15.667
  301    HE2  LYS  39           HE2      LYS  39  12.766  12.576  16.052
  302    HE3  LYS  39           HE3      LYS  39  12.112  13.077  14.492
  303    HZ1  LYS  39           HZ1      LYS  39  13.510  14.886  16.391
  304    HZ2  LYS  39           HZ2      LYS  39  12.864  15.347  14.963
  305    HZ3  LYS  39           HZ3      LYS  39  14.121  14.313  14.992
  306    H    CYS  40           H        CYS  40  11.652   9.896  18.162
  307    HA   CYS  40           HA       CYS  40  10.544   9.426  15.593
  308    HB2  CYS  40           HB2      CYS  40  12.766   8.769  16.667
  309    HB3  CYS  40           HB3      CYS  40  11.915   7.437  17.451
  310    H    ARG  41           H        ARG  41   9.811   7.908  18.789
  311    HA   ARG  41           HA       ARG  41   7.638   6.226  17.924
  312    HB2  ARG  41           HB2      ARG  41   8.314   7.503  20.605
  313    HB3  ARG  41           HB3      ARG  41   6.923   6.449  20.376
  314    HG2  ARG  41           HG2      ARG  41   8.260   4.548  19.834
  315    HG3  ARG  41           HG3      ARG  41   9.716   5.520  19.622
  316    HD2  ARG  41           HD2      ARG  41   9.803   4.293  21.731
  317    HD3  ARG  41           HD3      ARG  41   9.798   6.040  21.999
  318    HE   ARG  41           HE       ARG  41   7.123   4.918  22.130
  319   HH11  ARG  41          HH11      ARG  41  10.017   5.243  24.076
  320   HH12  ARG  41          HH12      ARG  41   9.124   5.252  25.572
  321   HH21  ARG  41          HH21      ARG  41   6.042   4.941  24.081
  322   HH22  ARG  41          HH22      ARG  41   6.936   5.066  25.567
  323    H    TRP  42           H        TRP  42   7.540   9.585  19.255
  324    HA   TRP  42           HA       TRP  42   4.715   9.874  19.085
  325    HB2  TRP  42           HB2      TRP  42   6.206  11.379  20.339
  326    HB3  TRP  42           HB3      TRP  42   6.884  11.992  18.834
  327    HD1  TRP  42           HD1      TRP  42   3.857  12.232  21.092
  328    HE1  TRP  42           HE1      TRP  42   2.342  14.175  20.371
  329    HE3  TRP  42           HE3      TRP  42   6.158  13.467  16.674
  330    HZ2  TRP  42           HZ2      TRP  42   2.121  15.994  18.145
  331    HZ3  TRP  42           HZ3      TRP  42   5.250  15.297  15.261
  332    HH2  TRP  42           HH2      TRP  42   3.237  16.564  15.982
  333    H    LEU  43           H        LEU  43   7.221  10.703  16.652
  334    HA   LEU  43           HA       LEU  43   5.438  11.692  14.666
  335    HB2  LEU  43           HB2      LEU  43   7.882  12.063  14.857
  336    HB3  LEU  43           HB3      LEU  43   8.194  10.415  14.334
  337    HG   LEU  43           HG       LEU  43   6.612  12.390  12.629
  338   HD11  LEU  43          HD11      LEU  43   8.778  13.421  13.185
  339   HD12  LEU  43          HD12      LEU  43   8.724  12.945  11.485
  340   HD13  LEU  43          HD13      LEU  43   9.629  11.952  12.653
  341   HD21  LEU  43          HD21      LEU  43   6.513  10.068  11.797
  342   HD22  LEU  43          HD22      LEU  43   8.281   9.930  11.914
  343   HD23  LEU  43          HD23      LEU  43   7.532  11.034  10.742
  344    H    ALA  44           H        ALA  44   6.864   8.372  15.020
  345    HA   ALA  44           HA       ALA  44   5.492   7.230  12.816
  346    HB1  ALA  44           HB1      ALA  44   6.474   5.929  15.396
  347    HB2  ALA  44           HB2      ALA  44   6.068   5.081  13.887
  348    HB3  ALA  44           HB3      ALA  44   7.437   6.208  13.925
  349    H    SER  45           H        SER  45   4.447   7.531  16.237
  350    HA   SER  45           HA       SER  45   1.974   6.098  15.961
  351    HB2  SER  45           HB2      SER  45   3.110   6.620  18.115
  352    HB3  SER  45           HB3      SER  45   2.717   8.333  17.892
  353    HG   SER  45           HG       SER  45   0.930   6.135  18.257
  354    H    SER  46           H        SER  46   2.753   9.593  15.636
  355    HA   SER  46           HA       SER  46   0.054  10.454  15.094
  356    HB2  SER  46           HB2      SER  46   2.707  11.780  14.396
  357    HB3  SER  46           HB3      SER  46   1.108  12.549  14.347
  358    HG   SER  46           HG       SER  46   2.547  11.576  16.585
  359    H    LYS  47           H        LYS  47   2.687   9.379  12.980
  360    HA   LYS  47           HA       LYS  47   1.321   9.965  10.478
  361    HB2  LYS  47           HB2      LYS  47   3.788  10.011  10.851
  362    HB3  LYS  47           HB3      LYS  47   3.787   8.250  10.993
  363    HG2  LYS  47           HG2      LYS  47   3.059   8.026   8.664
  364    HG3  LYS  47           HG3      LYS  47   2.758   9.769   8.547
  365    HD2  LYS  47           HD2      LYS  47   5.152  10.237   8.833
  366    HD3  LYS  47           HD3      LYS  47   5.493   8.504   9.041
  367    HE2  LYS  47           HE2      LYS  47   4.709   8.030   6.771
  368    HE3  LYS  47           HE3      LYS  47   4.201   9.710   6.553
  369    HZ1  LYS  47           HZ1      LYS  47   7.016   8.841   6.966
  370    HZ2  LYS  47           HZ2      LYS  47   6.528  10.384   6.732
  371    HZ3  LYS  47           HZ3      LYS  47   6.374   9.291   5.533
  372    H    GLY  48           H        GLY  48  -0.619   8.817  11.575
  373    HA2  GLY  48           HA2      GLY  48  -0.925   5.981  11.510
  374    HA3  GLY  48           HA3      GLY  48  -2.221   7.175  11.390
  375    H    LYS  49           H        LYS  49  -1.011   8.328   8.876
  376    HA   LYS  49           HA       LYS  49  -2.268   6.633   6.893
  377    HB2  LYS  49           HB2      LYS  49  -2.030   9.220   6.896
  378    HB3  LYS  49           HB3      LYS  49  -0.377   8.964   6.365
  379    HG2  LYS  49           HG2      LYS  49  -1.566   9.301   4.369
  380    HG3  LYS  49           HG3      LYS  49  -1.403   7.543   4.434
  381    HD2  LYS  49           HD2      LYS  49  -3.734   7.423   5.421
  382    HD3  LYS  49           HD3      LYS  49  -3.846   9.187   5.259
  383    HE2  LYS  49           HE2      LYS  49  -3.476   8.952   2.794
  384    HE3  LYS  49           HE3      LYS  49  -3.433   7.193   2.985
  385    HZ1  LYS  49           HZ1      LYS  49  -5.645   7.951   2.335
  386    HZ2  LYS  49           HZ2      LYS  49  -5.760   8.926   3.634
  387    HZ3  LYS  49           HZ3      LYS  49  -5.727   7.306   3.829
  388    H    GLN  50           H        GLN  50  -1.390   4.719   6.366
  389    HA   GLN  50           HA       GLN  50   1.423   4.109   6.379
  390    HB2  GLN  50           HB2      GLN  50  -0.472   2.457   6.625
  391    HB3  GLN  50           HB3      GLN  50  -0.852   2.693   4.922
  392    HG2  GLN  50           HG2      GLN  50   0.453   0.667   5.165
  393    HG3  GLN  50           HG3      GLN  50   1.417   1.857   4.304
  394   HE21  GLN  50          HE21      GLN  50   3.426   0.796   4.904
  395   HE22  GLN  50          HE22      GLN  50   4.001   0.860   6.565
  396    H    VAL  51           H        VAL  51   2.949   4.599   4.909
  397    HA   VAL  51           HA       VAL  51   2.350   4.991   2.037
  398    HB   VAL  51           HB       VAL  51   3.590   7.130   1.969
  399   HG11  VAL  51          HG11      VAL  51   1.106   7.118   2.025
  400   HG12  VAL  51          HG12      VAL  51   1.170   7.365   3.786
  401   HG13  VAL  51          HG13      VAL  51   1.827   8.593   2.693
  402   HG21  VAL  51          HG21      VAL  51   3.937   8.486   3.970
  403   HG22  VAL  51          HG22      VAL  51   3.352   7.169   5.008
  404   HG23  VAL  51          HG23      VAL  51   4.866   6.985   4.089
  405    H    ARG  52           H        ARG  52   4.340   5.180   0.723
  406    HA   ARG  52           HA       ARG  52   6.353   3.262   1.323
  407    HB2  ARG  52           HB2      ARG  52   5.712   4.157  -0.956
  408    HB3  ARG  52           HB3      ARG  52   6.578   5.647  -0.559
  409    HG2  ARG  52           HG2      ARG  52   8.673   4.219  -0.221
  410    HG3  ARG  52           HG3      ARG  52   7.738   2.825  -0.766
  411    HD2  ARG  52           HD2      ARG  52   9.055   3.665  -2.620
  412    HD3  ARG  52           HD3      ARG  52   7.350   3.951  -2.946
  413    HE   ARG  52           HE       ARG  52   7.733   6.223  -2.965
  414   HH11  ARG  52          HH11      ARG  52  10.558   4.814  -1.422
  415   HH12  ARG  52          HH12      ARG  52  11.357   6.356  -1.294
  416   HH21  ARG  52          HH21      ARG  52   8.825   8.132  -2.793
  417   HH22  ARG  52          HH22      ARG  52  10.408   8.175  -2.073
  418    H    ASN  53           H        ASN  53   8.350   3.352   2.209
  419    HA   ASN  53           HA       ASN  53   9.522   5.844   3.255
  420    HB2  ASN  53           HB2      ASN  53   9.456   5.013   5.590
  421    HB3  ASN  53           HB3      ASN  53   7.845   5.300   4.950
  422   HD21  ASN  53          HD21      ASN  53   6.454   3.423   4.469
  423   HD22  ASN  53          HD22      ASN  53   6.870   1.865   5.169
  424    H    PHE  54           H        PHE  54  11.687   5.611   3.971
  425    HA   PHE  54           HA       PHE  54  13.158   3.658   2.417
  426    HB2  PHE  54           HB2      PHE  54  14.017   5.883   4.304
  427    HB3  PHE  54           HB3      PHE  54  15.138   4.891   3.386
  428    HD1  PHE  54           HD1      PHE  54  14.914   4.799   0.825
  429    HD2  PHE  54           HD2      PHE  54  13.070   7.844   3.261
  430    HE1  PHE  54           HE1      PHE  54  14.717   6.271  -1.165
  431    HE2  PHE  54           HE2      PHE  54  12.874   9.314   1.269
  432    HZ   PHE  54           HZ       PHE  54  13.701   8.533  -0.946
  433    H    SER  55           H        SER  55  14.612   2.125   3.033
  434    HA   SER  55           HA       SER  55  14.291   0.707   5.565
  435    HB2  SER  55           HB2      SER  55  16.010  -0.807   4.559
  436    HB3  SER  55           HB3      SER  55  14.548  -0.606   3.584
  437    HG   SER  55           HG       SER  55  16.503  -0.417   2.327
  Start of MODEL    6
    1    H1   GLY   1           H1       GLY   1   1.708   8.830   0.935
    2    H2   GLY   1           H2       GLY   1   0.425   7.808   0.857
    3    H3   GLY   1           H3       GLY   1   0.417   9.205  -0.005
    4    HA2  GLY   1           HA2      GLY   1   2.242   6.935  -0.464
    5    HA3  GLY   1           HA3      GLY   1   0.844   7.337  -1.460
    6    H    SER   2           H        SER   2   4.182   7.987  -0.822
    7    HA   SER   2           HA       SER   2   4.435   9.570  -3.256
    8    HB2  SER   2           HB2      SER   2   3.853  11.265  -1.455
    9    HB3  SER   2           HB3      SER   2   5.372  10.838  -0.663
   10    HG   SER   2           HG       SER   2   5.522  12.668  -2.096
   11    H    GLU   3           H        GLU   3   6.787  10.148  -3.614
   12    HA   GLU   3           HA       GLU   3   8.475   7.766  -3.068
   13    HB2  GLU   3           HB2      GLU   3   8.868  10.115  -4.963
   14    HB3  GLU   3           HB3      GLU   3   9.946   8.728  -4.809
   15    HG2  GLU   3           HG2      GLU   3   7.060   8.713  -5.789
   16    HG3  GLU   3           HG3      GLU   3   8.515   8.468  -6.755
   17    H    PHE   4           H        PHE   4   8.704   8.297  -0.793
   18    HA   PHE   4           HA       PHE   4  10.153  10.561   0.189
   19    HB2  PHE   4           HB2      PHE   4   9.568   7.778   1.206
   20    HB3  PHE   4           HB3      PHE   4  10.791   8.742   2.007
   21    HD1  PHE   4           HD2      PHE   4   7.318   9.494   0.643
   22    HD2  PHE   4           HD1      PHE   4  10.067   9.718   3.966
   23    HE1  PHE   4           HE2      PHE   4   5.621  10.715   1.970
   24    HE2  PHE   4           HE1      PHE   4   8.354  10.923   5.294
   25    HZ   PHE   4           HZ       PHE   4   6.131  11.434   4.297
   26    H    THR   5           H        THR   5  12.266  10.994   0.487
   27    HA   THR   5           HA       THR   5  14.294   9.613  -1.080
   28    HB   THR   5           HB       THR   5  14.194  12.079  -0.694
   29    HG1  THR   5           HG1      THR   5  16.412  12.238  -0.626
   30   HG21  THR   5          HG21      THR   5  15.447  11.449   2.018
   31   HG22  THR   5          HG22      THR   5  13.802  12.087   1.779
   32   HG23  THR   5          HG23      THR   5  15.205  13.050   1.286
   33    H    SER   6           H        SER   6  16.515   9.330   0.176
   34    HA   SER   6           HA       SER   6  16.199   7.731   2.657
   35    HB2  SER   6           HB2      SER   6  15.893   6.224   0.631
   36    HB3  SER   6           HB3      SER   6  17.584   6.564   0.220
   37    HG   SER   6           HG       SER   6  17.269   4.643   1.510
   38    H    SER   7           H        SER   7  18.538   6.823   3.183
   39    HA   SER   7           HA       SER   7  20.361   9.212   3.203
   40    HB2  SER   7           HB2      SER   7  19.655   7.297   5.462
   41    HB3  SER   7           HB3      SER   7  20.876   8.581   5.555
   42    HG   SER   7           HG       SER   7  18.821   9.236   6.385
   43    HA   PRO   8           HA       PRO   8  23.571   6.497   1.895
   44    HB2  PRO   8           HB2      PRO   8  25.845   7.676   2.885
   45    HB3  PRO   8           HB3      PRO   8  24.858   8.382   1.571
   46    HG2  PRO   8           HG2      PRO   8  24.759   9.041   4.532
   47    HG3  PRO   8           HG3      PRO   8  24.859  10.178   3.147
   48    HD2  PRO   8           HD2      PRO   8  22.491   9.592   4.337
   49    HD3  PRO   8           HD3      PRO   8  22.598   9.810   2.564
   50    H    ARG   9           H        ARG   9  24.864   4.780   2.505
   51    HA   ARG   9           HA       ARG   9  24.618   3.654   5.185
   52    HB2  ARG   9           HB2      ARG   9  26.038   1.851   4.332
   53    HB3  ARG   9           HB3      ARG   9  24.681   2.171   3.268
   54    HG2  ARG   9           HG2      ARG   9  26.056   3.142   1.584
   55    HG3  ARG   9           HG3      ARG   9  27.399   3.411   2.700
   56    HD2  ARG   9           HD2      ARG   9  27.880   1.558   1.174
   57    HD3  ARG   9           HD3      ARG   9  27.851   1.050   2.870
   58    HE   ARG   9           HE       ARG   9  25.312   0.675   1.428
   59   HH11  ARG   9          HH11      ARG   9  28.346  -0.896   2.216
   60   HH12  ARG   9          HH12      ARG   9  27.672  -2.493   2.034
   61   HH21  ARG   9          HH21      ARG   9  24.515  -1.394   1.228
   62   HH22  ARG   9          HH22      ARG   9  25.563  -2.758   1.480
   63    H    GLY  10           H        GLY  10  26.536   2.838   6.370
   64    HA2  GLY  10           HA2      GLY  10  29.128   4.012   6.113
   65    HA3  GLY  10           HA3      GLY  10  28.237   4.835   7.399
   66    H    ASP  11           H        ASP  11  30.500   3.581   8.083
   67    HA   ASP  11           HA       ASP  11  30.173   0.844   8.994
   68    HB2  ASP  11           HB2      ASP  11  32.147   3.025   9.785
   69    HB3  ASP  11           HB3      ASP  11  32.258   1.336  10.276
   70    H    LYS  12           H        LYS  12  30.310   0.186  11.252
   71    HA   LYS  12           HA       LYS  12  29.231   1.971  13.340
   72    HB2  LYS  12           HB2      LYS  12  27.348   0.575  13.889
   73    HB3  LYS  12           HB3      LYS  12  27.237   0.968  12.172
   74    HG2  LYS  12           HG2      LYS  12  28.318  -1.309  11.686
   75    HG3  LYS  12           HG3      LYS  12  28.205  -1.655  13.415
   76    HD2  LYS  12           HD2      LYS  12  26.397  -2.737  12.340
   77    HD3  LYS  12           HD3      LYS  12  25.709  -1.392  13.275
   78    HE2  LYS  12           HE2      LYS  12  25.343  -0.075  11.300
   79    HE3  LYS  12           HE3      LYS  12  26.438  -1.079  10.331
   80    HZ1  LYS  12           HZ1      LYS  12  23.824  -2.029  11.407
   81    HZ2  LYS  12           HZ2      LYS  12  24.857  -2.903  10.470
   82    HZ3  LYS  12           HZ3      LYS  12  24.107  -1.584   9.840
   83    H    ALA  13           H        ALA  13  29.339   0.987  15.495
   84    HA   ALA  13           HA       ALA  13  31.680  -0.753  15.857
   85    HB1  ALA  13           HB1      ALA  13  29.703   0.464  17.838
   86    HB2  ALA  13           HB2      ALA  13  31.220  -0.381  18.253
   87    HB3  ALA  13           HB3      ALA  13  31.274   1.151  17.350
   88    H    ALA  14           H        ALA  14  28.159  -1.029  16.586
   89    HA   ALA  14           HA       ALA  14  26.877  -2.720  17.333
   90    HB1  ALA  14           HB1      ALA  14  27.059  -3.290  14.957
   91    HB2  ALA  14           HB2      ALA  14  28.438  -4.360  15.306
   92    HB3  ALA  14           HB3      ALA  14  26.828  -4.732  15.959
   93    H    TYR  15           H        TYR  15  29.050  -2.223  19.031
   94    HA   TYR  15           HA       TYR  15  29.492  -4.870  20.356
   95    HB2  TYR  15           HB2      TYR  15  31.343  -2.462  20.270
   96    HB3  TYR  15           HB3      TYR  15  31.616  -3.915  21.220
   97    HD1  TYR  15           HD2      TYR  15  31.141  -6.183  19.537
   98    HD2  TYR  15           HD1      TYR  15  32.936  -2.380  18.549
   99    HE1  TYR  15           HE2      TYR  15  32.404  -7.255  17.680
  100    HE2  TYR  15           HE1      TYR  15  34.194  -3.457  16.695
  101    HH   TYR  15           HH       TYR  15  34.615  -5.400  15.552
  102    H    ASP  16           H        ASP  16  27.171  -3.514  20.861
  103    HA   ASP  16           HA       ASP  16  25.828  -2.626  22.459
  104    HB2  ASP  16           HB2      ASP  16  27.785  -3.998  24.331
  105    HB3  ASP  16           HB3      ASP  16  26.135  -3.514  24.722
  106    H    ILE  17           H        ILE  17  27.625  -0.767  21.513
  107    HA   ILE  17           HA       ILE  17  28.117   1.091  23.810
  108    HB   ILE  17           HB       ILE  17  30.172   0.288  22.877
  109   HG12  ILE  17          HG12      ILE  17  29.682   3.154  21.948
  110   HG13  ILE  17          HG13      ILE  17  30.054   2.644  23.600
  111   HG21  ILE  17          HG21      ILE  17  29.415  -0.415  20.624
  112   HG22  ILE  17          HG22      ILE  17  29.274   1.290  20.138
  113   HG23  ILE  17          HG23      ILE  17  30.848   0.580  20.541
  114   HD11  ILE  17          HD11      ILE  17  32.260   1.740  22.727
  115   HD12  ILE  17          HD12      ILE  17  31.869   2.503  21.158
  116   HD13  ILE  17          HD13      ILE  17  32.057   3.504  22.605
  117    H    LEU  18           H        LEU  18  26.622   0.769  20.669
  118    HA   LEU  18           HA       LEU  18  25.364   3.451  20.894
  119    HB2  LEU  18           HB2      LEU  18  26.565   2.256  18.359
  120    HB3  LEU  18           HB3      LEU  18  25.638   3.744  18.441
  121    HG   LEU  18           HG       LEU  18  28.383   3.344  19.706
  122   HD11  LEU  18          HD11      LEU  18  28.426   3.281  17.238
  123   HD12  LEU  18          HD12      LEU  18  29.197   4.741  17.874
  124   HD13  LEU  18          HD13      LEU  18  27.559   4.835  17.184
  125   HD21  LEU  18          HD21      LEU  18  28.374   5.854  19.808
  126   HD22  LEU  18          HD22      LEU  18  27.238   5.082  20.902
  127   HD23  LEU  18          HD23      LEU  18  26.642   5.825  19.394
  128    H    ARG  19           H        ARG  19  23.373   3.566  19.658
  129    HA   ARG  19           HA       ARG  19  22.205   0.979  18.707
  130    HB2  ARG  19           HB2      ARG  19  21.461   1.683  21.046
  131    HB3  ARG  19           HB3      ARG  19  20.661   3.067  20.315
  132    HG2  ARG  19           HG2      ARG  19  20.076   0.231  19.374
  133    HG3  ARG  19           HG3      ARG  19  19.366   0.841  20.866
  134    HD2  ARG  19           HD2      ARG  19  18.220   2.628  19.710
  135    HD3  ARG  19           HD3      ARG  19  18.987   2.199  18.177
  136    HE   ARG  19           HE       ARG  19  17.634  -0.091  19.230
  137   HH11  ARG  19          HH11      ARG  19  16.840   2.929  17.642
  138   HH12  ARG  19          HH12      ARG  19  15.352   2.306  16.994
  139   HH21  ARG  19          HH21      ARG  19  15.744  -0.832  18.354
  140   HH22  ARG  19          HH22      ARG  19  14.750   0.226  17.400
  141    H    ARG  20           H        ARG  20  21.126   1.096  16.845
  142    HA   ARG  20           HA       ARG  20  20.916   3.730  15.439
  143    HB2  ARG  20           HB2      ARG  20  21.371   2.627  13.378
  144    HB3  ARG  20           HB3      ARG  20  22.621   2.144  14.529
  145    HG2  ARG  20           HG2      ARG  20  21.448  -0.015  14.907
  146    HG3  ARG  20           HG3      ARG  20  20.234   0.433  13.699
  147    HD2  ARG  20           HD2      ARG  20  23.219   0.221  13.148
  148    HD3  ARG  20           HD3      ARG  20  22.070  -1.082  12.870
  149    HE   ARG  20           HE       ARG  20  22.406   1.382  11.281
  150   HH11  ARG  20          HH11      ARG  20  20.259  -1.345  11.820
  151   HH12  ARG  20          HH12      ARG  20  19.526  -1.183  10.248
  152   HH21  ARG  20          HH21      ARG  20  21.404   1.536   9.307
  153   HH22  ARG  20          HH22      ARG  20  20.146   0.416   8.882
  154    H    CYS  21           H        CYS  21  19.160   4.125  14.096
  155    HA   CYS  21           HA       CYS  21  16.688   2.594  14.805
  156    HB2  CYS  21           HB2      CYS  21  16.961   4.945  15.630
  157    HB3  CYS  21           HB3      CYS  21  17.000   5.483  13.943
  158    H    SER  22           H        SER  22  15.977   1.316  13.278
  159    HA   SER  22           HA       SER  22  16.861   1.211  10.577
  160    HB2  SER  22           HB2      SER  22  15.068  -0.492  10.330
  161    HB3  SER  22           HB3      SER  22  16.085  -0.751  11.756
  162    HG   SER  22           HG       SER  22  13.827  -0.964  12.212
  163    H    GLN  23           H        GLN  23  14.620   3.372  11.891
  164    HA   GLN  23           HA       GLN  23  13.267   3.845   9.262
  165    HB2  GLN  23           HB2      GLN  23  12.360   4.481  12.095
  166    HB3  GLN  23           HB3      GLN  23  11.476   4.880  10.619
  167    HG2  GLN  23           HG2      GLN  23  11.306   2.461  10.058
  168    HG3  GLN  23           HG3      GLN  23  12.145   2.053  11.555
  169   HE21  GLN  23          HE21      GLN  23   9.054   3.047  10.183
  170   HE22  GLN  23          HE22      GLN  23   8.177   2.955  11.708
  171    H    CYS  24           H        CYS  24  15.746   5.105  11.129
  172    HA   CYS  24           HA       CYS  24  15.303   7.899  10.141
  173    HB2  CYS  24           HB2      CYS  24  16.567   7.174  12.787
  174    HB3  CYS  24           HB3      CYS  24  16.050   8.756  12.218
  175    H    GLY  25           H        GLY  25  17.719   5.366  10.852
  176    HA2  GLY  25           HA2      GLY  25  19.784   5.036   9.908
  177    HA3  GLY  25           HA3      GLY  25  19.579   6.490   8.935
  178    H    ILE  26           H        ILE  26  19.292   7.033  12.332
  179    HA   ILE  26           HA       ILE  26  22.043   8.192  12.482
  180    HB   ILE  26           HB       ILE  26  20.169   9.763  12.669
  181   HG12  ILE  26          HG12      ILE  26  21.689   9.537  15.300
  182   HG13  ILE  26          HG13      ILE  26  22.349  10.188  13.792
  183   HG21  ILE  26          HG21      ILE  26  18.505   8.241  13.744
  184   HG22  ILE  26          HG22      ILE  26  19.418   8.343  15.262
  185   HG23  ILE  26          HG23      ILE  26  18.654   9.791  14.563
  186   HD11  ILE  26          HD11      ILE  26  20.071  11.344  15.452
  187   HD12  ILE  26          HD12      ILE  26  21.687  12.021  15.194
  188   HD13  ILE  26          HD13      ILE  26  20.538  11.947  13.837
  189    H    LEU  27           H        LEU  27  23.213   8.002  14.494
  190    HA   LEU  27           HA       LEU  27  22.589   5.558  16.103
  191    HB2  LEU  27           HB2      LEU  27  25.317   6.485  15.082
  192    HB3  LEU  27           HB3      LEU  27  25.030   5.224  16.267
  193    HG   LEU  27           HG       LEU  27  23.565   4.115  14.388
  194   HD11  LEU  27          HD11      LEU  27  23.701   5.895  12.680
  195   HD12  LEU  27          HD12      LEU  27  24.526   4.443  12.119
  196   HD13  LEU  27          HD13      LEU  27  25.475   5.819  12.726
  197   HD21  LEU  27          HD21      LEU  27  26.610   4.170  14.268
  198   HD22  LEU  27          HD22      LEU  27  25.564   2.894  13.601
  199   HD23  LEU  27          HD23      LEU  27  25.625   3.158  15.350
  200    H    LEU  28           H        LEU  28  22.535   5.872  18.225
  201    HA   LEU  28           HA       LEU  28  23.824   8.293  19.452
  202    HB2  LEU  28           HB2      LEU  28  21.133   7.044  20.164
  203    HB3  LEU  28           HB3      LEU  28  21.930   8.314  21.054
  204    HG   LEU  28           HG       LEU  28  20.246   9.387  19.957
  205   HD11  LEU  28          HD11      LEU  28  21.227  10.984  18.490
  206   HD12  LEU  28          HD12      LEU  28  22.531   9.881  18.032
  207   HD13  LEU  28          HD13      LEU  28  22.460  10.527  19.684
  208   HD21  LEU  28          HD21      LEU  28  19.614   9.233  17.646
  209   HD22  LEU  28          HD22      LEU  28  19.605   7.616  18.372
  210   HD23  LEU  28          HD23      LEU  28  20.933   8.105  17.297
  211    HA   PRO  29           HA       PRO  29  25.595   5.259  22.178
  212    HB2  PRO  29           HB2      PRO  29  26.248   6.717  24.412
  213    HB3  PRO  29           HB3      PRO  29  27.093   6.842  22.845
  214    HG2  PRO  29           HG2      PRO  29  24.913   8.646  23.921
  215    HG3  PRO  29           HG3      PRO  29  26.454   9.110  23.140
  216    HD2  PRO  29           HD2      PRO  29  24.090   9.025  21.772
  217    HD3  PRO  29           HD3      PRO  29  25.638   8.575  21.002
  218    H    LEU  30           H        LEU  30  23.774   7.227  24.547
  219    HA   LEU  30           HA       LEU  30  21.824   5.143  25.098
  220    HB2  LEU  30           HB2      LEU  30  24.354   5.226  26.583
  221    HB3  LEU  30           HB3      LEU  30  22.998   5.403  27.657
  222    HG   LEU  30           HG       LEU  30  23.079   3.149  25.624
  223   HD11  LEU  30          HD11      LEU  30  23.932   1.695  27.431
  224   HD12  LEU  30          HD12      LEU  30  24.160   3.159  28.481
  225   HD13  LEU  30          HD13      LEU  30  25.115   2.967  26.955
  226   HD21  LEU  30          HD21      LEU  30  21.529   2.076  27.167
  227   HD22  LEU  30          HD22      LEU  30  20.892   3.655  26.695
  228   HD23  LEU  30          HD23      LEU  30  21.643   3.447  28.288
  229    HA   PRO  31           HA       PRO  31  20.668   8.853  27.769
  230    HB2  PRO  31           HB2      PRO  31  22.220  11.118  27.995
  231    HB3  PRO  31           HB3      PRO  31  22.327   9.687  29.074
  232    HG2  PRO  31           HG2      PRO  31  24.083  10.384  26.715
  233    HG3  PRO  31           HG3      PRO  31  24.568   9.771  28.325
  234    HD2  PRO  31           HD2      PRO  31  24.347   8.137  26.152
  235    HD3  PRO  31           HD3      PRO  31  23.949   7.583  27.794
  236    H    ILE  32           H        ILE  32  22.551  10.106  24.919
  237    HA   ILE  32           HA       ILE  32  20.538  12.039  24.192
  238    HB   ILE  32           HB       ILE  32  22.673  10.798  22.410
  239   HG12  ILE  32          HG12      ILE  32  23.508  13.380  23.018
  240   HG13  ILE  32          HG13      ILE  32  22.762  12.917  24.534
  241   HG21  ILE  32          HG21      ILE  32  21.060  13.369  22.101
  242   HG22  ILE  32          HG22      ILE  32  22.426  12.877  21.076
  243   HG23  ILE  32          HG23      ILE  32  20.948  11.929  21.068
  244   HD11  ILE  32          HD11      ILE  32  25.140  12.398  24.570
  245   HD12  ILE  32          HD12      ILE  32  24.253  10.859  24.535
  246   HD13  ILE  32          HD13      ILE  32  25.012  11.479  23.054
  247    H    LEU  33           H        LEU  33  20.768   8.601  23.599
  248    HA   LEU  33           HA       LEU  33  18.893   8.286  21.495
  249    HB2  LEU  33           HB2      LEU  33  20.385   6.512  22.446
  250    HB3  LEU  33           HB3      LEU  33  19.409   6.519  23.911
  251    HG   LEU  33           HG       LEU  33  17.447   5.712  22.630
  252   HD11  LEU  33          HD11      LEU  33  18.072   6.546  20.358
  253   HD12  LEU  33          HD12      LEU  33  17.730   4.818  20.368
  254   HD13  LEU  33          HD13      LEU  33  19.415   5.382  20.319
  255   HD21  LEU  33          HD21      LEU  33  18.299   3.421  22.295
  256   HD22  LEU  33          HD22      LEU  33  18.902   4.143  23.796
  257   HD23  LEU  33          HD23      LEU  33  19.970   4.037  22.382
  258    H    ASN  34           H        ASN  34  18.312   9.218  24.862
  259    HA   ASN  34           HA       ASN  34  15.560   8.553  25.074
  260    HB2  ASN  34           HB2      ASN  34  17.086   9.315  26.917
  261    HB3  ASN  34           HB3      ASN  34  17.051  10.944  26.247
  262   HD21  ASN  34          HD21      ASN  34  15.254   8.541  28.076
  263   HD22  ASN  34          HD22      ASN  34  13.922   9.617  28.484
  264    H    GLN  35           H        GLN  35  17.081  11.523  23.693
  265    HA   GLN  35           HA       GLN  35  14.593  12.839  23.074
  266    HB2  GLN  35           HB2      GLN  35  16.801  13.980  23.221
  267    HB3  GLN  35           HB3      GLN  35  17.321  13.151  21.747
  268    HG2  GLN  35           HG2      GLN  35  15.495  14.266  20.476
  269    HG3  GLN  35           HG3      GLN  35  14.928  15.040  21.955
  270   HE21  GLN  35          HE21      GLN  35  16.058  16.931  22.712
  271   HE22  GLN  35          HE22      GLN  35  17.364  17.645  21.767
  272    H    HIS  36           H        HIS  36  16.666  10.568  21.212
  273    HA   HIS  36           HA       HIS  36  15.105  10.653  18.809
  274    HB2  HIS  36           HB2      HIS  36  17.415   9.605  19.089
  275    HB3  HIS  36           HB3      HIS  36  16.608   8.209  19.810
  276    HD1  HIS  36           HD1      HIS  36  17.206   9.921  16.502
  277    HD2  HIS  36           HD2      HIS  36  14.808   6.851  18.084
  278    HE1  HIS  36           HE1      HIS  36  16.162   8.774  14.517
  279    H    GLN  37           H        GLN  37  14.915   8.427  21.655
  280    HA   GLN  37           HA       GLN  37  12.792   6.835  20.708
  281    HB2  GLN  37           HB2      GLN  37  13.651   7.609  23.516
  282    HB3  GLN  37           HB3      GLN  37  12.322   6.497  23.227
  283    HG2  GLN  37           HG2      GLN  37  15.149   6.088  22.171
  284    HG3  GLN  37           HG3      GLN  37  14.531   5.371  23.653
  285   HE21  GLN  37          HE21      GLN  37  15.567   3.926  21.328
  286   HE22  GLN  37          HE22      GLN  37  14.223   2.958  20.735
  287    H    GLU  38           H        GLU  38  12.500   9.936  22.571
  288    HA   GLU  38           HA       GLU  38   9.616   9.863  22.571
  289    HB2  GLU  38           HB2      GLU  38  11.476  12.275  22.726
  290    HB3  GLU  38           HB3      GLU  38   9.726  12.279  23.012
  291    HG2  GLU  38           HG2      GLU  38  10.229  10.418  24.789
  292    HG3  GLU  38           HG3      GLU  38  11.896  11.008  24.702
  293    H    LYS  39           H        LYS  39  11.886  11.471  20.256
  294    HA   LYS  39           HA       LYS  39   9.756  12.621  18.696
  295    HB2  LYS  39           HB2      LYS  39  12.200  13.338  18.894
  296    HB3  LYS  39           HB3      LYS  39  12.601  12.089  17.734
  297    HG2  LYS  39           HG2      LYS  39  10.507  14.250  17.215
  298    HG3  LYS  39           HG3      LYS  39  12.208  14.554  16.963
  299    HD2  LYS  39           HD2      LYS  39  10.596  12.433  15.481
  300    HD3  LYS  39           HD3      LYS  39  10.975  14.028  14.870
  301    HE2  LYS  39           HE2      LYS  39  13.072  11.936  15.615
  302    HE3  LYS  39           HE3      LYS  39  12.429  12.183  13.992
  303    HZ1  LYS  39           HZ1      LYS  39  14.488  13.397  14.259
  304    HZ2  LYS  39           HZ2      LYS  39  13.923  14.230  15.538
  305    HZ3  LYS  39           HZ3      LYS  39  13.280  14.466  14.058
  306    H    CYS  40           H        CYS  40  11.717   9.699  18.170
  307    HA   CYS  40           HA       CYS  40  10.613   8.910  15.680
  308    HB2  CYS  40           HB2      CYS  40  12.755   8.276  17.008
  309    HB3  CYS  40           HB3      CYS  40  11.759   7.062  17.808
  310    H    ARG  41           H        ARG  41   9.699   8.007  19.054
  311    HA   ARG  41           HA       ARG  41   7.433   6.362  18.398
  312    HB2  ARG  41           HB2      ARG  41   8.496   6.341  20.591
  313    HB3  ARG  41           HB3      ARG  41   8.037   8.027  20.878
  314    HG2  ARG  41           HG2      ARG  41   5.709   7.492  21.005
  315    HG3  ARG  41           HG3      ARG  41   5.965   5.846  20.407
  316    HD2  ARG  41           HD2      ARG  41   7.153   6.905  23.008
  317    HD3  ARG  41           HD3      ARG  41   5.580   6.091  22.908
  318    HE   ARG  41           HE       ARG  41   7.423   4.393  21.630
  319   HH11  ARG  41          HH11      ARG  41   6.953   5.548  24.905
  320   HH12  ARG  41          HH12      ARG  41   7.644   4.109  25.605
  321   HH21  ARG  41          HH21      ARG  41   8.282   2.591  22.583
  322   HH22  ARG  41          HH22      ARG  41   8.371   2.478  24.316
  323    H    TRP  42           H        TRP  42   7.577   9.900  19.135
  324    HA   TRP  42           HA       TRP  42   4.795  10.376  18.818
  325    HB2  TRP  42           HB2      TRP  42   6.401  11.997  19.774
  326    HB3  TRP  42           HB3      TRP  42   7.101  12.254  18.181
  327    HD1  TRP  42           HD1      TRP  42   4.140  13.153  20.342
  328    HE1  TRP  42           HE1      TRP  42   2.665  14.918  19.199
  329    HE3  TRP  42           HE3      TRP  42   6.373  13.223  15.717
  330    HZ2  TRP  42           HZ2      TRP  42   2.412  16.120  16.592
  331    HZ3  TRP  42           HZ3      TRP  42   5.459  14.661  13.912
  332    HH2  TRP  42           HH2      TRP  42   3.484  16.109  14.334
  333    H    LEU  43           H        LEU  43   7.398  10.494  16.347
  334    HA   LEU  43           HA       LEU  43   5.755  11.223  14.160
  335    HB2  LEU  43           HB2      LEU  43   8.340  11.164  14.464
  336    HB3  LEU  43           HB3      LEU  43   8.252   9.483  13.992
  337    HG   LEU  43           HG       LEU  43   8.942  10.876  12.163
  338   HD11  LEU  43          HD11      LEU  43   6.080  10.103  11.502
  339   HD12  LEU  43          HD12      LEU  43   7.440   8.946  11.601
  340   HD13  LEU  43          HD13      LEU  43   7.461  10.260  10.401
  341   HD21  LEU  43          HD21      LEU  43   7.892  12.995  12.911
  342   HD22  LEU  43          HD22      LEU  43   6.312  12.396  12.355
  343   HD23  LEU  43          HD23      LEU  43   7.628  12.655  11.193
  344    H    ALA  44           H        ALA  44   6.815   7.907  15.170
  345    HA   ALA  44           HA       ALA  44   5.324   6.493  13.217
  346    HB1  ALA  44           HB1      ALA  44   5.697   4.556  14.700
  347    HB2  ALA  44           HB2      ALA  44   7.166   5.537  14.541
  348    HB3  ALA  44           HB3      ALA  44   6.181   5.645  16.019
  349    H    SER  45           H        SER  45   4.313   7.564  16.489
  350    HA   SER  45           HA       SER  45   1.718   6.312  16.439
  351    HB2  SER  45           HB2      SER  45   2.933   7.074  18.484
  352    HB3  SER  45           HB3      SER  45   2.668   8.755  17.990
  353    HG   SER  45           HG       SER  45   0.726   6.785  18.703
  354    H    SER  46           H        SER  46   2.808   9.623  15.569
  355    HA   SER  46           HA       SER  46   0.243  10.693  14.883
  356    HB2  SER  46           HB2      SER  46   2.266  12.025  15.392
  357    HB3  SER  46           HB3      SER  46   3.020  11.459  13.887
  358    HG   SER  46           HG       SER  46   1.981  13.526  13.701
  359    H    LYS  47           H        LYS  47   2.713   9.036  12.924
  360    HA   LYS  47           HA       LYS  47   1.302   9.256  10.399
  361    HB2  LYS  47           HB2      LYS  47   3.791   9.202  10.776
  362    HB3  LYS  47           HB3      LYS  47   3.659   7.477  11.138
  363    HG2  LYS  47           HG2      LYS  47   2.839   7.059   8.835
  364    HG3  LYS  47           HG3      LYS  47   2.741   8.799   8.535
  365    HD2  LYS  47           HD2      LYS  47   4.716   7.927   7.460
  366    HD3  LYS  47           HD3      LYS  47   5.203   8.989   8.792
  367    HE2  LYS  47           HE2      LYS  47   5.575   6.970  10.231
  368    HE3  LYS  47           HE3      LYS  47   5.104   5.933   8.874
  369    HZ1  LYS  47           HZ1      LYS  47   7.440   7.780   8.888
  370    HZ2  LYS  47           HZ2      LYS  47   7.004   6.837   7.625
  371    HZ3  LYS  47           HZ3      LYS  47   7.519   6.154   9.015
  372    H    GLY  48           H        GLY  48  -0.672   8.389  11.694
  373    HA2  GLY  48           HA2      GLY  48  -1.092   5.670  12.284
  374    HA3  GLY  48           HA3      GLY  48  -2.351   6.822  11.825
  375    H    LYS  49           H        LYS  49  -1.421   7.286   9.109
  376    HA   LYS  49           HA       LYS  49  -2.305   4.809   7.749
  377    HB2  LYS  49           HB2      LYS  49  -3.062   7.194   7.114
  378    HB3  LYS  49           HB3      LYS  49  -1.432   7.449   6.503
  379    HG2  LYS  49           HG2      LYS  49  -2.555   6.792   4.567
  380    HG3  LYS  49           HG3      LYS  49  -1.852   5.270   5.093
  381    HD2  LYS  49           HD2      LYS  49  -4.040   4.655   4.567
  382    HD3  LYS  49           HD3      LYS  49  -4.147   4.881   6.328
  383    HE2  LYS  49           HE2      LYS  49  -4.948   7.262   5.885
  384    HE3  LYS  49           HE3      LYS  49  -4.925   6.890   4.147
  385    HZ1  LYS  49           HZ1      LYS  49  -7.140   6.576   5.040
  386    HZ2  LYS  49           HZ2      LYS  49  -6.621   5.531   6.188
  387    HZ3  LYS  49           HZ3      LYS  49  -6.564   5.108   4.601
  388    H    GLN  50           H        GLN  50  -0.928   3.320   6.983
  389    HA   GLN  50           HA       GLN  50   1.950   3.637   7.075
  390    HB2  GLN  50           HB2      GLN  50   2.060   1.397   6.226
  391    HB3  GLN  50           HB3      GLN  50   0.848   1.487   7.499
  392    HG2  GLN  50           HG2      GLN  50  -0.959   1.499   5.803
  393    HG3  GLN  50           HG3      GLN  50   0.231   1.457   4.503
  394   HE21  GLN  50          HE21      GLN  50  -1.803  -0.512   4.740
  395   HE22  GLN  50          HE22      GLN  50  -1.010  -2.034   5.133
  396    H    VAL  51           H        VAL  51   3.376   3.131   5.232
  397    HA   VAL  51           HA       VAL  51   2.729   4.676   2.783
  398    HB   VAL  51           HB       VAL  51   5.087   4.332   2.201
  399   HG11  VAL  51          HG11      VAL  51   6.061   5.755   3.905
  400   HG12  VAL  51          HG12      VAL  51   4.400   6.274   3.573
  401   HG13  VAL  51          HG13      VAL  51   4.765   5.357   5.051
  402   HG21  VAL  51          HG21      VAL  51   5.411   2.932   4.897
  403   HG22  VAL  51          HG22      VAL  51   5.468   2.122   3.316
  404   HG23  VAL  51          HG23      VAL  51   6.685   3.336   3.729
  405    H    ARG  52           H        ARG  52   3.700   3.624   0.698
  406    HA   ARG  52           HA       ARG  52   2.706   0.810   0.421
  407    HB2  ARG  52           HB2      ARG  52   1.272   2.841  -0.439
  408    HB3  ARG  52           HB3      ARG  52   2.421   2.870  -1.779
  409    HG2  ARG  52           HG2      ARG  52   1.829   0.471  -2.271
  410    HG3  ARG  52           HG3      ARG  52   0.719   0.488  -0.890
  411    HD2  ARG  52           HD2      ARG  52  -0.564   2.327  -1.982
  412    HD3  ARG  52           HD3      ARG  52   0.523   2.226  -3.385
  413    HE   ARG  52           HE       ARG  52  -0.484  -0.373  -2.925
  414   HH11  ARG  52          HH11      ARG  52  -1.825   2.703  -3.931
  415   HH12  ARG  52          HH12      ARG  52  -3.149   1.950  -4.779
  416   HH21  ARG  52          HH21      ARG  52  -2.196  -1.267  -4.017
  417   HH22  ARG  52          HH22      ARG  52  -3.345  -0.240  -4.825
  418    H    ASN  53           H        ASN  53   5.460   1.901   0.784
  419    HA   ASN  53           HA       ASN  53   6.815   0.270  -1.229
  420    HB2  ASN  53           HB2      ASN  53   8.424   2.129  -1.817
  421    HB3  ASN  53           HB3      ASN  53   6.799   2.321  -2.438
  422   HD21  ASN  53          HD21      ASN  53   6.592   4.532  -2.600
  423   HD22  ASN  53          HD22      ASN  53   6.818   5.632  -1.253
  424    H    PHE  54           H        PHE  54   9.252   0.236  -0.714
  425    HA   PHE  54           HA       PHE  54   9.825   0.453   2.209
  426    HB2  PHE  54           HB2      PHE  54   8.928  -1.800   1.824
  427    HB3  PHE  54           HB3      PHE  54  10.098  -2.074   0.541
  428    HD1  PHE  54           HD2      PHE  54   9.825  -1.336   4.216
  429    HD2  PHE  54           HD1      PHE  54  12.246  -2.988   1.049
  430    HE1  PHE  54           HE2      PHE  54  11.451  -2.182   5.896
  431    HE2  PHE  54           HE1      PHE  54  13.864  -3.835   2.731
  432    HZ   PHE  54           HZ       PHE  54  13.473  -3.429   5.155
  433    H    SER  55           H        SER  55  11.109  -0.057  -1.054
  434    HA   SER  55           HA       SER  55  13.191   0.139  -1.988
  435    HB2  SER  55           HB2      SER  55  12.925   2.775  -0.518
  436    HB3  SER  55           HB3      SER  55  13.992   2.459  -1.901
  437    HG   SER  55           HG       SER  55  11.954   3.347  -2.568
  Start of MODEL    7
    1    H1   GLY   1           H1       GLY   1  19.496 -14.853   9.546
    2    H2   GLY   1           H2       GLY   1  17.876 -15.112   9.484
    3    H3   GLY   1           H3       GLY   1  18.531 -14.305  10.763
    4    HA2  GLY   1           HA2      GLY   1  17.438 -12.764   9.270
    5    HA3  GLY   1           HA3      GLY   1  19.176 -12.467   9.379
    6    H    SER   2           H        SER   2  17.522 -11.622   7.235
    7    HA   SER   2           HA       SER   2  18.014 -13.226   4.835
    8    HB2  SER   2           HB2      SER   2  17.400 -11.015   3.730
    9    HB3  SER   2           HB3      SER   2  16.198 -11.666   4.831
   10    HG   SER   2           HG       SER   2  16.470  -9.440   5.200
   11    H    GLU   3           H        GLU   3  19.295 -12.126   3.000
   12    HA   GLU   3           HA       GLU   3  22.064 -11.932   3.664
   13    HB2  GLU   3           HB2      GLU   3  22.385 -11.280   1.327
   14    HB3  GLU   3           HB3      GLU   3  21.355 -12.698   1.501
   15    HG2  GLU   3           HG2      GLU   3  19.337 -11.290   1.105
   16    HG3  GLU   3           HG3      GLU   3  20.366  -9.863   0.946
   17    H    PHE   4           H        PHE   4  23.546 -10.201   3.481
   18    HA   PHE   4           HA       PHE   4  22.451  -7.478   4.108
   19    HB2  PHE   4           HB2      PHE   4  24.931  -8.910   5.133
   20    HB3  PHE   4           HB3      PHE   4  24.633  -7.195   5.347
   21    HD1  PHE   4           HD2      PHE   4  22.548  -6.422   6.611
   22    HD2  PHE   4           HD1      PHE   4  24.013 -10.478   6.714
   23    HE1  PHE   4           HE2      PHE   4  21.322  -6.812   8.736
   24    HE2  PHE   4           HE1      PHE   4  22.791 -10.863   8.842
   25    HZ   PHE   4           HZ       PHE   4  21.447  -9.031   9.857
   26    H    THR   5           H        THR   5  23.472  -5.690   3.232
   27    HA   THR   5           HA       THR   5  24.418  -5.939   0.575
   28    HB   THR   5           HB       THR   5  24.715  -3.525   2.404
   29    HG1  THR   5           HG1      THR   5  22.510  -4.308   0.796
   30   HG21  THR   5          HG21      THR   5  24.346  -2.235   0.317
   31   HG22  THR   5          HG22      THR   5  24.369  -3.748  -0.621
   32   HG23  THR   5          HG23      THR   5  25.825  -3.202   0.241
   33    H    SER   6           H        SER   6  26.252  -4.879   3.476
   34    HA   SER   6           HA       SER   6  28.789  -6.016   2.515
   35    HB2  SER   6           HB2      SER   6  28.425  -3.007   2.920
   36    HB3  SER   6           HB3      SER   6  29.985  -3.830   2.768
   37    HG   SER   6           HG       SER   6  29.321  -2.940   0.780
   38    H    SER   7           H        SER   7  30.427  -6.001   4.168
   39    HA   SER   7           HA       SER   7  29.512  -5.740   6.963
   40    HB2  SER   7           HB2      SER   7  31.709  -6.747   7.471
   41    HB3  SER   7           HB3      SER   7  30.816  -7.700   6.281
   42    HG   SER   7           HG       SER   7  32.968  -7.442   5.630
   43    HA   PRO   8           HA       PRO   8  31.577  -1.795   7.566
   44    HB2  PRO   8           HB2      PRO   8  32.379  -1.845  10.178
   45    HB3  PRO   8           HB3      PRO   8  30.661  -1.814   9.687
   46    HG2  PRO   8           HG2      PRO   8  32.336  -4.238  10.422
   47    HG3  PRO   8           HG3      PRO   8  30.727  -3.773  11.064
   48    HD2  PRO   8           HD2      PRO   8  30.980  -5.566   9.050
   49    HD3  PRO   8           HD3      PRO   8  29.644  -4.381   9.055
   50    H    ARG   9           H        ARG   9  33.391  -4.628   7.425
   51    HA   ARG   9           HA       ARG   9  35.597  -5.225   7.389
   52    HB2  ARG   9           HB2      ARG   9  35.855  -2.600   5.881
   53    HB3  ARG   9           HB3      ARG   9  36.945  -3.988   5.800
   54    HG2  ARG   9           HG2      ARG   9  34.928  -5.370   4.991
   55    HG3  ARG   9           HG3      ARG   9  34.065  -3.832   4.835
   56    HD2  ARG   9           HD2      ARG   9  34.932  -4.324   2.682
   57    HD3  ARG   9           HD3      ARG   9  35.941  -3.024   3.340
   58    HE   ARG   9           HE       ARG   9  37.016  -5.670   3.907
   59   HH11  ARG   9          HH11      ARG   9  36.899  -3.300   1.330
   60   HH12  ARG   9          HH12      ARG   9  38.346  -3.916   0.578
   61   HH21  ARG   9          HH21      ARG   9  38.847  -6.404   2.902
   62   HH22  ARG   9          HH22      ARG   9  39.412  -5.634   1.448
   63    H    GLY  10           H        GLY  10  35.163  -4.399   9.862
   64    HA2  GLY  10           HA2      GLY  10  37.839  -3.541  10.733
   65    HA3  GLY  10           HA3      GLY  10  36.516  -2.473  11.213
   66    H    ASP  11           H        ASP  11  37.899  -3.449  13.204
   67    HA   ASP  11           HA       ASP  11  36.356  -5.696  14.442
   68    HB2  ASP  11           HB2      ASP  11  39.377  -5.444  14.180
   69    HB3  ASP  11           HB3      ASP  11  38.566  -6.554  15.280
   70    H    LYS  12           H        LYS  12  35.260  -4.277  15.793
   71    HA   LYS  12           HA       LYS  12  36.743  -3.468  18.194
   72    HB2  LYS  12           HB2      LYS  12  36.593  -1.497  16.368
   73    HB3  LYS  12           HB3      LYS  12  34.943  -1.374  16.938
   74    HG2  LYS  12           HG2      LYS  12  36.134   0.210  18.206
   75    HG3  LYS  12           HG3      LYS  12  35.894  -1.137  19.310
   76    HD2  LYS  12           HD2      LYS  12  38.131  -0.334  19.596
   77    HD3  LYS  12           HD3      LYS  12  38.258  -1.903  18.792
   78    HE2  LYS  12           HE2      LYS  12  38.544  -0.759  16.602
   79    HE3  LYS  12           HE3      LYS  12  38.356   0.811  17.393
   80    HZ1  LYS  12           HZ1      LYS  12  40.379   0.319  18.674
   81    HZ2  LYS  12           HZ2      LYS  12  40.693   0.269  17.073
   82    HZ3  LYS  12           HZ3      LYS  12  40.553  -1.120  17.917
   83    H    ALA  13           H        ALA  13  35.510  -3.547  20.035
   84    HA   ALA  13           HA       ALA  13  32.797  -4.631  19.913
   85    HB1  ALA  13           HB1      ALA  13  34.484  -5.405  21.545
   86    HB2  ALA  13           HB2      ALA  13  34.542  -3.779  22.267
   87    HB3  ALA  13           HB3      ALA  13  33.054  -4.744  22.354
   88    H    ALA  14           H        ALA  14  33.962  -1.448  19.785
   89    HA   ALA  14           HA       ALA  14  32.351   0.005  21.542
   90    HB1  ALA  14           HB1      ALA  14  34.357   0.850  20.374
   91    HB2  ALA  14           HB2      ALA  14  33.477   0.817  18.825
   92    HB3  ALA  14           HB3      ALA  14  32.970   1.924  20.117
   93    H    TYR  15           H        TYR  15  31.260  -1.526  18.617
   94    HA   TYR  15           HA       TYR  15  29.024   0.332  18.203
   95    HB2  TYR  15           HB2      TYR  15  29.746  -2.217  16.731
   96    HB3  TYR  15           HB3      TYR  15  28.634  -0.966  16.191
   97    HD1  TYR  15           HD2      TYR  15  29.711   1.523  16.184
   98    HD2  TYR  15           HD1      TYR  15  31.926  -2.165  15.822
   99    HE1  TYR  15           HE2      TYR  15  31.615   2.765  15.161
  100    HE2  TYR  15           HE1      TYR  15  33.812  -0.926  14.772
  101    HH   TYR  15           HH       TYR  15  34.621   1.117  14.111
  102    H    ASP  16           H        ASP  16  29.406  -2.441  20.169
  103    HA   ASP  16           HA       ASP  16  26.646  -3.416  19.902
  104    HB2  ASP  16           HB2      ASP  16  28.909  -4.083  21.816
  105    HB3  ASP  16           HB3      ASP  16  27.316  -4.831  21.883
  106    H    ILE  17           H        ILE  17  28.331  -1.152  22.047
  107    HA   ILE  17           HA       ILE  17  26.142  -0.961  23.970
  108    HB   ILE  17           HB       ILE  17  28.333  -0.501  24.697
  109   HG12  ILE  17          HG12      ILE  17  26.333   0.833  25.614
  110   HG13  ILE  17          HG13      ILE  17  27.968   1.242  26.090
  111   HG21  ILE  17          HG21      ILE  17  28.553   1.768  22.687
  112   HG22  ILE  17          HG22      ILE  17  29.680   1.459  24.022
  113   HG23  ILE  17          HG23      ILE  17  29.499   0.264  22.743
  114   HD11  ILE  17          HD11      ILE  17  28.000   3.218  24.680
  115   HD12  ILE  17          HD12      ILE  17  26.412   2.822  23.997
  116   HD13  ILE  17          HD13      ILE  17  26.563   3.237  25.709
  117    H    LEU  18           H        LEU  18  27.029   0.774  21.011
  118    HA   LEU  18           HA       LEU  18  25.141   2.921  21.246
  119    HB2  LEU  18           HB2      LEU  18  26.274   1.644  18.722
  120    HB3  LEU  18           HB3      LEU  18  25.519   3.235  18.839
  121    HG   LEU  18           HG       LEU  18  28.173   2.401  20.075
  122   HD11  LEU  18          HD11      LEU  18  28.183   2.739  17.618
  123   HD12  LEU  18          HD12      LEU  18  29.144   3.963  18.470
  124   HD13  LEU  18          HD13      LEU  18  27.522   4.382  17.849
  125   HD21  LEU  18          HD21      LEU  18  27.208   4.024  21.561
  126   HD22  LEU  18          HD22      LEU  18  26.721   5.065  20.205
  127   HD23  LEU  18          HD23      LEU  18  28.430   4.840  20.597
  128    H    ARG  19           H        ARG  19  23.245   3.297  20.054
  129    HA   ARG  19           HA       ARG  19  21.699   0.924  19.055
  130    HB2  ARG  19           HB2      ARG  19  20.930   3.140  20.942
  131    HB3  ARG  19           HB3      ARG  19  19.712   2.630  19.791
  132    HG2  ARG  19           HG2      ARG  19  21.176   0.607  21.521
  133    HG3  ARG  19           HG3      ARG  19  19.772   1.478  22.115
  134    HD2  ARG  19           HD2      ARG  19  19.729  -0.154  19.547
  135    HD3  ARG  19           HD3      ARG  19  19.314  -0.824  21.103
  136    HE   ARG  19           HE       ARG  19  17.687   0.947  19.457
  137   HH11  ARG  19          HH11      ARG  19  18.097  -0.169  22.761
  138   HH12  ARG  19          HH12      ARG  19  16.457   0.238  23.194
  139   HH21  ARG  19          HH21      ARG  19  15.577   1.338  20.064
  140   HH22  ARG  19          HH22      ARG  19  15.105   1.135  21.731
  141    H    ARG  20           H        ARG  20  20.402   1.257  17.317
  142    HA   ARG  20           HA       ARG  20  20.777   3.718  15.679
  143    HB2  ARG  20           HB2      ARG  20  21.478   2.514  13.787
  144    HB3  ARG  20           HB3      ARG  20  22.416   1.843  15.115
  145    HG2  ARG  20           HG2      ARG  20  20.617  -0.035  15.218
  146    HG3  ARG  20           HG3      ARG  20  20.069   0.598  13.659
  147    HD2  ARG  20           HD2      ARG  20  21.551  -1.111  13.043
  148    HD3  ARG  20           HD3      ARG  20  22.518   0.343  12.872
  149    HE   ARG  20           HE       ARG  20  23.858  -0.309  14.687
  150   HH11  ARG  20          HH11      ARG  20  21.183  -2.565  14.451
  151   HH12  ARG  20          HH12      ARG  20  21.898  -3.674  15.587
  152   HH21  ARG  20          HH21      ARG  20  24.694  -1.762  16.167
  153   HH22  ARG  20          HH22      ARG  20  23.829  -3.227  16.519
  154    H    CYS  21           H        CYS  21  19.268   3.771  13.818
  155    HA   CYS  21           HA       CYS  21  16.577   2.647  14.512
  156    HB2  CYS  21           HB2      CYS  21  16.958   4.864  15.535
  157    HB3  CYS  21           HB3      CYS  21  17.337   5.540  13.929
  158    H    SER  22           H        SER  22  15.896   1.525  12.881
  159    HA   SER  22           HA       SER  22  17.025   1.376  10.325
  160    HB2  SER  22           HB2      SER  22  14.275   0.441  11.200
  161    HB3  SER  22           HB3      SER  22  15.199  -0.182   9.828
  162    HG   SER  22           HG       SER  22  16.743  -0.983  11.260
  163    H    GLN  23           H        GLN  23  14.972   3.844  11.284
  164    HA   GLN  23           HA       GLN  23  14.263   4.487   8.450
  165    HB2  GLN  23           HB2      GLN  23  12.183   5.470   9.190
  166    HB3  GLN  23           HB3      GLN  23  12.264   3.767   9.629
  167    HG2  GLN  23           HG2      GLN  23  12.838   4.377  11.961
  168    HG3  GLN  23           HG3      GLN  23  12.769   6.090  11.545
  169   HE21  GLN  23          HE21      GLN  23  11.089   4.224  13.402
  170   HE22  GLN  23          HE22      GLN  23   9.445   4.642  12.937
  171    H    CYS  24           H        CYS  24  16.326   5.382  10.804
  172    HA   CYS  24           HA       CYS  24  16.307   8.265   9.984
  173    HB2  CYS  24           HB2      CYS  24  17.208   7.185  12.662
  174    HB3  CYS  24           HB3      CYS  24  17.050   8.866  12.165
  175    H    GLY  25           H        GLY  25  18.310   5.409  10.743
  176    HA2  GLY  25           HA2      GLY  25  20.355   4.804   9.887
  177    HA3  GLY  25           HA3      GLY  25  20.448   6.329   9.010
  178    H    ILE  26           H        ILE  26  20.030   7.579  11.905
  179    HA   ILE  26           HA       ILE  26  22.839   8.017  12.501
  180    HB   ILE  26           HB       ILE  26  21.088   9.743  12.622
  181   HG12  ILE  26          HG12      ILE  26  22.415   9.366  15.334
  182   HG13  ILE  26          HG13      ILE  26  23.249   9.928  13.873
  183   HG21  ILE  26          HG21      ILE  26  19.478   9.863  14.423
  184   HG22  ILE  26          HG22      ILE  26  19.260   8.337  13.582
  185   HG23  ILE  26          HG23      ILE  26  20.086   8.357  15.133
  186   HD11  ILE  26          HD11      ILE  26  22.665  11.834  15.232
  187   HD12  ILE  26          HD12      ILE  26  21.666  11.872  13.758
  188   HD13  ILE  26          HD13      ILE  26  20.966  11.342  15.315
  189    H    LEU  27           H        LEU  27  23.863   7.667  14.571
  190    HA   LEU  27           HA       LEU  27  22.819   5.381  16.188
  191    HB2  LEU  27           HB2      LEU  27  25.663   5.955  15.265
  192    HB3  LEU  27           HB3      LEU  27  25.303   5.003  16.697
  193    HG   LEU  27           HG       LEU  27  23.940   3.440  15.263
  194   HD11  LEU  27          HD11      LEU  27  23.625   4.715  13.203
  195   HD12  LEU  27          HD12      LEU  27  24.620   3.308  12.847
  196   HD13  LEU  27          HD13      LEU  27  25.384   4.908  13.010
  197   HD21  LEU  27          HD21      LEU  27  26.166   2.889  16.098
  198   HD22  LEU  27          HD22      LEU  27  26.917   3.715  14.719
  199   HD23  LEU  27          HD23      LEU  27  25.956   2.246  14.469
  200    H    LEU  28           H        LEU  28  22.815   5.638  18.348
  201    HA   LEU  28           HA       LEU  28  24.059   8.060  19.598
  202    HB2  LEU  28           HB2      LEU  28  21.273   6.934  20.116
  203    HB3  LEU  28           HB3      LEU  28  22.056   8.129  21.111
  204    HG   LEU  28           HG       LEU  28  20.494   9.297  19.917
  205   HD11  LEU  28          HD11      LEU  28  21.682  10.933  18.636
  206   HD12  LEU  28          HD12      LEU  28  23.005   9.807  18.292
  207   HD13  LEU  28          HD13      LEU  28  22.742  10.382  19.950
  208   HD21  LEU  28          HD21      LEU  28  20.081   9.297  17.566
  209   HD22  LEU  28          HD22      LEU  28  19.999   7.628  18.153
  210   HD23  LEU  28          HD23      LEU  28  21.423   8.190  17.255
  211    HA   PRO  29           HA       PRO  29  25.522   5.015  22.481
  212    HB2  PRO  29           HB2      PRO  29  26.133   6.489  24.711
  213    HB3  PRO  29           HB3      PRO  29  27.051   6.562  23.179
  214    HG2  PRO  29           HG2      PRO  29  24.896   8.457  24.141
  215    HG3  PRO  29           HG3      PRO  29  26.483   8.854  23.416
  216    HD2  PRO  29           HD2      PRO  29  24.159   8.823  21.964
  217    HD3  PRO  29           HD3      PRO  29  25.726   8.344  21.255
  218    H    LEU  30           H        LEU  30  23.584   7.176  24.618
  219    HA   LEU  30           HA       LEU  30  21.518   5.215  25.081
  220    HB2  LEU  30           HB2      LEU  30  23.919   5.059  26.728
  221    HB3  LEU  30           HB3      LEU  30  22.550   5.477  27.740
  222    HG   LEU  30           HG       LEU  30  22.427   3.132  25.805
  223   HD11  LEU  30          HD11      LEU  30  24.304   2.766  27.341
  224   HD12  LEU  30          HD12      LEU  30  22.952   1.694  27.727
  225   HD13  LEU  30          HD13      LEU  30  23.257   3.127  28.733
  226   HD21  LEU  30          HD21      LEU  30  20.859   3.796  28.334
  227   HD22  LEU  30          HD22      LEU  30  20.635   2.374  27.291
  228   HD23  LEU  30          HD23      LEU  30  20.256   3.991  26.671
  229    HA   PRO  31           HA       PRO  31  20.368   8.909  27.749
  230    HB2  PRO  31           HB2      PRO  31  21.997  11.061  28.234
  231    HB3  PRO  31           HB3      PRO  31  21.994   9.561  29.208
  232    HG2  PRO  31           HG2      PRO  31  23.882  10.326  26.973
  233    HG3  PRO  31           HG3      PRO  31  24.280   9.636  28.575
  234    HD2  PRO  31           HD2      PRO  31  24.115   8.083  26.344
  235    HD3  PRO  31           HD3      PRO  31  23.590   7.493  27.943
  236    H    ILE  32           H        ILE  32  22.419   9.963  24.986
  237    HA   ILE  32           HA       ILE  32  20.606  12.104  24.204
  238    HB   ILE  32           HB       ILE  32  22.702  10.691  22.506
  239   HG12  ILE  32          HG12      ILE  32  23.740  13.182  23.104
  240   HG13  ILE  32          HG13      ILE  32  22.885  12.846  24.598
  241   HG21  ILE  32          HG21      ILE  32  21.292  13.375  22.148
  242   HG22  ILE  32          HG22      ILE  32  22.643  12.779  21.158
  243   HG23  ILE  32          HG23      ILE  32  21.100  11.942  21.113
  244   HD11  ILE  32          HD11      ILE  32  25.207  12.116  24.752
  245   HD12  ILE  32          HD12      ILE  32  24.183  10.669  24.748
  246   HD13  ILE  32          HD13      ILE  32  25.049  11.147  23.273
  247    H    LEU  33           H        LEU  33  20.613   8.632  23.700
  248    HA   LEU  33           HA       LEU  33  18.861   8.468  21.469
  249    HB2  LEU  33           HB2      LEU  33  20.195   6.572  22.539
  250    HB3  LEU  33           HB3      LEU  33  18.989   6.565  23.826
  251    HG   LEU  33           HG       LEU  33  17.217   6.061  22.067
  252   HD11  LEU  33          HD11      LEU  33  17.921   5.124  19.945
  253   HD12  LEU  33          HD12      LEU  33  19.631   5.368  20.343
  254   HD13  LEU  33          HD13      LEU  33  18.569   6.763  20.053
  255   HD21  LEU  33          HD21      LEU  33  18.061   4.341  23.539
  256   HD22  LEU  33          HD22      LEU  33  19.487   4.099  22.513
  257   HD23  LEU  33          HD23      LEU  33  17.863   3.674  21.911
  258    H    ASN  34           H        ASN  34  18.104   9.363  24.831
  259    HA   ASN  34           HA       ASN  34  15.338   8.797  24.865
  260    HB2  ASN  34           HB2      ASN  34  17.003  10.999  26.145
  261    HB3  ASN  34           HB3      ASN  34  15.265  10.915  26.371
  262   HD21  ASN  34          HD21      ASN  34  14.328   9.209  27.596
  263   HD22  ASN  34          HD22      ASN  34  15.341   8.173  28.592
  264    H    GLN  35           H        GLN  35  16.935  11.701  23.454
  265    HA   GLN  35           HA       GLN  35  14.503  12.992  22.622
  266    HB2  GLN  35           HB2      GLN  35  16.704  14.120  22.835
  267    HB3  GLN  35           HB3      GLN  35  17.305  13.204  21.444
  268    HG2  GLN  35           HG2      GLN  35  15.561  14.259  20.005
  269    HG3  GLN  35           HG3      GLN  35  14.934  15.135  21.404
  270   HE21  GLN  35          HE21      GLN  35  17.476  15.031  18.955
  271   HE22  GLN  35          HE22      GLN  35  18.218  16.552  19.435
  272    H    HIS  36           H        HIS  36  16.652  10.623  21.014
  273    HA   HIS  36           HA       HIS  36  15.275  10.643  18.487
  274    HB2  HIS  36           HB2      HIS  36  17.633   9.737  19.071
  275    HB3  HIS  36           HB3      HIS  36  16.807   8.274  19.621
  276    HD1  HIS  36           HD1      HIS  36  17.784  10.155  16.499
  277    HD2  HIS  36           HD2      HIS  36  15.287   6.971  17.621
  278    HE1  HIS  36           HE1      HIS  36  17.037   9.071  14.348
  279    H    GLN  37           H        GLN  37  14.961   8.595  21.400
  280    HA   GLN  37           HA       GLN  37  13.067   6.763  20.374
  281    HB2  GLN  37           HB2      GLN  37  14.527   6.869  22.660
  282    HB3  GLN  37           HB3      GLN  37  13.027   7.520  23.293
  283    HG2  GLN  37           HG2      GLN  37  12.640   5.303  23.675
  284    HG3  GLN  37           HG3      GLN  37  11.999   5.355  22.033
  285   HE21  GLN  37          HE21      GLN  37  14.328   5.228  20.423
  286   HE22  GLN  37          HE22      GLN  37  15.227   3.783  20.845
  287    H    GLU  38           H        GLU  38  12.494   9.796  22.290
  288    HA   GLU  38           HA       GLU  38   9.636   9.562  22.042
  289    HB2  GLU  38           HB2      GLU  38   9.441  11.752  22.891
  290    HB3  GLU  38           HB3      GLU  38  10.693  10.904  23.793
  291    HG2  GLU  38           HG2      GLU  38  12.425  12.126  22.487
  292    HG3  GLU  38           HG3      GLU  38  11.159  12.977  21.600
  293    H    LYS  39           H        LYS  39  12.043  11.135  19.871
  294    HA   LYS  39           HA       LYS  39  10.087  12.369  18.189
  295    HB2  LYS  39           HB2      LYS  39  12.366  13.119  18.088
  296    HB3  LYS  39           HB3      LYS  39  12.957  11.503  17.709
  297    HG2  LYS  39           HG2      LYS  39  13.033  12.895  15.729
  298    HG3  LYS  39           HG3      LYS  39  11.912  11.566  15.505
  299    HD2  LYS  39           HD2      LYS  39  10.084  13.373  16.250
  300    HD3  LYS  39           HD3      LYS  39  11.334  14.527  15.798
  301    HE2  LYS  39           HE2      LYS  39  10.153  12.311  14.058
  302    HE3  LYS  39           HE3      LYS  39   9.710  14.017  13.972
  303    HZ1  LYS  39           HZ1      LYS  39  12.407  12.929  13.346
  304    HZ2  LYS  39           HZ2      LYS  39  12.000  14.512  13.288
  305    HZ3  LYS  39           HZ3      LYS  39  11.317  13.453  12.252
  306    H    CYS  40           H        CYS  40  11.790   9.216  17.664
  307    HA   CYS  40           HA       CYS  40  10.307   8.491  15.353
  308    HB2  CYS  40           HB2      CYS  40  11.816   6.910  17.457
  309    HB3  CYS  40           HB3      CYS  40  10.980   6.115  16.125
  310    H    ARG  41           H        ARG  41   9.609   7.853  18.823
  311    HA   ARG  41           HA       ARG  41   7.186   6.386  18.415
  312    HB2  ARG  41           HB2      ARG  41   8.588   6.516  20.487
  313    HB3  ARG  41           HB3      ARG  41   7.932   8.116  20.817
  314    HG2  ARG  41           HG2      ARG  41   6.224   5.598  20.519
  315    HG3  ARG  41           HG3      ARG  41   6.975   6.086  22.037
  316    HD2  ARG  41           HD2      ARG  41   5.741   8.267  21.917
  317    HD3  ARG  41           HD3      ARG  41   4.844   7.628  20.522
  318    HE   ARG  41           HE       ARG  41   4.647   5.707  22.574
  319   HH11  ARG  41          HH11      ARG  41   3.528   8.990  22.102
  320   HH12  ARG  41          HH12      ARG  41   2.131   8.758  23.119
  321   HH21  ARG  41          HH21      ARG  41   2.875   5.487  23.889
  322   HH22  ARG  41          HH22      ARG  41   1.785   6.823  24.112
  323    H    TRP  42           H        TRP  42   7.648   9.924  18.921
  324    HA   TRP  42           HA       TRP  42   4.932  10.646  18.999
  325    HB2  TRP  42           HB2      TRP  42   6.892  12.085  19.564
  326    HB3  TRP  42           HB3      TRP  42   7.224  12.283  17.850
  327    HD1  TRP  42           HD1      TRP  42   5.192  13.553  20.701
  328    HE1  TRP  42           HE1      TRP  42   3.737  15.551  20.007
  329    HE3  TRP  42           HE3      TRP  42   5.806  13.293  15.607
  330    HZ2  TRP  42           HZ2      TRP  42   2.914  16.846  17.572
  331    HZ3  TRP  42           HZ3      TRP  42   4.658  14.928  14.128
  332    HH2  TRP  42           HH2      TRP  42   3.212  16.700  15.094
  333    H    LEU  43           H        LEU  43   7.039  10.435  16.062
  334    HA   LEU  43           HA       LEU  43   4.840  11.084  14.280
  335    HB2  LEU  43           HB2      LEU  43   7.592   9.879  13.898
  336    HB3  LEU  43           HB3      LEU  43   6.424   9.821  12.588
  337    HG   LEU  43           HG       LEU  43   7.410  12.381  13.902
  338   HD11  LEU  43          HD11      LEU  43   8.568  12.731  11.761
  339   HD12  LEU  43          HD12      LEU  43   7.942  11.188  11.144
  340   HD13  LEU  43          HD13      LEU  43   9.095  11.197  12.491
  341   HD21  LEU  43          HD21      LEU  43   5.139  12.748  13.023
  342   HD22  LEU  43          HD22      LEU  43   5.564  11.924  11.506
  343   HD23  LEU  43          HD23      LEU  43   6.305  13.485  11.930
  344    H    ALA  44           H        ALA  44   6.161   7.915  15.388
  345    HA   ALA  44           HA       ALA  44   4.479   6.333  13.750
  346    HB1  ALA  44           HB1      ALA  44   5.657   5.710  16.493
  347    HB2  ALA  44           HB2      ALA  44   5.040   4.523  15.324
  348    HB3  ALA  44           HB3      ALA  44   6.469   5.493  14.924
  349    H    SER  45           H        SER  45   3.821   7.595  17.078
  350    HA   SER  45           HA       SER  45   1.203   6.344  17.218
  351    HB2  SER  45           HB2      SER  45   0.886   7.603  19.240
  352    HB3  SER  45           HB3      SER  45   2.503   6.882  19.235
  353    HG   SER  45           HG       SER  45   2.266   9.191  19.889
  354    H    SER  46           H        SER  46   2.328   9.618  16.261
  355    HA   SER  46           HA       SER  46  -0.295  10.727  15.870
  356    HB2  SER  46           HB2      SER  46   2.322  11.465  14.501
  357    HB3  SER  46           HB3      SER  46   0.821  12.410  14.457
  358    HG   SER  46           HG       SER  46   2.527  11.853  16.631
  359    H    LYS  47           H        LYS  47   1.775   8.786  13.708
  360    HA   LYS  47           HA       LYS  47   0.160   8.994  11.348
  361    HB2  LYS  47           HB2      LYS  47   2.569   7.899  11.809
  362    HB3  LYS  47           HB3      LYS  47   1.636   6.447  12.089
  363    HG2  LYS  47           HG2      LYS  47   2.212   6.312   9.822
  364    HG3  LYS  47           HG3      LYS  47   0.550   6.890   9.778
  365    HD2  LYS  47           HD2      LYS  47   1.820   8.146   8.168
  366    HD3  LYS  47           HD3      LYS  47   1.454   9.248   9.496
  367    HE2  LYS  47           HE2      LYS  47   3.745   8.847  10.432
  368    HE3  LYS  47           HE3      LYS  47   4.084   7.748   9.096
  369    HZ1  LYS  47           HZ1      LYS  47   4.967   9.954   8.648
  370    HZ2  LYS  47           HZ2      LYS  47   3.497  10.650   8.823
  371    HZ3  LYS  47           HZ3      LYS  47   3.783   9.636   7.570
  372    H    GLY  48           H        GLY  48   0.104   6.663  14.015
  373    HA2  GLY  48           HA2      GLY  48  -1.496   5.278  14.897
  374    HA3  GLY  48           HA3      GLY  48  -2.721   6.164  13.989
  375    H    LYS  49           H        LYS  49  -2.650   5.675  11.554
  376    HA   LYS  49           HA       LYS  49  -2.785   2.778  11.011
  377    HB2  LYS  49           HB2      LYS  49  -4.460   4.597  10.273
  378    HB3  LYS  49           HB3      LYS  49  -3.287   5.067   9.058
  379    HG2  LYS  49           HG2      LYS  49  -4.596   2.320   9.380
  380    HG3  LYS  49           HG3      LYS  49  -5.069   3.568   8.226
  381    HD2  LYS  49           HD2      LYS  49  -2.809   3.375   7.137
  382    HD3  LYS  49           HD3      LYS  49  -2.456   2.005   8.226
  383    HE2  LYS  49           HE2      LYS  49  -4.455   0.811   7.366
  384    HE3  LYS  49           HE3      LYS  49  -4.781   2.156   6.260
  385    HZ1  LYS  49           HZ1      LYS  49  -3.553   0.367   5.160
  386    HZ2  LYS  49           HZ2      LYS  49  -2.321   0.486   6.225
  387    HZ3  LYS  49           HZ3      LYS  49  -2.638   1.716   5.192
  388    H    GLN  50           H        GLN  50  -0.499   2.466  11.486
  389    HA   GLN  50           HA       GLN  50   1.645   3.473   9.881
  390    HB2  GLN  50           HB2      GLN  50   1.305   0.810  11.324
  391    HB3  GLN  50           HB3      GLN  50   2.800   1.333  10.536
  392    HG2  GLN  50           HG2      GLN  50   2.884   3.339  12.016
  393    HG3  GLN  50           HG3      GLN  50   1.421   2.786  12.832
  394   HE21  GLN  50          HE21      GLN  50   2.704   2.785  14.852
  395   HE22  GLN  50          HE22      GLN  50   3.787   1.430  15.159
  396    H    VAL  51           H        VAL  51   2.622   2.762   8.001
  397    HA   VAL  51           HA       VAL  51   0.883   1.566   6.031
  398    HB   VAL  51           HB       VAL  51   2.786   1.816   4.477
  399   HG11  VAL  51          HG11      VAL  51   2.280   4.292   6.177
  400   HG12  VAL  51          HG12      VAL  51   2.819   4.244   4.486
  401   HG13  VAL  51          HG13      VAL  51   1.199   3.668   4.913
  402   HG21  VAL  51          HG21      VAL  51   4.331   2.968   6.844
  403   HG22  VAL  51          HG22      VAL  51   4.695   1.432   6.027
  404   HG23  VAL  51          HG23      VAL  51   4.833   2.957   5.145
  405    H    ARG  52           H        ARG  52   3.177   0.108   8.156
  406    HA   ARG  52           HA       ARG  52   4.228  -1.946   8.250
  407    HB2  ARG  52           HB2      ARG  52   1.470  -2.829   7.311
  408    HB3  ARG  52           HB3      ARG  52   2.658  -3.835   8.150
  409    HG2  ARG  52           HG2      ARG  52   2.552  -2.307  10.124
  410    HG3  ARG  52           HG3      ARG  52   1.271  -1.383   9.308
  411    HD2  ARG  52           HD2      ARG  52  -0.110  -3.441   9.161
  412    HD3  ARG  52           HD3      ARG  52   1.158  -4.341  10.020
  413    HE   ARG  52           HE       ARG  52   0.458  -2.091  11.606
  414   HH11  ARG  52          HH11      ARG  52  -1.037  -5.095  10.597
  415   HH12  ARG  52          HH12      ARG  52  -2.073  -5.158  11.996
  416   HH21  ARG  52          HH21      ARG  52  -0.899  -2.230  13.368
  417   HH22  ARG  52          HH22      ARG  52  -1.992  -3.575  13.518
  418    H    ASN  53           H        ASN  53   4.797  -0.673   5.813
  419    HA   ASN  53           HA       ASN  53   5.332  -0.844   3.636
  420    HB2  ASN  53           HB2      ASN  53   7.166  -1.957   5.094
  421    HB3  ASN  53           HB3      ASN  53   6.697  -3.457   4.320
  422   HD21  ASN  53          HD21      ASN  53   9.073  -1.338   4.172
  423   HD22  ASN  53          HD22      ASN  53   9.302  -1.201   2.434
  424    H    PHE  54           H        PHE  54   2.864  -1.243   3.405
  425    HA   PHE  54           HA       PHE  54   1.858  -3.720   2.559
  426    HB2  PHE  54           HB2      PHE  54  -0.080  -2.521   1.823
  427    HB3  PHE  54           HB3      PHE  54   0.488  -1.859   3.333
  428    HD1  PHE  54           HD2      PHE  54   0.412  -1.255  -0.377
  429    HD2  PHE  54           HD1      PHE  54   0.872   0.502   3.534
  430    HE1  PHE  54           HE2      PHE  54   0.340   1.009  -1.377
  431    HE2  PHE  54           HE1      PHE  54   0.807   2.764   2.526
  432    HZ   PHE  54           HZ       PHE  54   0.543   3.027   0.067
  433    H    SER  55           H        SER  55   4.013  -1.861   0.738
  434    HA   SER  55           HA       SER  55   4.639  -1.660  -1.447
  435    HB2  SER  55           HB2      SER  55   4.009  -4.627  -1.462
  436    HB3  SER  55           HB3      SER  55   5.061  -3.773  -2.603
  437    HG   SER  55           HG       SER  55   6.342  -3.124  -0.719
  Start of MODEL    8
    1    H1   GLY   1           H1       GLY   1  36.015  20.478  11.588
    2    H2   GLY   1           H2       GLY   1  36.895  20.637  10.217
    3    H3   GLY   1           H3       GLY   1  35.527  19.739  10.211
    4    HA2  GLY   1           HA2      GLY   1  35.804  22.652  10.333
    5    HA3  GLY   1           HA3      GLY   1  34.850  21.700   9.187
    6    H    SER   2           H        SER   2  32.764  22.350   9.569
    7    HA   SER   2           HA       SER   2  31.790  22.637  12.389
    8    HB2  SER   2           HB2      SER   2  31.042  24.257   9.932
    9    HB3  SER   2           HB3      SER   2  30.334  24.425  11.552
   10    HG   SER   2           HG       SER   2  33.036  24.898  10.788
   11    H    GLU   3           H        GLU   3  31.542  20.161  11.558
   12    HA   GLU   3           HA       GLU   3  29.064  19.501  10.216
   13    HB2  GLU   3           HB2      GLU   3  31.124  18.040  10.525
   14    HB3  GLU   3           HB3      GLU   3  30.638  17.825  12.211
   15    HG2  GLU   3           HG2      GLU   3  28.493  16.817  11.453
   16    HG3  GLU   3           HG3      GLU   3  28.955  17.103   9.771
   17    H    PHE   4           H        PHE   4  27.021  19.127  11.046
   18    HA   PHE   4           HA       PHE   4  26.539  19.223  13.971
   19    HB2  PHE   4           HB2      PHE   4  26.474  21.567  13.094
   20    HB3  PHE   4           HB3      PHE   4  25.146  21.111  12.041
   21    HD1  PHE   4           HD2      PHE   4  26.199  21.074  15.662
   22    HD2  PHE   4           HD1      PHE   4  22.922  21.370  12.872
   23    HE1  PHE   4           HE2      PHE   4  24.640  21.547  17.540
   24    HE2  PHE   4           HE1      PHE   4  21.368  21.850  14.752
   25    HZ   PHE   4           HZ       PHE   4  22.225  21.937  17.087
   26    H    THR   5           H        THR   5  26.346  16.946  13.317
   27    HA   THR   5           HA       THR   5  25.231  15.048  12.780
   28    HB   THR   5           HB       THR   5  22.676  16.528  13.476
   29    HG1  THR   5           HG1      THR   5  23.208  16.094  15.600
   30   HG21  THR   5          HG21      THR   5  22.217  14.200  12.883
   31   HG22  THR   5          HG22      THR   5  22.178  14.323  14.636
   32   HG23  THR   5          HG23      THR   5  23.603  13.632  13.834
   33    H    SER   6           H        SER   6  25.857  16.678  10.574
   34    HA   SER   6           HA       SER   6  23.831  17.119   8.708
   35    HB2  SER   6           HB2      SER   6  26.701  16.378   8.047
   36    HB3  SER   6           HB3      SER   6  25.604  17.418   7.122
   37    HG   SER   6           HG       SER   6  27.009  18.706   8.315
   38    H    SER   7           H        SER   7  25.506  14.114   9.384
   39    HA   SER   7           HA       SER   7  23.720  12.480   7.779
   40    HB2  SER   7           HB2      SER   7  25.262  13.284   6.028
   41    HB3  SER   7           HB3      SER   7  26.662  12.792   6.987
   42    HG   SER   7           HG       SER   7  26.155  11.260   5.387
   43    HA   PRO   8           HA       PRO   8  25.167   9.724  11.066
   44    HB2  PRO   8           HB2      PRO   8  24.388   7.257  10.160
   45    HB3  PRO   8           HB3      PRO   8  23.243   8.510  10.722
   46    HG2  PRO   8           HG2      PRO   8  24.072   7.913   7.866
   47    HG3  PRO   8           HG3      PRO   8  22.409   8.059   8.527
   48    HD2  PRO   8           HD2      PRO   8  23.612  10.147   7.303
   49    HD3  PRO   8           HD3      PRO   8  22.609  10.408   8.754
   50    H    ARG   9           H        ARG   9  26.505   7.673  11.381
   51    HA   ARG   9           HA       ARG   9  28.693   7.317   9.382
   52    HB2  ARG   9           HB2      ARG   9  29.253   9.148  11.019
   53    HB3  ARG   9           HB3      ARG   9  29.127   7.974  12.334
   54    HG2  ARG   9           HG2      ARG   9  31.005   6.679  11.375
   55    HG3  ARG   9           HG3      ARG   9  31.059   7.775   9.975
   56    HD2  ARG   9           HD2      ARG   9  31.541   9.670  11.525
   57    HD3  ARG   9           HD3      ARG   9  31.583   8.527  12.884
   58    HE   ARG   9           HE       ARG   9  33.393   7.485  11.053
   59   HH11  ARG   9          HH11      ARG   9  33.182  10.564  12.718
   60   HH12  ARG   9          HH12      ARG   9  34.900  10.836  12.618
   61   HH21  ARG   9          HH21      ARG   9  35.574   7.896  10.965
   62   HH22  ARG   9          HH22      ARG   9  36.211   9.360  11.656
   63    H    GLY  10           H        GLY  10  29.575   5.321   9.327
   64    HA2  GLY  10           HA2      GLY  10  28.785   3.216  11.292
   65    HA3  GLY  10           HA3      GLY  10  28.334   3.046   9.590
   66    H    ASP  11           H        ASP  11  31.310   4.357  10.981
   67    HA   ASP  11           HA       ASP  11  32.983   2.347   9.522
   68    HB2  ASP  11           HB2      ASP  11  33.234   5.384   9.577
   69    HB3  ASP  11           HB3      ASP  11  34.406   4.283   8.848
   70    H    LYS  12           H        LYS  12  32.427   2.002  12.177
   71    HA   LYS  12           HA       LYS  12  34.996   2.545  13.587
   72    HB2  LYS  12           HB2      LYS  12  33.312   4.391  13.998
   73    HB3  LYS  12           HB3      LYS  12  32.247   3.199  14.751
   74    HG2  LYS  12           HG2      LYS  12  33.807   2.843  16.565
   75    HG3  LYS  12           HG3      LYS  12  35.103   3.664  15.683
   76    HD2  LYS  12           HD2      LYS  12  34.328   5.166  17.395
   77    HD3  LYS  12           HD3      LYS  12  33.891   5.799  15.819
   78    HE2  LYS  12           HE2      LYS  12  32.033   6.220  17.171
   79    HE3  LYS  12           HE3      LYS  12  31.542   4.857  16.167
   80    HZ1  LYS  12           HZ1      LYS  12  31.022   4.679  18.618
   81    HZ2  LYS  12           HZ2      LYS  12  32.613   4.541  18.927
   82    HZ3  LYS  12           HZ3      LYS  12  31.822   3.394  18.047
   83    H    ALA  13           H        ALA  13  35.613   0.968  14.996
   84    HA   ALA  13           HA       ALA  13  34.443  -1.638  14.810
   85    HB1  ALA  13           HB1      ALA  13  36.501  -0.516  16.767
   86    HB2  ALA  13           HB2      ALA  13  36.191  -2.236  16.452
   87    HB3  ALA  13           HB3      ALA  13  36.849  -1.209  15.165
   88    H    ALA  14           H        ALA  14  34.258   0.824  17.375
   89    HA   ALA  14           HA       ALA  14  32.580  -0.825  19.123
   90    HB1  ALA  14           HB1      ALA  14  32.646   1.170  20.581
   91    HB2  ALA  14           HB2      ALA  14  34.266   0.649  20.086
   92    HB3  ALA  14           HB3      ALA  14  33.522   2.068  19.320
   93    H    TYR  15           H        TYR  15  31.070  -1.083  17.139
   94    HA   TYR  15           HA       TYR  15  29.000   1.070  17.092
   95    HB2  TYR  15           HB2      TYR  15  28.189   0.150  15.089
   96    HB3  TYR  15           HB3      TYR  15  29.923   0.295  14.932
   97    HD1  TYR  15           HD2      TYR  15  31.367  -1.775  14.897
   98    HD2  TYR  15           HD1      TYR  15  27.058  -1.996  15.017
   99    HE1  TYR  15           HE2      TYR  15  31.472  -4.160  14.204
  100    HE2  TYR  15           HE1      TYR  15  27.167  -4.382  14.289
  101    HH   TYR  15           HH       TYR  15  30.307  -6.023  13.667
  102    H    ASP  16           H        ASP  16  29.580  -1.825  18.731
  103    HA   ASP  16           HA       ASP  16  26.857  -2.823  18.877
  104    HB2  ASP  16           HB2      ASP  16  28.920  -4.205  19.084
  105    HB3  ASP  16           HB3      ASP  16  29.286  -3.406  20.614
  106    H    ILE  17           H        ILE  17  28.746  -0.558  20.857
  107    HA   ILE  17           HA       ILE  17  26.834  -0.443  23.052
  108    HB   ILE  17           HB       ILE  17  29.110   0.067  23.458
  109   HG12  ILE  17          HG12      ILE  17  27.210   1.267  24.704
  110   HG13  ILE  17          HG13      ILE  17  28.875   1.747  24.956
  111   HG21  ILE  17          HG21      ILE  17  29.909   0.967  21.344
  112   HG22  ILE  17          HG22      ILE  17  28.952   2.446  21.568
  113   HG23  ILE  17          HG23      ILE  17  30.287   2.068  22.667
  114   HD11  ILE  17          HD11      ILE  17  27.329   3.673  24.859
  115   HD12  ILE  17          HD12      ILE  17  28.603   3.767  23.637
  116   HD13  ILE  17          HD13      ILE  17  26.955   3.304  23.172
  117    H    LEU  18           H        LEU  18  27.351   1.427  20.083
  118    HA   LEU  18           HA       LEU  18  25.333   3.431  20.526
  119    HB2  LEU  18           HB2      LEU  18  26.490   2.259  17.955
  120    HB3  LEU  18           HB3      LEU  18  25.474   3.691  18.025
  121    HG   LEU  18           HG       LEU  18  28.197   3.494  19.379
  122   HD11  LEU  18          HD11      LEU  18  27.425   4.832  16.761
  123   HD12  LEU  18          HD12      LEU  18  28.397   3.353  16.921
  124   HD13  LEU  18          HD13      LEU  18  29.010   4.901  17.536
  125   HD21  LEU  18          HD21      LEU  18  26.767   5.203  20.396
  126   HD22  LEU  18          HD22      LEU  18  26.361   5.871  18.802
  127   HD23  LEU  18          HD23      LEU  18  28.019   5.977  19.435
  128    H    ARG  19           H        ARG  19  23.258   3.610  19.590
  129    HA   ARG  19           HA       ARG  19  21.934   1.040  18.779
  130    HB2  ARG  19           HB2      ARG  19  21.283   2.239  21.035
  131    HB3  ARG  19           HB3      ARG  19  20.479   3.399  19.984
  132    HG2  ARG  19           HG2      ARG  19  18.866   1.782  20.726
  133    HG3  ARG  19           HG3      ARG  19  19.130   1.486  19.005
  134    HD2  ARG  19           HD2      ARG  19  20.453  -0.479  19.472
  135    HD3  ARG  19           HD3      ARG  19  20.655  -0.009  21.170
  136    HE   ARG  19           HE       ARG  19  17.877  -0.493  20.333
  137   HH11  ARG  19          HH11      ARG  19  20.712  -2.011  21.721
  138   HH12  ARG  19          HH12      ARG  19  19.774  -3.220  22.557
  139   HH21  ARG  19          HH21      ARG  19  16.736  -2.059  21.438
  140   HH22  ARG  19          HH22      ARG  19  17.585  -3.244  22.387
  141    H    ARG  20           H        ARG  20  20.853   0.984  16.947
  142    HA   ARG  20           HA       ARG  20  20.929   3.335  15.087
  143    HB2  ARG  20           HB2      ARG  20  20.936   0.313  14.652
  144    HB3  ARG  20           HB3      ARG  20  20.761   1.475  13.338
  145    HG2  ARG  20           HG2      ARG  20  22.955   2.272  13.535
  146    HG3  ARG  20           HG3      ARG  20  23.136   1.709  15.202
  147    HD2  ARG  20           HD2      ARG  20  24.497   0.331  13.830
  148    HD3  ARG  20           HD3      ARG  20  23.137  -0.632  14.419
  149    HE   ARG  20           HE       ARG  20  22.740   0.581  11.765
  150   HH11  ARG  20          HH11      ARG  20  23.958  -2.275  13.389
  151   HH12  ARG  20          HH12      ARG  20  23.842  -3.258  11.956
  152   HH21  ARG  20          HH21      ARG  20  22.620  -0.729   9.968
  153   HH22  ARG  20          HH22      ARG  20  23.107  -2.396  10.074
  154    H    CYS  21           H        CYS  21  19.141   3.851  13.875
  155    HA   CYS  21           HA       CYS  21  16.506   2.818  14.847
  156    HB2  CYS  21           HB2      CYS  21  17.138   5.146  15.455
  157    HB3  CYS  21           HB3      CYS  21  17.259   5.539  13.737
  158    H    SER  22           H        SER  22  15.690   1.424  13.426
  159    HA   SER  22           HA       SER  22  16.501   1.097  10.729
  160    HB2  SER  22           HB2      SER  22  15.451  -0.591  12.337
  161    HB3  SER  22           HB3      SER  22  13.881   0.103  11.901
  162    HG   SER  22           HG       SER  22  14.414  -0.416   9.687
  163    H    GLN  23           H        GLN  23  14.566   3.571  11.839
  164    HA   GLN  23           HA       GLN  23  13.224   3.962   9.202
  165    HB2  GLN  23           HB2      GLN  23  11.891   3.422  11.460
  166    HB3  GLN  23           HB3      GLN  23  12.174   5.129  11.775
  167    HG2  GLN  23           HG2      GLN  23  10.040   4.993  10.769
  168    HG3  GLN  23           HG3      GLN  23  11.084   5.583   9.486
  169   HE21  GLN  23          HE21      GLN  23   8.908   3.038  10.457
  170   HE22  GLN  23          HE22      GLN  23   9.113   2.057   9.013
  171    H    CYS  24           H        CYS  24  15.658   5.190  11.177
  172    HA   CYS  24           HA       CYS  24  15.463   7.938   9.997
  173    HB2  CYS  24           HB2      CYS  24  16.496   7.278  12.767
  174    HB3  CYS  24           HB3      CYS  24  16.202   8.865  12.071
  175    H    GLY  25           H        GLY  25  17.607   5.263  10.905
  176    HA2  GLY  25           HA2      GLY  25  19.685   4.718  10.125
  177    HA3  GLY  25           HA3      GLY  25  19.711   6.179   9.142
  178    H    ILE  26           H        ILE  26  19.184   7.455  12.086
  179    HA   ILE  26           HA       ILE  26  21.888   8.312  12.550
  180    HB   ILE  26           HB       ILE  26  19.855   9.651  12.947
  181   HG12  ILE  26          HG12      ILE  26  21.442   9.449  15.523
  182   HG13  ILE  26          HG13      ILE  26  22.115  10.103  14.039
  183   HG21  ILE  26          HG21      ILE  26  18.386   7.939  13.950
  184   HG22  ILE  26          HG22      ILE  26  19.416   7.859  15.380
  185   HG23  ILE  26          HG23      ILE  26  18.518   9.338  15.007
  186   HD11  ILE  26          HD11      ILE  26  19.664  11.208  15.480
  187   HD12  ILE  26          HD12      ILE  26  21.297  11.884  15.493
  188   HD13  ILE  26          HD13      ILE  26  20.373  11.851  13.981
  189    H    LEU  27           H        LEU  27  23.117   8.096  14.554
  190    HA   LEU  27           HA       LEU  27  22.680   5.590  16.102
  191    HB2  LEU  27           HB2      LEU  27  25.316   6.603  14.946
  192    HB3  LEU  27           HB3      LEU  27  25.184   5.467  16.277
  193    HG   LEU  27           HG       LEU  27  23.733   4.027  14.684
  194   HD11  LEU  27          HD11      LEU  27  23.508   5.547  12.779
  195   HD12  LEU  27          HD12      LEU  27  24.506   4.184  12.292
  196   HD13  LEU  27          HD13      LEU  27  25.265   5.742  12.681
  197   HD21  LEU  27          HD21      LEU  27  25.783   2.928  13.805
  198   HD22  LEU  27          HD22      LEU  27  25.923   3.342  15.514
  199   HD23  LEU  27          HD23      LEU  27  26.733   4.349  14.288
  200    H    LEU  28           H        LEU  28  22.620   5.897  18.211
  201    HA   LEU  28           HA       LEU  28  23.840   8.333  19.459
  202    HB2  LEU  28           HB2      LEU  28  21.175   7.029  20.157
  203    HB3  LEU  28           HB3      LEU  28  21.933   8.328  21.039
  204    HG   LEU  28           HG       LEU  28  20.213   9.333  19.925
  205   HD11  LEU  28          HD11      LEU  28  21.137  10.958  18.462
  206   HD12  LEU  28          HD12      LEU  28  22.489   9.909  18.018
  207   HD13  LEU  28          HD13      LEU  28  22.379  10.554  19.664
  208   HD21  LEU  28          HD21      LEU  28  19.644   7.537  18.345
  209   HD22  LEU  28          HD22      LEU  28  20.960   8.052  17.287
  210   HD23  LEU  28          HD23      LEU  28  19.605   9.145  17.608
  211    HA   PRO  29           HA       PRO  29  25.677   5.320  22.174
  212    HB2  PRO  29           HB2      PRO  29  26.271   6.788  24.417
  213    HB3  PRO  29           HB3      PRO  29  27.123   6.947  22.854
  214    HG2  PRO  29           HG2      PRO  29  24.891   8.683  23.934
  215    HG3  PRO  29           HG3      PRO  29  26.419   9.192  23.158
  216    HD2  PRO  29           HD2      PRO  29  24.066   9.051  21.782
  217    HD3  PRO  29           HD3      PRO  29  25.628   8.643  21.018
  218    H    LEU  30           H        LEU  30  23.571   7.304  24.293
  219    HA   LEU  30           HA       LEU  30  21.717   5.223  24.932
  220    HB2  LEU  30           HB2      LEU  30  23.423   4.113  26.131
  221    HB3  LEU  30           HB3      LEU  30  24.056   5.588  26.819
  222    HG   LEU  30           HG       LEU  30  22.030   5.764  28.273
  223   HD11  LEU  30          HD11      LEU  30  21.318   3.041  27.095
  224   HD12  LEU  30          HD12      LEU  30  20.384   4.538  26.886
  225   HD13  LEU  30          HD13      LEU  30  20.530   3.811  28.489
  226   HD21  LEU  30          HD21      LEU  30  24.078   4.625  29.046
  227   HD22  LEU  30          HD22      LEU  30  23.462   3.083  28.413
  228   HD23  LEU  30          HD23      LEU  30  22.623   3.903  29.750
  229    HA   PRO  31           HA       PRO  31  20.581   8.857  27.702
  230    HB2  PRO  31           HB2      PRO  31  22.152  11.099  28.029
  231    HB3  PRO  31           HB3      PRO  31  22.230   9.636  29.053
  232    HG2  PRO  31           HG2      PRO  31  24.009  10.375  26.725
  233    HG3  PRO  31           HG3      PRO  31  24.482   9.733  28.325
  234    HD2  PRO  31           HD2      PRO  31  24.281   8.114  26.157
  235    HD3  PRO  31           HD3      PRO  31  23.787   7.568  27.784
  236    H    ILE  32           H        ILE  32  22.459  10.104  24.878
  237    HA   ILE  32           HA       ILE  32  20.464  12.074  24.163
  238    HB   ILE  32           HB       ILE  32  22.605  10.832  22.391
  239   HG12  ILE  32          HG12      ILE  32  23.432  13.416  22.974
  240   HG13  ILE  32          HG13      ILE  32  22.668  12.980  24.491
  241   HG21  ILE  32          HG21      ILE  32  22.343  12.902  21.043
  242   HG22  ILE  32          HG22      ILE  32  20.869  11.947  21.043
  243   HG23  ILE  32          HG23      ILE  32  20.976  13.392  22.069
  244   HD11  ILE  32          HD11      ILE  32  25.047  12.465  24.557
  245   HD12  ILE  32          HD12      ILE  32  24.162  10.929  24.552
  246   HD13  ILE  32          HD13      ILE  32  24.932  11.513  23.063
  247    H    LEU  33           H        LEU  33  20.689   8.607  23.553
  248    HA   LEU  33           HA       LEU  33  18.808   8.427  21.416
  249    HB2  LEU  33           HB2      LEU  33  20.237   6.521  22.273
  250    HB3  LEU  33           HB3      LEU  33  19.201   6.460  23.699
  251    HG   LEU  33           HG       LEU  33  17.239   5.958  22.201
  252   HD11  LEU  33          HD11      LEU  33  17.663   5.117  19.931
  253   HD12  LEU  33          HD12      LEU  33  19.361   5.582  20.061
  254   HD13  LEU  33          HD13      LEU  33  18.097   6.837  20.053
  255   HD21  LEU  33          HD21      LEU  33  17.880   3.618  21.800
  256   HD22  LEU  33          HD22      LEU  33  18.379   4.193  23.394
  257   HD23  LEU  33          HD23      LEU  33  19.582   4.036  22.113
  258    H    ASN  34           H        ASN  34  18.269   9.025  24.889
  259    HA   ASN  34           HA       ASN  34  15.528   8.361  25.000
  260    HB2  ASN  34           HB2      ASN  34  17.088   8.945  26.916
  261    HB3  ASN  34           HB3      ASN  34  16.930  10.641  26.458
  262   HD21  ASN  34          HD21      ASN  34  15.954  11.232  28.459
  263   HD22  ASN  34          HD22      ASN  34  14.332  10.695  28.870
  264    H    GLN  35           H        GLN  35  17.051  11.385  23.821
  265    HA   GLN  35           HA       GLN  35  14.556  12.785  23.352
  266    HB2  GLN  35           HB2      GLN  35  16.729  13.932  23.657
  267    HB3  GLN  35           HB3      GLN  35  17.312  13.241  22.133
  268    HG2  GLN  35           HG2      GLN  35  15.492  14.432  20.907
  269    HG3  GLN  35           HG3      GLN  35  14.886  15.079  22.435
  270   HE21  GLN  35          HE21      GLN  35  17.779  15.074  20.269
  271   HE22  GLN  35          HE22      GLN  35  18.303  16.678  20.762
  272    H    HIS  36           H        HIS  36  16.732  10.826  21.192
  273    HA   HIS  36           HA       HIS  36  15.063  11.198  18.871
  274    HB2  HIS  36           HB2      HIS  36  17.405  10.304  18.769
  275    HB3  HIS  36           HB3      HIS  36  16.817   8.777  19.438
  276    HD1  HIS  36           HD1      HIS  36  16.472  10.979  16.295
  277    HD2  HIS  36           HD2      HIS  36  15.412   7.171  17.720
  278    HE1  HIS  36           HE1      HIS  36  15.501   9.745  14.314
  279    H    GLN  37           H        GLN  37  15.085   8.663  21.406
  280    HA   GLN  37           HA       GLN  37  13.160   6.966  20.331
  281    HB2  GLN  37           HB2      GLN  37  14.673   6.522  22.273
  282    HB3  GLN  37           HB3      GLN  37  13.680   7.577  23.271
  283    HG2  GLN  37           HG2      GLN  37  13.162   5.231  23.680
  284    HG3  GLN  37           HG3      GLN  37  11.757   6.057  23.008
  285   HE21  GLN  37          HE21      GLN  37  14.682   4.504  21.450
  286   HE22  GLN  37          HE22      GLN  37  13.702   3.460  20.429
  287    H    GLU  38           H        GLU  38  12.494   9.686  22.690
  288    HA   GLU  38           HA       GLU  38   9.667   9.269  22.549
  289    HB2  GLU  38           HB2      GLU  38   9.375  11.366  23.637
  290    HB3  GLU  38           HB3      GLU  38  10.704  10.484  24.382
  291    HG2  GLU  38           HG2      GLU  38  12.334  11.939  23.219
  292    HG3  GLU  38           HG3      GLU  38  11.017  12.798  22.420
  293    H    LYS  39           H        LYS  39  11.753  11.328  20.498
  294    HA   LYS  39           HA       LYS  39   9.528  12.613  19.156
  295    HB2  LYS  39           HB2      LYS  39  11.926  13.427  19.519
  296    HB3  LYS  39           HB3      LYS  39  12.414  12.405  18.180
  297    HG2  LYS  39           HG2      LYS  39  10.239  14.553  18.008
  298    HG3  LYS  39           HG3      LYS  39  11.940  14.911  17.783
  299    HD2  LYS  39           HD2      LYS  39  10.288  13.097  15.978
  300    HD3  LYS  39           HD3      LYS  39  10.786  14.756  15.662
  301    HE2  LYS  39           HE2      LYS  39  13.203  13.994  15.926
  302    HE3  LYS  39           HE3      LYS  39  12.604  12.328  15.946
  303    HZ1  LYS  39           HZ1      LYS  39  11.654  12.728  13.730
  304    HZ2  LYS  39           HZ2      LYS  39  13.260  13.019  13.707
  305    HZ3  LYS  39           HZ3      LYS  39  12.214  14.266  13.726
  306    H    CYS  40           H        CYS  40  11.701   9.963  18.224
  307    HA   CYS  40           HA       CYS  40  10.611   9.343  15.678
  308    HB2  CYS  40           HB2      CYS  40  12.840   8.767  16.793
  309    HB3  CYS  40           HB3      CYS  40  11.997   7.488  17.664
  310    H    ARG  41           H        ARG  41   9.891   7.983  18.956
  311    HA   ARG  41           HA       ARG  41   7.721   6.257  18.240
  312    HB2  ARG  41           HB2      ARG  41   8.373   7.824  20.766
  313    HB3  ARG  41           HB3      ARG  41   6.943   6.827  20.660
  314    HG2  ARG  41           HG2      ARG  41   9.648   5.627  19.999
  315    HG3  ARG  41           HG3      ARG  41   9.154   5.834  21.680
  316    HD2  ARG  41           HD2      ARG  41   7.534   4.316  19.602
  317    HD3  ARG  41           HD3      ARG  41   8.670   3.567  20.737
  318    HE   ARG  41           HE       ARG  41   7.001   5.036  22.377
  319   HH11  ARG  41          HH11      ARG  41   6.420   2.436  20.106
  320   HH12  ARG  41          HH12      ARG  41   4.982   1.909  20.939
  321   HH21  ARG  41          HH21      ARG  41   5.165   4.326  23.385
  322   HH22  ARG  41          HH22      ARG  41   4.301   2.953  22.758
  323    H    TRP  42           H        TRP  42   7.557   9.707  19.300
  324    HA   TRP  42           HA       TRP  42   4.736   9.880  19.066
  325    HB2  TRP  42           HB2      TRP  42   6.322  11.456  20.250
  326    HB3  TRP  42           HB3      TRP  42   6.697  12.168  18.686
  327    HD1  TRP  42           HD1      TRP  42   4.181  12.092  21.460
  328    HE1  TRP  42           HE1      TRP  42   2.301  13.796  21.071
  329    HE3  TRP  42           HE3      TRP  42   5.266  13.412  16.620
  330    HZ2  TRP  42           HZ2      TRP  42   1.365  15.484  18.932
  331    HZ3  TRP  42           HZ3      TRP  42   3.846  15.068  15.431
  332    HH2  TRP  42           HH2      TRP  42   1.897  16.107  16.571
  333    H    LEU  43           H        LEU  43   7.254  10.711  16.633
  334    HA   LEU  43           HA       LEU  43   5.432  11.568  14.625
  335    HB2  LEU  43           HB2      LEU  43   7.893  12.056  14.769
  336    HB3  LEU  43           HB3      LEU  43   8.230  10.381  14.341
  337    HG   LEU  43           HG       LEU  43   7.095  10.762  12.135
  338   HD11  LEU  43          HD11      LEU  43   6.692  13.134  11.432
  339   HD12  LEU  43          HD12      LEU  43   6.920  13.662  13.110
  340   HD13  LEU  43          HD13      LEU  43   5.561  12.607  12.672
  341   HD21  LEU  43          HD21      LEU  43   9.277  12.774  12.789
  342   HD22  LEU  43          HD22      LEU  43   8.865  12.169  11.174
  343   HD23  LEU  43          HD23      LEU  43   9.532  11.054  12.393
  344    H    ALA  44           H        ALA  44   6.924   8.318  15.163
  345    HA   ALA  44           HA       ALA  44   5.630   7.055  12.932
  346    HB1  ALA  44           HB1      ALA  44   6.374   4.975  14.022
  347    HB2  ALA  44           HB2      ALA  44   7.666   6.191  14.021
  348    HB3  ALA  44           HB3      ALA  44   6.745   5.869  15.511
  349    H    SER  45           H        SER  45   4.604   7.486  16.339
  350    HA   SER  45           HA       SER  45   2.188   5.921  16.163
  351    HB2  SER  45           HB2      SER  45   3.257   6.630  18.275
  352    HB3  SER  45           HB3      SER  45   2.844   8.317  17.930
  353    HG   SER  45           HG       SER  45   0.948   7.899  18.756
  354    H    SER  46           H        SER  46   2.850   9.393  15.607
  355    HA   SER  46           HA       SER  46   0.177  10.146  14.913
  356    HB2  SER  46           HB2      SER  46   1.980  11.659  15.710
  357    HB3  SER  46           HB3      SER  46   2.823  11.448  14.164
  358    HG   SER  46           HG       SER  46   1.430  13.341  14.298
  359    H    LYS  47           H        LYS  47   2.728   8.683  13.008
  360    HA   LYS  47           HA       LYS  47   3.034   8.146  10.822
  361    HB2  LYS  47           HB2      LYS  47  -0.009   8.036  10.740
  362    HB3  LYS  47           HB3      LYS  47   1.052   7.367   9.515
  363    HG2  LYS  47           HG2      LYS  47   1.042   6.415  12.405
  364    HG3  LYS  47           HG3      LYS  47   0.074   5.720  11.107
  365    HD2  LYS  47           HD2      LYS  47   2.163   5.198   9.824
  366    HD3  LYS  47           HD3      LYS  47   3.117   5.851  11.157
  367    HE2  LYS  47           HE2      LYS  47   3.127   3.501  11.454
  368    HE3  LYS  47           HE3      LYS  47   2.049   4.155  12.691
  369    HZ1  LYS  47           HZ1      LYS  47   1.091   2.204  11.581
  370    HZ2  LYS  47           HZ2      LYS  47   1.174   2.922  10.123
  371    HZ3  LYS  47           HZ3      LYS  47   0.162   3.508  11.267
  372    H    GLY  48           H        GLY  48   2.909  10.973  11.495
  373    HA2  GLY  48           HA2      GLY  48   1.383  12.463   9.598
  374    HA3  GLY  48           HA3      GLY  48   2.698  13.086  10.597
  375    H    LYS  49           H        LYS  49   4.917  11.797   9.658
  376    HA   LYS  49           HA       LYS  49   5.309  12.868   6.931
  377    HB2  LYS  49           HB2      LYS  49   6.987  12.796   9.052
  378    HB3  LYS  49           HB3      LYS  49   7.417  11.237   8.342
  379    HG2  LYS  49           HG2      LYS  49   7.742  12.550   6.122
  380    HG3  LYS  49           HG3      LYS  49   7.565  14.016   7.101
  381    HD2  LYS  49           HD2      LYS  49   9.469  13.079   8.564
  382    HD3  LYS  49           HD3      LYS  49   9.723  11.873   7.300
  383    HE2  LYS  49           HE2      LYS  49   9.935  14.909   7.038
  384    HE3  LYS  49           HE3      LYS  49  11.275  13.760   7.072
  385    HZ1  LYS  49           HZ1      LYS  49  10.419  12.829   4.966
  386    HZ2  LYS  49           HZ2      LYS  49  10.800  14.405   4.811
  387    HZ3  LYS  49           HZ3      LYS  49   9.238  13.965   4.921
  388    H    GLN  50           H        GLN  50   6.206  11.532   5.206
  389    HA   GLN  50           HA       GLN  50   5.456   8.628   5.308
  390    HB2  GLN  50           HB2      GLN  50   5.190  10.566   2.984
  391    HB3  GLN  50           HB3      GLN  50   5.061   8.802   2.867
  392    HG2  GLN  50           HG2      GLN  50   3.174   8.855   4.523
  393    HG3  GLN  50           HG3      GLN  50   3.264  10.617   4.529
  394   HE21  GLN  50          HE21      GLN  50   0.939  10.465   3.838
  395   HE22  GLN  50          HE22      GLN  50   0.616  10.211   2.127
  396    H    VAL  51           H        VAL  51   7.342   7.763   5.803
  397    HA   VAL  51           HA       VAL  51   9.912   8.527   4.719
  398    HB   VAL  51           HB       VAL  51  10.759   6.540   5.850
  399   HG11  VAL  51          HG11      VAL  51  10.228   7.175   8.114
  400   HG12  VAL  51          HG12      VAL  51  10.293   8.638   7.129
  401   HG13  VAL  51          HG13      VAL  51   8.723   7.958   7.621
  402   HG21  VAL  51          HG21      VAL  51   8.975   4.908   5.455
  403   HG22  VAL  51          HG22      VAL  51   9.261   5.086   7.185
  404   HG23  VAL  51          HG23      VAL  51   7.844   5.850   6.452
  405    H    ARG  52           H        ARG  52  11.347   7.111   3.510
  406    HA   ARG  52           HA       ARG  52   9.977   5.812   1.209
  407    HB2  ARG  52           HB2      ARG  52  11.600   7.700   0.844
  408    HB3  ARG  52           HB3      ARG  52  12.875   6.691   1.516
  409    HG2  ARG  52           HG2      ARG  52  13.091   6.512  -0.824
  410    HG3  ARG  52           HG3      ARG  52  12.352   4.988  -0.338
  411    HD2  ARG  52           HD2      ARG  52  10.113   5.884  -0.999
  412    HD3  ARG  52           HD3      ARG  52  10.862   7.400  -1.493
  413    HE   ARG  52           HE       ARG  52  10.794   4.881  -2.948
  414   HH11  ARG  52          HH11      ARG  52  12.690   7.823  -2.686
  415   HH12  ARG  52          HH12      ARG  52  13.368   7.623  -4.280
  416   HH21  ARG  52          HH21      ARG  52  11.685   4.709  -4.965
  417   HH22  ARG  52          HH22      ARG  52  12.804   5.915  -5.531
  418    H    ASN  53           H        ASN  53   9.427   3.838   2.037
  419    HA   ASN  53           HA       ASN  53  11.604   1.851   2.148
  420    HB2  ASN  53           HB2      ASN  53  11.216   2.605   4.517
  421    HB3  ASN  53           HB3      ASN  53   9.520   2.141   4.370
  422   HD21  ASN  53          HD21      ASN  53  12.841   0.757   3.969
  423   HD22  ASN  53          HD22      ASN  53  12.383  -0.820   4.595
  424    H    PHE  54           H        PHE  54  10.853  -0.338   1.794
  425    HA   PHE  54           HA       PHE  54   8.212  -0.518   0.396
  426    HB2  PHE  54           HB2      PHE  54   9.247  -2.035  -1.176
  427    HB3  PHE  54           HB3      PHE  54  10.069  -0.488  -1.181
  428    HD1  PHE  54           HD1      PHE  54  10.358  -4.079  -0.327
  429    HD2  PHE  54           HD2      PHE  54  12.398  -0.276  -0.380
  430    HE1  PHE  54           HE1      PHE  54  12.523  -5.232   0.058
  431    HE2  PHE  54           HE2      PHE  54  14.561  -1.436   0.009
  432    HZ   PHE  54           HZ       PHE  54  14.626  -3.913   0.230
  433    H    SER  55           H        SER  55   7.095  -2.458   0.478
  434    HA   SER  55           HA       SER  55   7.407  -3.944   3.021
  435    HB2  SER  55           HB2      SER  55   5.105  -3.881   1.033
  436    HB3  SER  55           HB3      SER  55   5.090  -4.632   2.640
  437    HG   SER  55           HG       SER  55   5.477  -2.540   3.547
  Start of MODEL    9
    1    H1   GLY   1           H1       GLY   1  15.438  26.371   7.732
    2    H2   GLY   1           H2       GLY   1  14.583  27.300   8.775
    3    H3   GLY   1           H3       GLY   1  13.953  25.885   8.240
    4    HA2  GLY   1           HA2      GLY   1  16.341  26.153   9.963
    5    HA3  GLY   1           HA3      GLY   1  14.732  25.652  10.504
    6    H    SER   2           H        SER   2  17.594  24.685   8.660
    7    HA   SER   2           HA       SER   2  16.648  22.001   8.008
    8    HB2  SER   2           HB2      SER   2  18.440  23.132   6.730
    9    HB3  SER   2           HB3      SER   2  19.471  23.116   8.175
   10    HG   SER   2           HG       SER   2  19.869  21.339   6.752
   11    H    GLU   3           H        GLU   3  17.048  20.094   9.081
   12    HA   GLU   3           HA       GLU   3  17.647  20.183  11.964
   13    HB2  GLU   3           HB2      GLU   3  17.051  17.862  10.080
   14    HB3  GLU   3           HB3      GLU   3  17.218  17.745  11.838
   15    HG2  GLU   3           HG2      GLU   3  15.313  19.325  12.121
   16    HG3  GLU   3           HG3      GLU   3  15.089  19.357  10.371
   17    H    PHE   4           H        PHE   4  19.468  19.653   9.063
   18    HA   PHE   4           HA       PHE   4  21.386  18.608   8.495
   19    HB2  PHE   4           HB2      PHE   4  22.266  19.939  11.073
   20    HB3  PHE   4           HB3      PHE   4  23.366  19.291   9.869
   21    HD1  PHE   4           HD2      PHE   4  23.084  20.116   7.398
   22    HD2  PHE   4           HD1      PHE   4  21.656  22.238  10.872
   23    HE1  PHE   4           HE2      PHE   4  23.111  22.240   6.111
   24    HE2  PHE   4           HE1      PHE   4  21.708  24.365   9.589
   25    HZ   PHE   4           HZ       PHE   4  22.430  24.369   7.206
   26    H    THR   5           H        THR   5  19.603  16.850  10.187
   27    HA   THR   5           HA       THR   5  21.194  15.085  11.762
   28    HB   THR   5           HB       THR   5  19.263  13.440  11.218
   29    HG1  THR   5           HG1      THR   5  18.479  14.504   9.381
   30   HG21  THR   5          HG21      THR   5  17.732  14.666  12.741
   31   HG22  THR   5          HG22      THR   5  18.747  16.119  12.573
   32   HG23  THR   5          HG23      THR   5  19.406  14.651  13.323
   33    H    SER   6           H        SER   6  22.794  13.877  11.171
   34    HA   SER   6           HA       SER   6  22.708  12.125   8.817
   35    HB2  SER   6           HB2      SER   6  24.915  12.894   7.999
   36    HB3  SER   6           HB3      SER   6  23.673  14.140   7.840
   37    HG   SER   6           HG       SER   6  24.498  15.186   9.646
   38    H    SER   7           H        SER   7  24.686  10.670   8.816
   39    HA   SER   7           HA       SER   7  25.697  10.100  11.554
   40    HB2  SER   7           HB2      SER   7  25.027   7.712  11.240
   41    HB3  SER   7           HB3      SER   7  23.671   8.838  11.353
   42    HG   SER   7           HG       SER   7  23.411   7.301   9.678
   43    HA   PRO   8           HA       PRO   8  29.485   9.154   9.566
   44    HB2  PRO   8           HB2      PRO   8  30.610   7.210  11.161
   45    HB3  PRO   8           HB3      PRO   8  30.422   8.921  11.645
   46    HG2  PRO   8           HG2      PRO   8  28.591   6.591  12.300
   47    HG3  PRO   8           HG3      PRO   8  29.251   7.834  13.419
   48    HD2  PRO   8           HD2      PRO   8  26.767   8.049  12.407
   49    HD3  PRO   8           HD3      PRO   8  27.803   9.493  12.592
   50    H    ARG   9           H        ARG   9  30.814   7.488   8.557
   51    HA   ARG   9           HA       ARG   9  29.434   5.027   7.611
   52    HB2  ARG   9           HB2      ARG   9  29.946   5.544   5.278
   53    HB3  ARG   9           HB3      ARG   9  28.877   6.759   5.968
   54    HG2  ARG   9           HG2      ARG   9  30.728   8.349   6.192
   55    HG3  ARG   9           HG3      ARG   9  31.897   7.123   5.670
   56    HD2  ARG   9           HD2      ARG   9  30.795   6.985   3.469
   57    HD3  ARG   9           HD3      ARG   9  29.614   8.199   3.958
   58    HE   ARG   9           HE       ARG   9  32.478   8.603   3.304
   59   HH11  ARG   9          HH11      ARG   9  29.575  10.177   4.486
   60   HH12  ARG   9          HH12      ARG   9  30.228  11.771   4.221
   61   HH21  ARG   9          HH21      ARG   9  33.248  10.657   3.013
   62   HH22  ARG   9          HH22      ARG   9  32.254  12.027   3.411
   63    H    GLY  10           H        GLY  10  30.945   3.681   6.250
   64    HA2  GLY  10           HA2      GLY  10  33.097   2.755   5.841
   65    HA3  GLY  10           HA3      GLY  10  33.812   3.845   7.021
   66    H    ASP  11           H        ASP  11  34.885   1.834   7.647
   67    HA   ASP  11           HA       ASP  11  33.468  -0.398   8.795
   68    HB2  ASP  11           HB2      ASP  11  36.421   0.340   8.810
   69    HB3  ASP  11           HB3      ASP  11  35.754  -1.231   9.261
   70    H    LYS  12           H        LYS  12  32.518   1.730  10.240
   71    HA   LYS  12           HA       LYS  12  33.784   2.433  12.667
   72    HB2  LYS  12           HB2      LYS  12  31.831   3.598  11.809
   73    HB3  LYS  12           HB3      LYS  12  30.843   2.149  11.932
   74    HG2  LYS  12           HG2      LYS  12  30.300   3.730  13.710
   75    HG3  LYS  12           HG3      LYS  12  30.884   2.210  14.342
   76    HD2  LYS  12           HD2      LYS  12  31.839   3.950  15.691
   77    HD3  LYS  12           HD3      LYS  12  33.138   3.264  14.743
   78    HE2  LYS  12           HE2      LYS  12  33.538   5.553  14.621
   79    HE3  LYS  12           HE3      LYS  12  32.773   5.195  13.072
   80    HZ1  LYS  12           HZ1      LYS  12  31.422   6.346  15.463
   81    HZ2  LYS  12           HZ2      LYS  12  30.660   5.997  14.060
   82    HZ3  LYS  12           HZ3      LYS  12  31.808   7.167  14.111
   83    H    ALA  13           H        ALA  13  31.759  -0.409  12.025
   84    HA   ALA  13           HA       ALA  13  31.216  -2.245  13.270
   85    HB1  ALA  13           HB1      ALA  13  34.200  -2.084  13.824
   86    HB2  ALA  13           HB2      ALA  13  33.197  -3.551  13.853
   87    HB3  ALA  13           HB3      ALA  13  33.448  -2.683  12.329
   88    H    ALA  14           H        ALA  14  30.413  -0.082  14.781
   89    HA   ALA  14           HA       ALA  14  30.880  -0.970  17.593
   90    HB1  ALA  14           HB1      ALA  14  32.260   1.023  17.122
   91    HB2  ALA  14           HB2      ALA  14  30.798   1.914  16.639
   92    HB3  ALA  14           HB3      ALA  14  30.981   1.350  18.307
   93    H    TYR  15           H        TYR  15  29.000  -2.118  17.598
   94    HA   TYR  15           HA       TYR  15  26.471  -0.532  17.785
   95    HB2  TYR  15           HB2      TYR  15  26.741  -3.291  16.542
   96    HB3  TYR  15           HB3      TYR  15  25.280  -2.322  16.656
   97    HD1  TYR  15           HD1      TYR  15  25.026  -0.230  15.275
   98    HD2  TYR  15           HD2      TYR  15  28.359  -2.927  14.776
   99    HE1  TYR  15           HE1      TYR  15  25.536   0.806  13.068
  100    HE2  TYR  15           HE2      TYR  15  28.877  -1.871  12.573
  101    HH   TYR  15           HH       TYR  15  26.943   0.835  11.251
  102    H    ASP  16           H        ASP  16  28.624  -2.181  19.561
  103    HA   ASP  16           HA       ASP  16  26.909  -3.865  21.225
  104    HB2  ASP  16           HB2      ASP  16  29.757  -2.827  21.547
  105    HB3  ASP  16           HB3      ASP  16  28.987  -3.988  22.624
  106    H    ILE  17           H        ILE  17  27.508  -0.510  21.084
  107    HA   ILE  17           HA       ILE  17  26.150  -0.065  23.685
  108    HB   ILE  17           HB       ILE  17  28.462   0.137  24.192
  109   HG12  ILE  17          HG12      ILE  17  26.726   1.702  25.200
  110   HG13  ILE  17          HG13      ILE  17  28.430   2.024  25.456
  111   HG21  ILE  17          HG21      ILE  17  29.490   0.662  22.052
  112   HG22  ILE  17          HG22      ILE  17  28.785   2.295  22.071
  113   HG23  ILE  17          HG23      ILE  17  29.979   1.821  23.287
  114   HD11  ILE  17          HD11      ILE  17  26.725   3.545  23.438
  115   HD12  ILE  17          HD12      ILE  17  27.131   4.084  25.071
  116   HD13  ILE  17          HD13      ILE  17  28.415   3.875  23.874
  117    H    LEU  18           H        LEU  18  27.253   1.534  20.639
  118    HA   LEU  18           HA       LEU  18  25.178   3.524  20.627
  119    HB2  LEU  18           HB2      LEU  18  26.751   2.216  18.375
  120    HB3  LEU  18           HB3      LEU  18  25.676   3.583  18.143
  121    HG   LEU  18           HG       LEU  18  28.109   3.687  19.977
  122   HD11  LEU  18          HD11      LEU  18  28.820   3.276  17.651
  123   HD12  LEU  18          HD12      LEU  18  29.239   4.909  18.181
  124   HD13  LEU  18          HD13      LEU  18  27.847   4.660  17.103
  125   HD21  LEU  18          HD21      LEU  18  26.404   5.414  20.426
  126   HD22  LEU  18          HD22      LEU  18  26.407   5.891  18.719
  127   HD23  LEU  18          HD23      LEU  18  27.852   6.131  19.728
  128    H    ARG  19           H        ARG  19  23.143   3.508  19.851
  129    HA   ARG  19           HA       ARG  19  21.940   0.956  18.807
  130    HB2  ARG  19           HB2      ARG  19  21.169   1.974  21.084
  131    HB3  ARG  19           HB3      ARG  19  20.505   3.290  20.126
  132    HG2  ARG  19           HG2      ARG  19  18.653   1.893  20.418
  133    HG3  ARG  19           HG3      ARG  19  19.205   1.439  18.817
  134    HD2  ARG  19           HD2      ARG  19  18.744  -0.595  19.920
  135    HD3  ARG  19           HD3      ARG  19  20.512  -0.472  19.957
  136    HE   ARG  19           HE       ARG  19  19.454   0.715  22.331
  137   HH11  ARG  19          HH11      ARG  19  19.777  -2.503  20.985
  138   HH12  ARG  19          HH12      ARG  19  19.695  -3.262  22.552
  139   HH21  ARG  19          HH21      ARG  19  19.342  -0.315  24.291
  140   HH22  ARG  19          HH22      ARG  19  19.457  -2.048  24.370
  141    H    ARG  20           H        ARG  20  20.676   1.085  16.935
  142    HA   ARG  20           HA       ARG  20  20.878   3.622  15.370
  143    HB2  ARG  20           HB2      ARG  20  22.638   1.762  14.997
  144    HB3  ARG  20           HB3      ARG  20  21.371   0.868  14.174
  145    HG2  ARG  20           HG2      ARG  20  22.064   3.739  13.429
  146    HG3  ARG  20           HG3      ARG  20  23.052   2.407  12.868
  147    HD2  ARG  20           HD2      ARG  20  20.066   2.596  12.305
  148    HD3  ARG  20           HD3      ARG  20  21.300   3.266  11.251
  149    HE   ARG  20           HE       ARG  20  20.585   0.462  11.537
  150   HH11  ARG  20          HH11      ARG  20  23.214   2.557  10.516
  151   HH12  ARG  20          HH12      ARG  20  23.948   1.307   9.551
  152   HH21  ARG  20          HH21      ARG  20  21.574  -1.069  10.265
  153   HH22  ARG  20          HH22      ARG  20  23.039  -0.679   9.413
  154    H    CYS  21           H        CYS  21  19.077   4.339  14.574
  155    HA   CYS  21           HA       CYS  21  16.583   2.889  14.863
  156    HB2  CYS  21           HB2      CYS  21  16.992   5.297  15.387
  157    HB3  CYS  21           HB3      CYS  21  17.223   5.605  13.661
  158    H    SER  22           H        SER  22  15.652   1.598  13.386
  159    HA   SER  22           HA       SER  22  16.708   1.104  10.768
  160    HB2  SER  22           HB2      SER  22  14.797  -0.447  10.553
  161    HB3  SER  22           HB3      SER  22  15.671  -0.650  12.080
  162    HG   SER  22           HG       SER  22  13.375  -0.618  12.354
  163    H    GLN  23           H        GLN  23  14.669   3.614  11.709
  164    HA   GLN  23           HA       GLN  23  13.612   3.982   8.924
  165    HB2  GLN  23           HB2      GLN  23  12.363   4.776  11.581
  166    HB3  GLN  23           HB3      GLN  23  11.721   5.186   9.986
  167    HG2  GLN  23           HG2      GLN  23  11.451   2.777   9.457
  168    HG3  GLN  23           HG3      GLN  23  12.065   2.349  11.056
  169   HE21  GLN  23          HE21      GLN  23   9.278   3.710   9.310
  170   HE22  GLN  23          HE22      GLN  23   8.199   3.621  10.697
  171    H    CYS  24           H        CYS  24  15.821   5.241  11.129
  172    HA   CYS  24           HA       CYS  24  15.724   7.961   9.882
  173    HB2  CYS  24           HB2      CYS  24  16.565   7.361  12.725
  174    HB3  CYS  24           HB3      CYS  24  16.277   8.928  11.985
  175    H    GLY  25           H        GLY  25  17.815   5.272  10.843
  176    HA2  GLY  25           HA2      GLY  25  19.914   4.752  10.092
  177    HA3  GLY  25           HA3      GLY  25  19.965   6.257   9.182
  178    H    ILE  26           H        ILE  26  19.392   7.474  12.104
  179    HA   ILE  26           HA       ILE  26  22.100   8.242  12.659
  180    HB   ILE  26           HB       ILE  26  20.166   9.701  12.993
  181   HG12  ILE  26          HG12      ILE  26  20.652  10.645  15.205
  182   HG13  ILE  26          HG13      ILE  26  21.594   9.227  15.636
  183   HG21  ILE  26          HG21      ILE  26  19.355   7.849  15.273
  184   HG22  ILE  26          HG22      ILE  26  18.643   9.432  14.919
  185   HG23  ILE  26          HG23      ILE  26  18.474   8.114  13.762
  186   HD11  ILE  26          HD11      ILE  26  22.224  11.137  13.346
  187   HD12  ILE  26          HD12      ILE  26  23.000  11.143  14.942
  188   HD13  ILE  26          HD13      ILE  26  23.239   9.766  13.857
  189    H    LEU  27           H        LEU  27  23.403   7.842  14.488
  190    HA   LEU  27           HA       LEU  27  22.813   5.389  16.092
  191    HB2  LEU  27           HB2      LEU  27  25.495   6.503  15.157
  192    HB3  LEU  27           HB3      LEU  27  25.302   5.337  16.451
  193    HG   LEU  27           HG       LEU  27  24.119   3.815  14.749
  194   HD11  LEU  27          HD11      LEU  27  25.604   5.684  12.835
  195   HD12  LEU  27          HD12      LEU  27  23.848   5.427  12.880
  196   HD13  LEU  27          HD13      LEU  27  24.913   4.107  12.401
  197   HD21  LEU  27          HD21      LEU  27  27.084   4.462  14.502
  198   HD22  LEU  27          HD22      LEU  27  26.309   2.966  13.941
  199   HD23  LEU  27          HD23      LEU  27  26.330   3.344  15.663
  200    H    LEU  28           H        LEU  28  22.558   5.746  18.230
  201    HA   LEU  28           HA       LEU  28  23.713   8.216  19.484
  202    HB2  LEU  28           HB2      LEU  28  21.037   6.917  20.128
  203    HB3  LEU  28           HB3      LEU  28  21.771   8.247  20.990
  204    HG   LEU  28           HG       LEU  28  20.100   9.240  19.813
  205   HD11  LEU  28          HD11      LEU  28  21.051  10.777  18.277
  206   HD12  LEU  28          HD12      LEU  28  22.392   9.689  17.895
  207   HD13  LEU  28          HD13      LEU  28  22.279  10.415  19.506
  208   HD21  LEU  28          HD21      LEU  28  20.834   7.758  17.276
  209   HD22  LEU  28          HD22      LEU  28  19.523   8.936  17.487
  210   HD23  LEU  28          HD23      LEU  28  19.475   7.392  18.353
  211    HA   PRO  29           HA       PRO  29  25.467   5.259  22.328
  212    HB2  PRO  29           HB2      PRO  29  26.128   6.851  24.472
  213    HB3  PRO  29           HB3      PRO  29  26.987   6.854  22.907
  214    HG2  PRO  29           HG2      PRO  29  24.842   8.779  23.845
  215    HG3  PRO  29           HG3      PRO  29  26.399   9.148  23.045
  216    HD2  PRO  29           HD2      PRO  29  24.055   9.028  21.660
  217    HD3  PRO  29           HD3      PRO  29  25.592   8.469  20.946
  218    H    LEU  30           H        LEU  30  23.497   7.450  24.371
  219    HA   LEU  30           HA       LEU  30  21.544   5.500  25.146
  220    HB2  LEU  30           HB2      LEU  30  23.235   4.358  26.347
  221    HB3  LEU  30           HB3      LEU  30  23.952   5.830  26.958
  222    HG   LEU  30           HG       LEU  30  21.993   6.168  28.455
  223   HD11  LEU  30          HD11      LEU  30  21.059   3.468  27.379
  224   HD12  LEU  30          HD12      LEU  30  20.224   5.022  27.157
  225   HD13  LEU  30          HD13      LEU  30  20.370   4.330  28.775
  226   HD21  LEU  30          HD21      LEU  30  22.493   4.322  29.979
  227   HD22  LEU  30          HD22      LEU  30  23.978   4.911  29.214
  228   HD23  LEU  30          HD23      LEU  30  23.236   3.397  28.654
  229    HA   PRO  31           HA       PRO  31  20.763   9.364  27.809
  230    HB2  PRO  31           HB2      PRO  31  22.470  11.537  27.777
  231    HB3  PRO  31           HB3      PRO  31  22.574  10.179  28.936
  232    HG2  PRO  31           HG2      PRO  31  24.145  10.557  26.371
  233    HG3  PRO  31           HG3      PRO  31  24.758  10.104  27.993
  234    HD2  PRO  31           HD2      PRO  31  24.303   8.225  26.121
  235    HD3  PRO  31           HD3      PRO  31  23.872   7.928  27.827
  236    H    ILE  32           H        ILE  32  22.400  10.001  24.722
  237    HA   ILE  32           HA       ILE  32  20.536  12.094  23.897
  238    HB   ILE  32           HB       ILE  32  22.506  10.569  22.160
  239   HG12  ILE  32          HG12      ILE  32  23.016  13.104  23.792
  240   HG13  ILE  32          HG13      ILE  32  23.702  11.518  24.137
  241   HG21  ILE  32          HG21      ILE  32  20.825  11.956  20.940
  242   HG22  ILE  32          HG22      ILE  32  21.302  13.368  21.904
  243   HG23  ILE  32          HG23      ILE  32  22.436  12.617  20.762
  244   HD11  ILE  32          HD11      ILE  32  25.398  12.782  23.086
  245   HD12  ILE  32          HD12      ILE  32  24.869  11.547  21.928
  246   HD13  ILE  32          HD13      ILE  32  24.354  13.244  21.739
  247    H    LEU  33           H        LEU  33  20.706   8.574  23.540
  248    HA   LEU  33           HA       LEU  33  18.891   8.217  21.380
  249    HB2  LEU  33           HB2      LEU  33  20.318   6.408  22.339
  250    HB3  LEU  33           HB3      LEU  33  19.362   6.456  23.817
  251    HG   LEU  33           HG       LEU  33  17.341   5.732  22.551
  252   HD11  LEU  33          HD11      LEU  33  17.903   6.525  20.281
  253   HD12  LEU  33          HD12      LEU  33  17.600   4.788  20.286
  254   HD13  LEU  33          HD13      LEU  33  19.269   5.386  20.215
  255   HD21  LEU  33          HD21      LEU  33  18.721   4.106  23.710
  256   HD22  LEU  33          HD22      LEU  33  19.774   3.941  22.291
  257   HD23  LEU  33          HD23      LEU  33  18.070   3.416  22.217
  258    H    ASN  34           H        ASN  34  18.263   8.862  24.816
  259    HA   ASN  34           HA       ASN  34  15.523   8.251  24.915
  260    HB2  ASN  34           HB2      ASN  34  17.110   8.851  26.806
  261    HB3  ASN  34           HB3      ASN  34  16.937  10.544  26.346
  262   HD21  ASN  34          HD21      ASN  34  15.292   7.726  27.726
  263   HD22  ASN  34          HD22      ASN  34  13.933   8.637  28.364
  264    H    GLN  35           H        GLN  35  17.061  11.235  23.669
  265    HA   GLN  35           HA       GLN  35  14.563  12.644  23.226
  266    HB2  GLN  35           HB2      GLN  35  16.762  13.759  23.563
  267    HB3  GLN  35           HB3      GLN  35  17.308  13.132  21.999
  268    HG2  GLN  35           HG2      GLN  35  15.502  14.387  20.853
  269    HG3  GLN  35           HG3      GLN  35  14.874  14.937  22.409
  270   HE21  GLN  35          HE21      GLN  35  16.073  16.607  23.574
  271   HE22  GLN  35          HE22      GLN  35  17.320  17.528  22.743
  272    H    HIS  36           H        HIS  36  16.720  10.667  21.070
  273    HA   HIS  36           HA       HIS  36  15.048  11.062  18.746
  274    HB2  HIS  36           HB2      HIS  36  17.395  10.154  18.647
  275    HB3  HIS  36           HB3      HIS  36  16.787   8.624  19.289
  276    HD1  HIS  36           HD1      HIS  36  16.450  10.895  16.193
  277    HD2  HIS  36           HD2      HIS  36  15.367   7.064  17.535
  278    HE1  HIS  36           HE1      HIS  36  15.459   9.718  14.190
  279    H    GLN  37           H        GLN  37  15.075   8.534  21.294
  280    HA   GLN  37           HA       GLN  37  13.123   6.852  20.221
  281    HB2  GLN  37           HB2      GLN  37  14.606   6.317  22.117
  282    HB3  GLN  37           HB3      GLN  37  13.744   7.461  23.141
  283    HG2  GLN  37           HG2      GLN  37  13.091   5.127  23.582
  284    HG3  GLN  37           HG3      GLN  37  11.720   6.106  23.066
  285   HE21  GLN  37          HE21      GLN  37  14.304   4.147  21.366
  286   HE22  GLN  37          HE22      GLN  37  13.139   3.318  20.345
  287    H    GLU  38           H        GLU  38  12.513   9.616  22.529
  288    HA   GLU  38           HA       GLU  38   9.668   9.226  22.397
  289    HB2  GLU  38           HB2      GLU  38   9.401  11.286  23.524
  290    HB3  GLU  38           HB3      GLU  38  10.745  10.396  24.244
  291    HG2  GLU  38           HG2      GLU  38  12.338  11.860  23.008
  292    HG3  GLU  38           HG3      GLU  38  10.979  12.768  22.342
  293    H    LYS  39           H        LYS  39  11.791  11.310  20.375
  294    HA   LYS  39           HA       LYS  39   9.601  12.547  18.958
  295    HB2  LYS  39           HB2      LYS  39  11.752  13.627  18.967
  296    HB3  LYS  39           HB3      LYS  39  12.558  12.188  18.346
  297    HG2  LYS  39           HG2      LYS  39  12.399  13.871  16.607
  298    HG3  LYS  39           HG3      LYS  39  11.483  12.439  16.171
  299    HD2  LYS  39           HD2      LYS  39   9.412  13.795  17.143
  300    HD3  LYS  39           HD3      LYS  39  10.464  15.193  16.943
  301    HE2  LYS  39           HE2      LYS  39   9.692  13.168  14.785
  302    HE3  LYS  39           HE3      LYS  39   8.926  14.742  15.011
  303    HZ1  LYS  39           HZ1      LYS  39  11.065  15.794  14.506
  304    HZ2  LYS  39           HZ2      LYS  39  10.609  14.834  13.271
  305    HZ3  LYS  39           HZ3      LYS  39  11.783  14.341  14.288
  306    H    CYS  40           H        CYS  40  11.678   9.788  18.084
  307    HA   CYS  40           HA       CYS  40  10.554   9.243  15.545
  308    HB2  CYS  40           HB2      CYS  40  12.769   8.590  16.701
  309    HB3  CYS  40           HB3      CYS  40  11.884   7.257  17.439
  310    H    ARG  41           H        ARG  41   9.840   7.840  18.780
  311    HA   ARG  41           HA       ARG  41   7.638   6.164  18.021
  312    HB2  ARG  41           HB2      ARG  41   8.888   5.959  20.124
  313    HB3  ARG  41           HB3      ARG  41   8.291   7.542  20.655
  314    HG2  ARG  41           HG2      ARG  41   6.019   6.708  20.811
  315    HG3  ARG  41           HG3      ARG  41   6.472   5.179  20.045
  316    HD2  ARG  41           HD2      ARG  41   6.225   4.954  22.509
  317    HD3  ARG  41           HD3      ARG  41   7.828   4.529  21.925
  318    HE   ARG  41           HE       ARG  41   8.754   6.207  23.171
  319   HH11  ARG  41          HH11      ARG  41   5.337   6.978  22.996
  320   HH12  ARG  41          HH12      ARG  41   5.487   8.287  24.133
  321   HH21  ARG  41          HH21      ARG  41   8.848   7.832  24.678
  322   HH22  ARG  41          HH22      ARG  41   7.423   8.759  25.044
  323    H    TRP  42           H        TRP  42   7.616   9.581  19.231
  324    HA   TRP  42           HA       TRP  42   4.787   9.880  19.147
  325    HB2  TRP  42           HB2      TRP  42   6.338  11.448  20.267
  326    HB3  TRP  42           HB3      TRP  42   6.908  12.013  18.698
  327    HD1  TRP  42           HD1      TRP  42   4.111  12.340  21.191
  328    HE1  TRP  42           HE1      TRP  42   2.444  14.161  20.488
  329    HE3  TRP  42           HE3      TRP  42   5.869  13.283  16.459
  330    HZ2  TRP  42           HZ2      TRP  42   1.889  15.756  18.156
  331    HZ3  TRP  42           HZ3      TRP  42   4.721  14.939  15.009
  332    HH2  TRP  42           HH2      TRP  42   2.736  16.181  15.842
  333    H    LEU  43           H        LEU  43   7.221  10.582  16.580
  334    HA   LEU  43           HA       LEU  43   5.338  11.498  14.658
  335    HB2  LEU  43           HB2      LEU  43   7.864  11.782  14.648
  336    HB3  LEU  43           HB3      LEU  43   7.995  10.097  14.151
  337    HG   LEU  43           HG       LEU  43   6.587  10.695  12.098
  338   HD11  LEU  43          HD11      LEU  43   5.553  12.795  12.903
  339   HD12  LEU  43          HD12      LEU  43   6.528  13.101  11.464
  340   HD13  LEU  43          HD13      LEU  43   7.159  13.537  13.065
  341   HD21  LEU  43          HD21      LEU  43   9.225  12.173  12.477
  342   HD22  LEU  43          HD22      LEU  43   8.464  11.766  10.920
  343   HD23  LEU  43          HD23      LEU  43   9.030  10.474  11.988
  344    H    ALA  44           H        ALA  44   6.682   8.188  15.157
  345    HA   ALA  44           HA       ALA  44   5.235   6.918  13.067
  346    HB1  ALA  44           HB1      ALA  44   7.199   5.951  14.202
  347    HB2  ALA  44           HB2      ALA  44   6.272   5.803  15.713
  348    HB3  ALA  44           HB3      ALA  44   5.813   4.847  14.287
  349    H    SER  45           H        SER  45   4.279   7.529  16.470
  350    HA   SER  45           HA       SER  45   1.754   6.117  16.314
  351    HB2  SER  45           HB2      SER  45   2.994   6.622  18.420
  352    HB3  SER  45           HB3      SER  45   2.651   8.344  18.189
  353    HG   SER  45           HG       SER  45   0.793   6.218  18.632
  354    H    SER  46           H        SER  46   2.669   9.556  15.927
  355    HA   SER  46           HA       SER  46   0.034  10.588  15.445
  356    HB2  SER  46           HB2      SER  46   1.998  11.895  16.220
  357    HB3  SER  46           HB3      SER  46   2.756  11.687  14.631
  358    HG   SER  46           HG       SER  46   1.589  13.695  14.928
  359    H    LYS  47           H        LYS  47   2.386   9.064  13.339
  360    HA   LYS  47           HA       LYS  47   2.488   8.514  11.149
  361    HB2  LYS  47           HB2      LYS  47  -0.551   8.643  11.294
  362    HB3  LYS  47           HB3      LYS  47   0.375   7.901   9.989
  363    HG2  LYS  47           HG2      LYS  47   1.253   6.190  11.430
  364    HG3  LYS  47           HG3      LYS  47   0.646   6.994  12.879
  365    HD2  LYS  47           HD2      LYS  47  -0.734   5.086  12.356
  366    HD3  LYS  47           HD3      LYS  47  -1.661   6.587  12.244
  367    HE2  LYS  47           HE2      LYS  47  -1.450   6.544   9.772
  368    HE3  LYS  47           HE3      LYS  47  -0.479   5.068   9.873
  369    HZ1  LYS  47           HZ1      LYS  47  -3.302   5.309  10.779
  370    HZ2  LYS  47           HZ2      LYS  47  -2.407   3.943  10.847
  371    HZ3  LYS  47           HZ3      LYS  47  -2.820   4.579   9.403
  372    H    GLY  48           H        GLY  48   2.650  11.329  11.853
  373    HA2  GLY  48           HA2      GLY  48   1.185  13.038  10.146
  374    HA3  GLY  48           HA3      GLY  48   2.694  13.447  10.964
  375    H    LYS  49           H        LYS  49   4.519  11.792   9.705
  376    HA   LYS  49           HA       LYS  49   4.219  11.778   6.809
  377    HB2  LYS  49           HB2      LYS  49   4.991  14.140   7.349
  378    HB3  LYS  49           HB3      LYS  49   6.492  13.476   7.975
  379    HG2  LYS  49           HG2      LYS  49   5.572  12.749   5.175
  380    HG3  LYS  49           HG3      LYS  49   6.214  14.360   5.474
  381    HD2  LYS  49           HD2      LYS  49   8.371  13.543   6.101
  382    HD3  LYS  49           HD3      LYS  49   7.804  11.885   6.233
  383    HE2  LYS  49           HE2      LYS  49   9.037  12.051   4.194
  384    HE3  LYS  49           HE3      LYS  49   7.335  11.816   3.797
  385    HZ1  LYS  49           HZ1      LYS  49   7.186  14.220   3.353
  386    HZ2  LYS  49           HZ2      LYS  49   8.344  13.549   2.425
  387    HZ3  LYS  49           HZ3      LYS  49   8.764  14.427   3.732
  388    H    GLN  50           H        GLN  50   5.385  10.147   5.937
  389    HA   GLN  50           HA       GLN  50   7.535   8.814   7.538
  390    HB2  GLN  50           HB2      GLN  50   5.331   7.426   5.958
  391    HB3  GLN  50           HB3      GLN  50   6.644   6.638   6.814
  392    HG2  GLN  50           HG2      GLN  50   4.314   8.177   8.041
  393    HG3  GLN  50           HG3      GLN  50   4.563   6.437   8.049
  394   HE21  GLN  50          HE21      GLN  50   7.209   6.117   8.921
  395   HE22  GLN  50          HE22      GLN  50   7.347   6.835  10.520
  396    H    VAL  51           H        VAL  51   9.302   8.166   6.374
  397    HA   VAL  51           HA       VAL  51   9.565   9.054   3.599
  398    HB   VAL  51           HB       VAL  51  11.870   8.305   3.737
  399   HG11  VAL  51          HG11      VAL  51  11.215  10.525   4.625
  400   HG12  VAL  51          HG12      VAL  51  11.057   9.822   6.251
  401   HG13  VAL  51          HG13      VAL  51  12.634   9.853   5.441
  402   HG21  VAL  51          HG21      VAL  51  11.733   6.305   5.117
  403   HG22  VAL  51          HG22      VAL  51  12.826   7.463   5.864
  404   HG23  VAL  51          HG23      VAL  51  11.196   7.253   6.525
  405    H    ARG  52           H        ARG  52   8.607   6.097   5.040
  406    HA   ARG  52           HA       ARG  52   9.021   4.419   2.621
  407    HB2  ARG  52           HB2      ARG  52   7.731   3.955   5.337
  408    HB3  ARG  52           HB3      ARG  52   7.453   2.866   3.985
  409    HG2  ARG  52           HG2      ARG  52   9.193   2.000   5.432
  410    HG3  ARG  52           HG3      ARG  52   9.805   2.314   3.807
  411    HD2  ARG  52           HD2      ARG  52  10.918   4.345   4.561
  412    HD3  ARG  52           HD3      ARG  52  10.177   4.211   6.158
  413    HE   ARG  52           HE       ARG  52  11.683   2.528   6.756
  414   HH11  ARG  52          HH11      ARG  52  12.195   3.211   3.355
  415   HH12  ARG  52          HH12      ARG  52  13.765   2.459   3.352
  416   HH21  ARG  52          HH21      ARG  52  13.724   1.647   6.695
  417   HH22  ARG  52          HH22      ARG  52  14.585   1.578   5.187
  418    H    ASN  53           H        ASN  53   8.008   5.511   1.025
  419    HA   ASN  53           HA       ASN  53   5.022   5.639   1.101
  420    HB2  ASN  53           HB2      ASN  53   6.297   7.866   1.382
  421    HB3  ASN  53           HB3      ASN  53   6.807   7.681  -0.292
  422   HD21  ASN  53          HD21      ASN  53   5.094   9.763   0.998
  423   HD22  ASN  53          HD22      ASN  53   3.579   9.699   0.105
  424    H    PHE  54           H        PHE  54   3.995   5.174  -0.902
  425    HA   PHE  54           HA       PHE  54   5.602   3.707  -2.934
  426    HB2  PHE  54           HB2      PHE  54   4.243   1.689  -2.582
  427    HB3  PHE  54           HB3      PHE  54   5.193   2.104  -1.176
  428    HD1  PHE  54           HD1      PHE  54   1.732   2.084  -2.578
  429    HD2  PHE  54           HD2      PHE  54   4.160   2.604   0.952
  430    HE1  PHE  54           HE1      PHE  54  -0.303   1.989  -1.161
  431    HE2  PHE  54           HE2      PHE  54   2.121   2.500   2.366
  432    HZ   PHE  54           HZ       PHE  54  -0.113   2.196   1.312
  433    H    SER  55           H        SER  55   4.087   2.682  -4.592
  434    HA   SER  55           HA       SER  55   1.856   4.476  -5.412
  435    HB2  SER  55           HB2      SER  55   4.077   5.353  -6.249
  436    HB3  SER  55           HB3      SER  55   4.256   3.849  -7.174
  437    HG   SER  55           HG       SER  55   3.259   5.562  -8.403
  Start of MODEL   10
    1    H1   GLY   1           H1       GLY   1  15.244  16.963   7.709
    2    H2   GLY   1           H2       GLY   1  14.061  17.861   8.406
    3    H3   GLY   1           H3       GLY   1  15.513  17.699   9.146
    4    HA2  GLY   1           HA2      GLY   1  14.753  19.729   7.463
    5    HA3  GLY   1           HA3      GLY   1  16.375  19.433   8.110
    6    H    SER   2           H        SER   2  15.054  20.191   5.347
    7    HA   SER   2           HA       SER   2  15.925  18.158   3.492
    8    HB2  SER   2           HB2      SER   2  15.103  21.039   2.993
    9    HB3  SER   2           HB3      SER   2  15.235  19.756   1.776
   10    HG   SER   2           HG       SER   2  13.572  18.628   2.839
   11    H    GLU   3           H        GLU   3  18.140  18.155   4.574
   12    HA   GLU   3           HA       GLU   3  20.071  19.937   3.119
   13    HB2  GLU   3           HB2      GLU   3  20.152  18.797   5.936
   14    HB3  GLU   3           HB3      GLU   3  21.547  19.536   5.163
   15    HG2  GLU   3           HG2      GLU   3  18.908  20.940   5.726
   16    HG3  GLU   3           HG3      GLU   3  20.381  21.084   6.673
   17    H    PHE   4           H        PHE   4  19.053  17.567   1.994
   18    HA   PHE   4           HA       PHE   4  19.641  15.671   0.912
   19    HB2  PHE   4           HB2      PHE   4  22.411  16.911   1.004
   20    HB3  PHE   4           HB3      PHE   4  21.855  15.699  -0.136
   21    HD1  PHE   4           HD1      PHE   4  20.304  16.252  -1.962
   22    HD2  PHE   4           HD2      PHE   4  21.690  19.271   0.789
   23    HE1  PHE   4           HE1      PHE   4  19.499  18.029  -3.501
   24    HE2  PHE   4           HE2      PHE   4  20.866  21.044  -0.743
   25    HZ   PHE   4           HZ       PHE   4  19.773  20.426  -2.891
   26    H    THR   5           H        THR   5  19.822  15.474   3.892
   27    HA   THR   5           HA       THR   5  21.972  13.530   4.421
   28    HB   THR   5           HB       THR   5  19.857  14.661   6.286
   29    HG1  THR   5           HG1      THR   5  21.520  16.082   5.253
   30   HG21  THR   5          HG21      THR   5  22.481  13.187   6.839
   31   HG22  THR   5          HG22      THR   5  20.849  12.604   7.232
   32   HG23  THR   5          HG23      THR   5  21.497  14.019   8.062
   33    H    SER   6           H        SER   6  21.145  11.993   2.841
   34    HA   SER   6           HA       SER   6  18.703  10.481   3.416
   35    HB2  SER   6           HB2      SER   6  21.017   9.859   1.540
   36    HB3  SER   6           HB3      SER   6  19.476   8.988   1.617
   37    HG   SER   6           HG       SER   6  19.898  11.708   0.877
   38    H    SER   7           H        SER   7  21.811  10.366   4.799
   39    HA   SER   7           HA       SER   7  23.091   8.806   5.881
   40    HB2  SER   7           HB2      SER   7  20.375   8.310   7.127
   41    HB3  SER   7           HB3      SER   7  21.934   7.874   7.850
   42    HG   SER   7           HG       SER   7  22.493  10.046   7.940
   43    HA   PRO   8           HA       PRO   8  21.699   5.123   3.323
   44    HB2  PRO   8           HB2      PRO   8  23.866   4.831   1.665
   45    HB3  PRO   8           HB3      PRO   8  22.526   5.974   1.350
   46    HG2  PRO   8           HG2      PRO   8  25.205   6.565   2.653
   47    HG3  PRO   8           HG3      PRO   8  24.404   7.455   1.319
   48    HD2  PRO   8           HD2      PRO   8  24.214   8.292   3.896
   49    HD3  PRO   8           HD3      PRO   8  22.820   8.410   2.781
   50    H    ARG   9           H        ARG   9  24.739   5.744   5.001
   51    HA   ARG   9           HA       ARG   9  24.827   2.999   6.106
   52    HB2  ARG   9           HB2      ARG   9  27.239   4.276   4.724
   53    HB3  ARG   9           HB3      ARG   9  27.245   2.771   5.646
   54    HG2  ARG   9           HG2      ARG   9  25.572   1.831   3.977
   55    HG3  ARG   9           HG3      ARG   9  25.820   3.292   3.009
   56    HD2  ARG   9           HD2      ARG   9  27.230   1.651   2.052
   57    HD3  ARG   9           HD3      ARG   9  28.281   2.752   2.931
   58    HE   ARG   9           HE       ARG   9  28.884   1.037   4.377
   59   HH11  ARG   9          HH11      ARG   9  26.097  -0.110   2.577
   60   HH12  ARG   9          HH12      ARG   9  26.281  -1.740   3.165
   61   HH21  ARG   9          HH21      ARG   9  29.049  -1.060   5.084
   62   HH22  ARG   9          HH22      ARG   9  27.906  -2.254   4.545
   63    H    GLY  10           H        GLY  10  26.492   2.874   7.890
   64    HA2  GLY  10           HA2      GLY  10  27.237   5.323   9.299
   65    HA3  GLY  10           HA3      GLY  10  25.775   4.572   9.941
   66    H    ASP  11           H        ASP  11  28.858   3.148   8.724
   67    HA   ASP  11           HA       ASP  11  29.053   1.195  10.836
   68    HB2  ASP  11           HB2      ASP  11  30.001   0.991   8.526
   69    HB3  ASP  11           HB3      ASP  11  31.186   2.236   8.928
   70    H    LYS  12           H        LYS  12  30.541   1.047  12.581
   71    HA   LYS  12           HA       LYS  12  32.269   3.307  13.298
   72    HB2  LYS  12           HB2      LYS  12  29.735   3.552  14.266
   73    HB3  LYS  12           HB3      LYS  12  30.352   2.430  15.464
   74    HG2  LYS  12           HG2      LYS  12  30.807   4.473  16.453
   75    HG3  LYS  12           HG3      LYS  12  32.354   4.155  15.687
   76    HD2  LYS  12           HD2      LYS  12  31.644   5.560  13.732
   77    HD3  LYS  12           HD3      LYS  12  30.120   5.911  14.547
   78    HE2  LYS  12           HE2      LYS  12  32.895   6.623  15.611
   79    HE3  LYS  12           HE3      LYS  12  31.836   7.723  14.725
   80    HZ1  LYS  12           HZ1      LYS  12  30.189   7.473  16.519
   81    HZ2  LYS  12           HZ2      LYS  12  31.592   8.080  17.083
   82    HZ3  LYS  12           HZ3      LYS  12  31.219   6.522  17.370
   83    H    ALA  13           H        ALA  13  33.821   2.791  14.916
   84    HA   ALA  13           HA       ALA  13  34.706   0.082  15.080
   85    HB1  ALA  13           HB1      ALA  13  35.461   2.526  16.747
   86    HB2  ALA  13           HB2      ALA  13  36.400   1.026  16.607
   87    HB3  ALA  13           HB3      ALA  13  36.184   2.062  15.185
   88    H    ALA  14           H        ALA  14  32.473   1.819  17.125
   89    HA   ALA  14           HA       ALA  14  32.410  -0.401  19.121
   90    HB1  ALA  14           HB1      ALA  14  32.239   1.290  20.885
   91    HB2  ALA  14           HB2      ALA  14  33.721   1.534  19.949
   92    HB3  ALA  14           HB3      ALA  14  32.318   2.596  19.682
   93    H    TYR  15           H        TYR  15  30.694  -0.198  16.855
   94    HA   TYR  15           HA       TYR  15  28.229   1.069  17.349
   95    HB2  TYR  15           HB2      TYR  15  27.367  -0.189  15.567
   96    HB3  TYR  15           HB3      TYR  15  29.040   0.142  15.172
   97    HD1  TYR  15           HD2      TYR  15  30.730  -1.721  15.182
   98    HD2  TYR  15           HD1      TYR  15  26.552  -2.440  16.001
   99    HE1  TYR  15           HE2      TYR  15  31.083  -4.162  14.859
  100    HE2  TYR  15           HE1      TYR  15  26.910  -4.880  15.675
  101    HH   TYR  15           HH       TYR  15  28.417  -6.537  15.195
  102    H    ASP  16           H        ASP  16  29.425  -1.751  18.969
  103    HA   ASP  16           HA       ASP  16  26.925  -2.992  19.667
  104    HB2  ASP  16           HB2      ASP  16  29.666  -3.039  20.990
  105    HB3  ASP  16           HB3      ASP  16  28.309  -4.043  21.490
  106    H    ILE  17           H        ILE  17  28.739  -0.314  21.220
  107    HA   ILE  17           HA       ILE  17  26.842  -0.259  23.499
  108    HB   ILE  17           HB       ILE  17  29.013   0.202  24.134
  109   HG12  ILE  17          HG12      ILE  17  27.115   1.662  25.059
  110   HG13  ILE  17          HG13      ILE  17  28.780   2.042  25.441
  111   HG21  ILE  17          HG21      ILE  17  29.257   2.330  21.987
  112   HG22  ILE  17          HG22      ILE  17  30.395   2.110  23.334
  113   HG23  ILE  17          HG23      ILE  17  30.180   0.816  22.166
  114   HD11  ILE  17          HD11      ILE  17  28.813   3.935  23.924
  115   HD12  ILE  17          HD12      ILE  17  27.190   3.558  23.323
  116   HD13  ILE  17          HD13      ILE  17  27.419   4.059  25.002
  117    H    LEU  18           H        LEU  18  27.477   1.540  20.504
  118    HA   LEU  18           HA       LEU  18  25.451   3.548  20.829
  119    HB2  LEU  18           HB2      LEU  18  26.471   2.231  18.279
  120    HB3  LEU  18           HB3      LEU  18  25.561   3.730  18.365
  121    HG   LEU  18           HG       LEU  18  28.388   3.313  19.424
  122   HD11  LEU  18          HD11      LEU  18  28.252   3.400  16.975
  123   HD12  LEU  18          HD12      LEU  18  28.977   4.881  17.623
  124   HD13  LEU  18          HD13      LEU  18  27.298   4.899  17.063
  125   HD21  LEU  18          HD21      LEU  18  26.576   5.757  19.453
  126   HD22  LEU  18          HD22      LEU  18  28.342   5.845  19.634
  127   HD23  LEU  18          HD23      LEU  18  27.401   4.957  20.825
  128    H    ARG  19           H        ARG  19  23.438   3.697  19.643
  129    HA   ARG  19           HA       ARG  19  22.112   1.118  18.895
  130    HB2  ARG  19           HB2      ARG  19  21.217   1.850  21.070
  131    HB3  ARG  19           HB3      ARG  19  20.931   3.464  20.430
  132    HG2  ARG  19           HG2      ARG  19  18.822   2.313  20.537
  133    HG3  ARG  19           HG3      ARG  19  19.232   2.534  18.853
  134    HD2  ARG  19           HD2      ARG  19  20.223   0.067  19.082
  135    HD3  ARG  19           HD3      ARG  19  19.213  -0.004  20.517
  136    HE   ARG  19           HE       ARG  19  18.377   0.108  17.682
  137   HH11  ARG  19          HH11      ARG  19  17.123   0.619  20.920
  138   HH12  ARG  19          HH12      ARG  19  15.479   0.384  20.394
  139   HH21  ARG  19          HH21      ARG  19  16.318  -0.281  17.124
  140   HH22  ARG  19          HH22      ARG  19  15.037  -0.145  18.296
  141    H    ARG  20           H        ARG  20  20.802   1.179  17.136
  142    HA   ARG  20           HA       ARG  20  20.788   3.620  15.404
  143    HB2  ARG  20           HB2      ARG  20  20.993   0.802  14.287
  144    HB3  ARG  20           HB3      ARG  20  21.264   2.338  13.485
  145    HG2  ARG  20           HG2      ARG  20  23.456   1.943  13.756
  146    HG3  ARG  20           HG3      ARG  20  23.232   2.400  15.436
  147    HD2  ARG  20           HD2      ARG  20  24.308   0.365  15.680
  148    HD3  ARG  20           HD3      ARG  20  22.627  -0.129  15.809
  149    HE   ARG  20           HE       ARG  20  22.799  -1.273  13.780
  150   HH11  ARG  20          HH11      ARG  20  25.654   0.738  14.066
  151   HH12  ARG  20          HH12      ARG  20  26.456  -0.052  12.736
  152   HH21  ARG  20          HH21      ARG  20  23.890  -2.235  12.088
  153   HH22  ARG  20          HH22      ARG  20  25.488  -1.695  11.669
  154    H    CYS  21           H        CYS  21  19.042   3.714  13.897
  155    HA   CYS  21           HA       CYS  21  16.583   2.198  14.681
  156    HB2  CYS  21           HB2      CYS  21  16.737   4.416  15.770
  157    HB3  CYS  21           HB3      CYS  21  16.884   5.177  14.180
  158    H    SER  22           H        SER  22  15.987   1.037  13.015
  159    HA   SER  22           HA       SER  22  16.806   1.310  10.331
  160    HB2  SER  22           HB2      SER  22  14.405  -0.205  11.422
  161    HB3  SER  22           HB3      SER  22  15.212  -0.488   9.868
  162    HG   SER  22           HG       SER  22  15.954  -1.943  11.469
  163    H    GLN  23           H        GLN  23  14.524   3.271  11.816
  164    HA   GLN  23           HA       GLN  23  13.092   3.864   9.259
  165    HB2  GLN  23           HB2      GLN  23  11.869   3.058  11.407
  166    HB3  GLN  23           HB3      GLN  23  12.191   4.677  12.036
  167    HG2  GLN  23           HG2      GLN  23  10.954   5.630  10.060
  168    HG3  GLN  23           HG3      GLN  23  10.652   3.989   9.487
  169   HE21  GLN  23          HE21      GLN  23   9.528   6.514  11.592
  170   HE22  GLN  23          HE22      GLN  23   8.254   5.570  12.350
  171    H    CYS  24           H        CYS  24  15.612   5.024  11.166
  172    HA   CYS  24           HA       CYS  24  15.171   7.883  10.375
  173    HB2  CYS  24           HB2      CYS  24  16.509   6.866  12.884
  174    HB3  CYS  24           HB3      CYS  24  16.052   8.527  12.502
  175    H    GLY  25           H        GLY  25  17.631   5.348  10.988
  176    HA2  GLY  25           HA2      GLY  25  19.649   5.008   9.929
  177    HA3  GLY  25           HA3      GLY  25  19.474   6.531   9.063
  178    H    ILE  26           H        ILE  26  19.136   7.574  12.122
  179    HA   ILE  26           HA       ILE  26  21.903   8.455  12.430
  180    HB   ILE  26           HB       ILE  26  19.954   9.897  12.819
  181   HG12  ILE  26          HG12      ILE  26  21.569   9.613  15.381
  182   HG13  ILE  26          HG13      ILE  26  22.163  10.362  13.893
  183   HG21  ILE  26          HG21      ILE  26  19.408   8.227  15.309
  184   HG22  ILE  26          HG22      ILE  26  18.535   9.690  14.783
  185   HG23  ILE  26          HG23      ILE  26  18.436   8.216  13.829
  186   HD11  ILE  26          HD11      ILE  26  19.865  11.323  15.643
  187   HD12  ILE  26          HD12      ILE  26  21.436  12.093  15.391
  188   HD13  ILE  26          HD13      ILE  26  20.269  12.022  14.053
  189    H    LEU  27           H        LEU  27  23.108   8.250  14.465
  190    HA   LEU  27           HA       LEU  27  22.627   5.748  16.013
  191    HB2  LEU  27           HB2      LEU  27  25.298   6.800  14.966
  192    HB3  LEU  27           HB3      LEU  27  25.105   5.580  16.213
  193    HG   LEU  27           HG       LEU  27  23.660   4.320  14.401
  194   HD11  LEU  27          HD11      LEU  27  25.521   5.969  12.641
  195   HD12  LEU  27          HD12      LEU  27  23.746   6.025  12.618
  196   HD13  LEU  27          HD13      LEU  27  24.578   4.552  12.129
  197   HD21  LEU  27          HD21      LEU  27  25.726   3.146  13.683
  198   HD22  LEU  27          HD22      LEU  27  25.747   3.482  15.421
  199   HD23  LEU  27          HD23      LEU  27  26.705   4.486  14.308
  200    H    LEU  28           H        LEU  28  22.700   5.972  18.162
  201    HA   LEU  28           HA       LEU  28  23.772   8.487  19.392
  202    HB2  LEU  28           HB2      LEU  28  21.209   7.008  20.136
  203    HB3  LEU  28           HB3      LEU  28  21.921   8.312  21.047
  204    HG   LEU  28           HG       LEU  28  20.130   9.267  20.001
  205   HD11  LEU  28          HD11      LEU  28  22.236  10.602  19.768
  206   HD12  LEU  28          HD12      LEU  28  20.959  11.003  18.604
  207   HD13  LEU  28          HD13      LEU  28  22.350  10.038  18.092
  208   HD21  LEU  28          HD21      LEU  28  19.505   9.157  17.692
  209   HD22  LEU  28          HD22      LEU  28  19.642   7.512  18.338
  210   HD23  LEU  28          HD23      LEU  28  20.911   8.168  17.288
  211    HA   PRO  29           HA       PRO  29  25.885   5.636  22.063
  212    HB2  PRO  29           HB2      PRO  29  26.419   7.164  24.290
  213    HB3  PRO  29           HB3      PRO  29  27.242   7.343  22.716
  214    HG2  PRO  29           HG2      PRO  29  24.923   8.973  23.788
  215    HG3  PRO  29           HG3      PRO  29  26.415   9.549  22.987
  216    HD2  PRO  29           HD2      PRO  29  24.072   9.253  21.626
  217    HD3  PRO  29           HD3      PRO  29  25.644   8.892  20.863
  218    H    LEU  30           H        LEU  30  23.772   7.462  24.309
  219    HA   LEU  30           HA       LEU  30  22.079   5.243  24.995
  220    HB2  LEU  30           HB2      LEU  30  23.944   4.255  26.064
  221    HB3  LEU  30           HB3      LEU  30  24.494   5.767  26.748
  222    HG   LEU  30           HG       LEU  30  22.570   5.761  28.325
  223   HD11  LEU  30          HD11      LEU  30  21.940   3.031  27.110
  224   HD12  LEU  30          HD12      LEU  30  20.906   4.474  27.019
  225   HD13  LEU  30          HD13      LEU  30  21.207   3.710  28.581
  226   HD21  LEU  30          HD21      LEU  30  24.155   3.162  28.303
  227   HD22  LEU  30          HD22      LEU  30  23.364   3.906  29.711
  228   HD23  LEU  30          HD23      LEU  30  24.729   4.721  28.932
  229    HA   PRO  31           HA       PRO  31  20.864   8.846  27.822
  230    HB2  PRO  31           HB2      PRO  31  22.317  11.178  28.001
  231    HB3  PRO  31           HB3      PRO  31  22.580   9.744  29.038
  232    HG2  PRO  31           HG2      PRO  31  24.100  10.530  26.535
  233    HG3  PRO  31           HG3      PRO  31  24.759  10.006  28.114
  234    HD2  PRO  31           HD2      PRO  31  24.510   8.271  26.059
  235    HD3  PRO  31           HD3      PRO  31  24.164   7.768  27.737
  236    H    ILE  32           H        ILE  32  22.549  10.055  24.898
  237    HA   ILE  32           HA       ILE  32  20.560  12.023  24.218
  238    HB   ILE  32           HB       ILE  32  22.543  10.695  22.340
  239   HG12  ILE  32          HG12      ILE  32  22.964  13.163  24.095
  240   HG13  ILE  32          HG13      ILE  32  23.708  11.591  24.373
  241   HG21  ILE  32          HG21      ILE  32  21.206  13.445  22.263
  242   HG22  ILE  32          HG22      ILE  32  22.375  12.830  21.076
  243   HG23  ILE  32          HG23      ILE  32  20.804  12.077  21.207
  244   HD11  ILE  32          HD11      ILE  32  25.354  12.957  23.371
  245   HD12  ILE  32          HD12      ILE  32  24.867  11.754  22.162
  246   HD13  ILE  32          HD13      ILE  32  24.290  13.438  22.046
  247    H    LEU  33           H        LEU  33  20.722   8.560  23.683
  248    HA   LEU  33           HA       LEU  33  18.838   8.265  21.576
  249    HB2  LEU  33           HB2      LEU  33  20.342   6.471  22.551
  250    HB3  LEU  33           HB3      LEU  33  19.287   6.452  23.964
  251    HG   LEU  33           HG       LEU  33  17.367   5.788  22.460
  252   HD11  LEU  33          HD11      LEU  33  19.591   5.316  20.428
  253   HD12  LEU  33          HD12      LEU  33  18.308   6.526  20.277
  254   HD13  LEU  33          HD13      LEU  33  17.892   4.811  20.271
  255   HD21  LEU  33          HD21      LEU  33  19.750   3.916  22.531
  256   HD22  LEU  33          HD22      LEU  33  18.031   3.468  22.344
  257   HD23  LEU  33          HD23      LEU  33  18.596   4.189  23.852
  258    H    ASN  34           H        ASN  34  18.285   9.146  24.979
  259    HA   ASN  34           HA       ASN  34  15.518   8.490  25.145
  260    HB2  ASN  34           HB2      ASN  34  17.098  10.791  26.373
  261    HB3  ASN  34           HB3      ASN  34  15.444  10.386  26.814
  262   HD21  ASN  34          HD21      ASN  34  17.921  10.357  28.475
  263   HD22  ASN  34          HD22      ASN  34  17.944   8.731  29.145
  264    H    GLN  35           H        GLN  35  17.064  11.425  23.738
  265    HA   GLN  35           HA       GLN  35  14.612  12.756  23.039
  266    HB2  GLN  35           HB2      GLN  35  16.811  13.875  23.110
  267    HB3  GLN  35           HB3      GLN  35  17.367  12.900  21.741
  268    HG2  GLN  35           HG2      GLN  35  15.638  13.918  20.289
  269    HG3  GLN  35           HG3      GLN  35  15.008  14.837  21.660
  270   HE21  GLN  35          HE21      GLN  35  17.975  14.381  19.635
  271   HE22  GLN  35          HE22      GLN  35  18.535  16.030  19.873
  272    H    HIS  36           H        HIS  36  16.630  10.345  21.287
  273    HA   HIS  36           HA       HIS  36  15.087  10.326  18.879
  274    HB2  HIS  36           HB2      HIS  36  17.360   9.223  19.256
  275    HB3  HIS  36           HB3      HIS  36  16.496   7.902  20.049
  276    HD1  HIS  36           HD1      HIS  36  17.458   9.143  16.699
  277    HD2  HIS  36           HD2      HIS  36  14.502   6.659  18.346
  278    HE1  HIS  36           HE1      HIS  36  16.442   7.901  14.766
  279    H    GLN  37           H        GLN  37  14.810   8.242  21.838
  280    HA   GLN  37           HA       GLN  37  12.665   6.686  20.862
  281    HB2  GLN  37           HB2      GLN  37  13.324   7.448  23.737
  282    HB3  GLN  37           HB3      GLN  37  12.138   6.231  23.271
  283    HG2  GLN  37           HG2      GLN  37  15.134   6.125  22.801
  284    HG3  GLN  37           HG3      GLN  37  14.183   5.112  23.875
  285   HE21  GLN  37          HE21      GLN  37  12.320   3.823  22.620
  286   HE22  GLN  37          HE22      GLN  37  12.845   3.140  21.087
  287    H    GLU  38           H        GLU  38  12.419   9.800  22.699
  288    HA   GLU  38           HA       GLU  38   9.531   9.761  22.653
  289    HB2  GLU  38           HB2      GLU  38  11.349  12.194  22.814
  290    HB3  GLU  38           HB3      GLU  38   9.638  12.122  23.220
  291    HG2  GLU  38           HG2      GLU  38  11.974  10.934  24.723
  292    HG3  GLU  38           HG3      GLU  38  10.805  12.111  25.275
  293    H    LYS  39           H        LYS  39  11.885  11.278  20.372
  294    HA   LYS  39           HA       LYS  39   9.826  12.517  18.780
  295    HB2  LYS  39           HB2      LYS  39  12.427  12.965  18.988
  296    HB3  LYS  39           HB3      LYS  39  12.560  11.813  17.673
  297    HG2  LYS  39           HG2      LYS  39  11.131  14.503  17.716
  298    HG3  LYS  39           HG3      LYS  39  12.599  14.074  16.863
  299    HD2  LYS  39           HD2      LYS  39  11.226  13.977  15.070
  300    HD3  LYS  39           HD3      LYS  39  10.985  12.331  15.619
  301    HE2  LYS  39           HE2      LYS  39   8.814  13.161  15.174
  302    HE3  LYS  39           HE3      LYS  39   8.942  13.204  16.930
  303    HZ1  LYS  39           HZ1      LYS  39   9.456  15.605  16.737
  304    HZ2  LYS  39           HZ2      LYS  39   8.007  15.273  16.069
  305    HZ3  LYS  39           HZ3      LYS  39   9.301  15.535  15.113
  306    H    CYS  40           H        CYS  40  11.714   9.526  18.262
  307    HA   CYS  40           HA       CYS  40  10.589   8.747  15.786
  308    HB2  CYS  40           HB2      CYS  40  12.708   8.069  17.094
  309    HB3  CYS  40           HB3      CYS  40  11.693   6.909  17.947
  310    H    ARG  41           H        ARG  41   9.613   7.950  19.160
  311    HA   ARG  41           HA       ARG  41   7.322   6.347  18.547
  312    HB2  ARG  41           HB2      ARG  41   8.357   6.477  20.787
  313    HB3  ARG  41           HB3      ARG  41   7.884   8.173  20.927
  314    HG2  ARG  41           HG2      ARG  41   6.418   6.790  22.245
  315    HG3  ARG  41           HG3      ARG  41   5.490   7.505  20.924
  316    HD2  ARG  41           HD2      ARG  41   5.609   5.385  19.665
  317    HD3  ARG  41           HD3      ARG  41   6.660   4.691  20.920
  318    HE   ARG  41           HE       ARG  41   4.165   5.630  22.039
  319   HH11  ARG  41          HH11      ARG  41   5.472   2.917  20.249
  320   HH12  ARG  41          HH12      ARG  41   4.254   1.819  20.842
  321   HH21  ARG  41          HH21      ARG  41   2.635   4.181  22.750
  322   HH22  ARG  41          HH22      ARG  41   2.689   2.526  22.217
  323    H    TRP  42           H        TRP  42   7.505   9.908  19.168
  324    HA   TRP  42           HA       TRP  42   4.736  10.411  18.718
  325    HB2  TRP  42           HB2      TRP  42   6.331  12.001  19.754
  326    HB3  TRP  42           HB3      TRP  42   7.100  12.249  18.193
  327    HD1  TRP  42           HD1      TRP  42   4.141  13.270  20.269
  328    HE1  TRP  42           HE1      TRP  42   2.762  15.087  19.092
  329    HE3  TRP  42           HE3      TRP  42   6.378  13.141  15.652
  330    HZ2  TRP  42           HZ2      TRP  42   2.613  16.296  16.478
  331    HZ3  TRP  42           HZ3      TRP  42   5.578  14.627  13.831
  332    HH2  TRP  42           HH2      TRP  42   3.702  16.205  14.230
  333    H    LEU  43           H        LEU  43   7.460  10.389  16.399
  334    HA   LEU  43           HA       LEU  43   5.965  11.219  14.124
  335    HB2  LEU  43           HB2      LEU  43   8.527  11.057  14.626
  336    HB3  LEU  43           HB3      LEU  43   8.420   9.430  13.979
  337    HG   LEU  43           HG       LEU  43   7.500  11.938  12.488
  338   HD11  LEU  43          HD11      LEU  43  10.202  10.537  12.369
  339   HD12  LEU  43          HD12      LEU  43   9.883  12.145  13.051
  340   HD13  LEU  43          HD13      LEU  43   9.670  11.872  11.320
  341   HD21  LEU  43          HD21      LEU  43   8.250   9.153  11.487
  342   HD22  LEU  43          HD22      LEU  43   7.866  10.550  10.459
  343   HD23  LEU  43          HD23      LEU  43   6.617   9.863  11.498
  344    H    ALA  44           H        ALA  44   6.819   7.875  15.218
  345    HA   ALA  44           HA       ALA  44   5.300   6.521  13.211
  346    HB1  ALA  44           HB1      ALA  44   5.548   4.579  14.712
  347    HB2  ALA  44           HB2      ALA  44   7.075   5.474  14.577
  348    HB3  ALA  44           HB3      ALA  44   6.068   5.649  16.032
  349    H    SER  45           H        SER  45   4.304   7.781  16.414
  350    HA   SER  45           HA       SER  45   1.653   6.667  16.404
  351    HB2  SER  45           HB2      SER  45   2.883   7.569  18.396
  352    HB3  SER  45           HB3      SER  45   2.653   9.205  17.756
  353    HG   SER  45           HG       SER  45   0.730   7.360  18.733
  354    H    SER  46           H        SER  46   2.913   9.836  15.287
  355    HA   SER  46           HA       SER  46   0.411  10.902  14.352
  356    HB2  SER  46           HB2      SER  46   2.427  12.236  14.922
  357    HB3  SER  46           HB3      SER  46   3.265  11.556  13.513
  358    HG   SER  46           HG       SER  46   2.280  13.622  13.116
  359    H    LYS  47           H        LYS  47   2.988   9.057  12.742
  360    HA   LYS  47           HA       LYS  47   1.338   8.720  10.257
  361    HB2  LYS  47           HB2      LYS  47   4.350   8.803  10.678
  362    HB3  LYS  47           HB3      LYS  47   3.585   8.193   9.212
  363    HG2  LYS  47           HG2      LYS  47   2.529  10.335   8.769
  364    HG3  LYS  47           HG3      LYS  47   3.230  11.032  10.249
  365    HD2  LYS  47           HD2      LYS  47   5.474  10.786   9.413
  366    HD3  LYS  47           HD3      LYS  47   4.944   9.743   8.079
  367    HE2  LYS  47           HE2      LYS  47   3.682  11.632   7.092
  368    HE3  LYS  47           HE3      LYS  47   4.246  12.692   8.393
  369    HZ1  LYS  47           HZ1      LYS  47   6.526  12.313   7.628
  370    HZ2  LYS  47           HZ2      LYS  47   5.632  12.871   6.384
  371    HZ3  LYS  47           HZ3      LYS  47   6.022  11.290   6.458
  372    H    GLY  48           H        GLY  48   0.236   7.082  11.601
  373    HA2  GLY  48           HA2      GLY  48   1.280   4.519  12.229
  374    HA3  GLY  48           HA3      GLY  48  -0.363   4.845  11.669
  375    H    LYS  49           H        LYS  49   2.525   3.313  10.916
  376    HA   LYS  49           HA       LYS  49   2.649   3.416   8.059
  377    HB2  LYS  49           HB2      LYS  49   3.621   1.481  10.190
  378    HB3  LYS  49           HB3      LYS  49   3.787   1.042   8.501
  379    HG2  LYS  49           HG2      LYS  49   4.903   3.632   9.649
  380    HG3  LYS  49           HG3      LYS  49   5.808   2.117   9.522
  381    HD2  LYS  49           HD2      LYS  49   5.365   2.094   7.045
  382    HD3  LYS  49           HD3      LYS  49   4.659   3.706   7.175
  383    HE2  LYS  49           HE2      LYS  49   7.504   2.960   7.989
  384    HE3  LYS  49           HE3      LYS  49   7.055   3.640   6.423
  385    HZ1  LYS  49           HZ1      LYS  49   6.227   5.618   7.581
  386    HZ2  LYS  49           HZ2      LYS  49   7.805   5.380   7.912
  387    HZ3  LYS  49           HZ3      LYS  49   6.675   5.008   9.033
  388    H    GLN  50           H        GLN  50   2.322   1.578   6.598
  389    HA   GLN  50           HA       GLN  50  -0.436   0.885   6.468
  390    HB2  GLN  50           HB2      GLN  50   1.485   1.086   4.616
  391    HB3  GLN  50           HB3      GLN  50   1.667  -0.637   4.915
  392    HG2  GLN  50           HG2      GLN  50   0.155  -0.380   3.078
  393    HG3  GLN  50           HG3      GLN  50  -0.831  -0.886   4.452
  394   HE21  GLN  50          HE21      GLN  50   0.219   2.062   2.611
  395   HE22  GLN  50          HE22      GLN  50  -1.230   2.976   3.003
  396    H    VAL  51           H        VAL  51  -1.472  -0.537   7.673
  397    HA   VAL  51           HA       VAL  51  -0.201  -3.130   8.484
  398    HB   VAL  51           HB       VAL  51  -1.573  -3.057  10.541
  399   HG11  VAL  51          HG11      VAL  51   0.309  -0.693  10.290
  400   HG12  VAL  51          HG12      VAL  51  -0.180  -1.518  11.779
  401   HG13  VAL  51          HG13      VAL  51   0.789  -2.376  10.570
  402   HG21  VAL  51          HG21      VAL  51  -2.577  -0.987  11.330
  403   HG22  VAL  51          HG22      VAL  51  -2.131  -0.142   9.838
  404   HG23  VAL  51          HG23      VAL  51  -3.334  -1.453   9.802
  405    H    ARG  52           H        ARG  52  -2.038  -2.227   6.205
  406    HA   ARG  52           HA       ARG  52  -4.495  -3.717   6.375
  407    HB2  ARG  52           HB2      ARG  52  -2.732  -2.898   4.017
  408    HB3  ARG  52           HB3      ARG  52  -4.267  -3.758   3.839
  409    HG2  ARG  52           HG2      ARG  52  -5.408  -1.926   5.116
  410    HG3  ARG  52           HG3      ARG  52  -3.910  -0.991   5.073
  411    HD2  ARG  52           HD2      ARG  52  -5.260  -2.047   2.541
  412    HD3  ARG  52           HD3      ARG  52  -5.741  -0.542   3.302
  413    HE   ARG  52           HE       ARG  52  -3.722   0.492   2.763
  414   HH11  ARG  52          HH11      ARG  52  -3.546  -2.810   1.574
  415   HH12  ARG  52          HH12      ARG  52  -2.285  -2.413   0.439
  416   HH21  ARG  52          HH21      ARG  52  -2.233   0.935   1.194
  417   HH22  ARG  52          HH22      ARG  52  -1.580  -0.351   0.224
  418    H    ASN  53           H        ASN  53  -5.032  -5.654   5.401
  419    HA   ASN  53           HA       ASN  53  -2.935  -7.703   4.984
  420    HB2  ASN  53           HB2      ASN  53  -4.184  -9.284   6.452
  421    HB3  ASN  53           HB3      ASN  53  -3.460  -7.947   7.330
  422   HD21  ASN  53          HD21      ASN  53  -4.839  -6.383   8.351
  423   HD22  ASN  53          HD22      ASN  53  -6.562  -6.690   8.517
  424    H    PHE  54           H        PHE  54  -3.554  -9.370   3.626
  425    HA   PHE  54           HA       PHE  54  -6.141  -9.112   2.166
  426    HB2  PHE  54           HB2      PHE  54  -4.382  -7.740   1.055
  427    HB3  PHE  54           HB3      PHE  54  -3.365  -9.165   0.912
  428    HD1  PHE  54           HD1      PHE  54  -6.537  -7.562  -0.211
  429    HD2  PHE  54           HD2      PHE  54  -3.766 -10.809  -0.845
  430    HE1  PHE  54           HE1      PHE  54  -7.661  -8.105  -2.360
  431    HE2  PHE  54           HE2      PHE  54  -4.894 -11.348  -2.993
  432    HZ   PHE  54           HZ       PHE  54  -6.845 -10.002  -3.750
  433    H    SER  55           H        SER  55  -7.019 -11.004   1.647
  434    HA   SER  55           HA       SER  55  -5.573 -13.544   2.311
  435    HB2  SER  55           HB2      SER  55  -7.230 -12.712   4.010
  436    HB3  SER  55           HB3      SER  55  -8.502 -12.888   2.786
  437    HG   SER  55           HG       SER  55  -8.292 -14.790   4.092
  Start of MODEL   11
    1    H1   GLY   1           H1       GLY   1  12.318   9.582   2.724
    2    H2   GLY   1           H2       GLY   1  11.471  10.474   3.805
    3    H3   GLY   1           H3       GLY   1  10.947  10.348   2.255
    4    HA2  GLY   1           HA2      GLY   1  11.069   8.150   4.215
    5    HA3  GLY   1           HA3      GLY   1   9.594   8.967   3.670
    6    H    SER   2           H        SER   2  11.222   6.189   3.324
    7    HA   SER   2           HA       SER   2  10.189   5.573   0.614
    8    HB2  SER   2           HB2      SER   2  13.101   5.116   1.401
    9    HB3  SER   2           HB3      SER   2  12.341   4.665  -0.131
   10    HG   SER   2           HG       SER   2  11.986   6.940  -0.496
   11    H    GLU   3           H        GLU   3  10.409   3.193   0.153
   12    HA   GLU   3           HA       GLU   3   9.810   1.461   2.396
   13    HB2  GLU   3           HB2      GLU   3  10.676   0.883  -0.468
   14    HB3  GLU   3           HB3      GLU   3  10.261  -0.365   0.714
   15    HG2  GLU   3           HG2      GLU   3   8.001   0.631   0.988
   16    HG3  GLU   3           HG3      GLU   3   8.385   1.838  -0.241
   17    H    PHE   4           H        PHE   4  11.081  -0.159   3.342
   18    HA   PHE   4           HA       PHE   4  13.849   0.448   3.867
   19    HB2  PHE   4           HB2      PHE   4  13.772  -1.702   5.126
   20    HB3  PHE   4           HB3      PHE   4  12.525  -0.556   5.569
   21    HD1  PHE   4           HD1      PHE   4  13.160  -3.728   3.691
   22    HD2  PHE   4           HD2      PHE   4  10.187  -1.089   5.372
   23    HE1  PHE   4           HE1      PHE   4  11.408  -5.443   3.297
   24    HE2  PHE   4           HE2      PHE   4   8.440  -2.807   4.973
   25    HZ   PHE   4           HZ       PHE   4   9.046  -4.984   3.933
   26    H    THR   5           H        THR   5  15.649  -1.025   3.569
   27    HA   THR   5           HA       THR   5  15.628  -2.712   1.111
   28    HB   THR   5           HB       THR   5  17.706  -1.652   0.338
   29    HG1  THR   5           HG1      THR   5  18.289   0.359   1.262
   30   HG21  THR   5          HG21      THR   5  15.531  -0.815  -0.552
   31   HG22  THR   5          HG22      THR   5  16.820   0.399  -0.568
   32   HG23  THR   5          HG23      THR   5  15.553   0.472   0.674
   33    H    SER   6           H        SER   6  17.808  -3.842   0.847
   34    HA   SER   6           HA       SER   6  18.331  -5.443   3.151
   35    HB2  SER   6           HB2      SER   6  20.110  -6.429   1.685
   36    HB3  SER   6           HB3      SER   6  18.497  -6.370   0.954
   37    HG   SER   6           HG       SER   6  20.108  -5.638  -0.502
   38    H    SER   7           H        SER   7  19.795  -2.464   2.165
   39    HA   SER   7           HA       SER   7  21.728  -1.365   2.682
   40    HB2  SER   7           HB2      SER   7  20.023  -1.000   4.491
   41    HB3  SER   7           HB3      SER   7  20.953  -2.113   5.508
   42    HG   SER   7           HG       SER   7  21.561   0.100   5.800
   43    HA   PRO   8           HA       PRO   8  24.342  -5.211   3.319
   44    HB2  PRO   8           HB2      PRO   8  25.813  -5.154   1.002
   45    HB3  PRO   8           HB3      PRO   8  24.177  -5.867   1.124
   46    HG2  PRO   8           HG2      PRO   8  24.929  -3.096   0.144
   47    HG3  PRO   8           HG3      PRO   8  23.829  -4.285  -0.625
   48    HD2  PRO   8           HD2      PRO   8  22.892  -2.247   0.918
   49    HD3  PRO   8           HD3      PRO   8  22.126  -3.862   0.942
   50    H    ARG   9           H        ARG   9  26.067  -5.062   4.576
   51    HA   ARG   9           HA       ARG   9  28.344  -3.285   4.106
   52    HB2  ARG   9           HB2      ARG   9  26.539  -1.875   5.228
   53    HB3  ARG   9           HB3      ARG   9  26.668  -2.913   6.643
   54    HG2  ARG   9           HG2      ARG   9  28.908  -2.176   7.091
   55    HG3  ARG   9           HG3      ARG   9  29.082  -1.453   5.483
   56    HD2  ARG   9           HD2      ARG   9  27.133  -0.487   7.618
   57    HD3  ARG   9           HD3      ARG   9  28.732   0.201   7.363
   58    HE   ARG   9           HE       ARG   9  26.337   0.607   5.729
   59   HH11  ARG   9          HH11      ARG   9  29.834   0.905   5.653
   60   HH12  ARG   9          HH12      ARG   9  29.796   1.997   4.296
   61   HH21  ARG   9          HH21      ARG   9  26.371   1.993   4.003
   62   HH22  ARG   9          HH22      ARG   9  27.886   2.598   3.398
   63    H    GLY  10           H        GLY  10  30.099  -3.684   5.664
   64    HA2  GLY  10           HA2      GLY  10  30.498  -6.436   6.379
   65    HA3  GLY  10           HA3      GLY  10  31.510  -5.077   6.859
   66    H    ASP  11           H        ASP  11  30.988  -7.268   8.527
   67    HA   ASP  11           HA       ASP  11  28.858  -6.763  10.410
   68    HB2  ASP  11           HB2      ASP  11  29.813  -8.995   9.947
   69    HB3  ASP  11           HB3      ASP  11  31.357  -8.487  10.637
   70    H    LYS  12           H        LYS  12  28.814  -5.608  12.239
   71    HA   LYS  12           HA       LYS  12  31.303  -4.551  13.497
   72    HB2  LYS  12           HB2      LYS  12  30.566  -2.845  11.881
   73    HB3  LYS  12           HB3      LYS  12  28.951  -2.843  12.580
   74    HG2  LYS  12           HG2      LYS  12  30.184  -0.890  13.307
   75    HG3  LYS  12           HG3      LYS  12  29.832  -1.921  14.688
   76    HD2  LYS  12           HD2      LYS  12  32.199  -2.795  14.604
   77    HD3  LYS  12           HD3      LYS  12  32.494  -1.757  13.207
   78    HE2  LYS  12           HE2      LYS  12  33.408  -0.637  15.090
   79    HE3  LYS  12           HE3      LYS  12  31.949   0.246  14.633
   80    HZ1  LYS  12           HZ1      LYS  12  32.123  -0.128  17.049
   81    HZ2  LYS  12           HZ2      LYS  12  32.110  -1.747  16.843
   82    HZ3  LYS  12           HZ3      LYS  12  30.787  -0.859  16.466
   83    H    ALA  13           H        ALA  13  27.829  -5.146  13.843
   84    HA   ALA  13           HA       ALA  13  26.466  -5.324  15.648
   85    HB1  ALA  13           HB1      ALA  13  27.645  -7.466  15.473
   86    HB2  ALA  13           HB2      ALA  13  28.866  -6.903  16.637
   87    HB3  ALA  13           HB3      ALA  13  27.178  -7.117  17.146
   88    H    ALA  14           H        ALA  14  27.306  -2.804  15.830
   89    HA   ALA  14           HA       ALA  14  28.646  -2.018  18.209
   90    HB1  ALA  14           HB1      ALA  14  27.935   0.232  17.554
   91    HB2  ALA  14           HB2      ALA  14  28.421  -0.672  16.111
   92    HB3  ALA  14           HB3      ALA  14  26.698  -0.438  16.471
   93    H    TYR  15           H        TYR  15  25.716  -3.519  18.330
   94    HA   TYR  15           HA       TYR  15  23.967  -1.790  19.658
   95    HB2  TYR  15           HB2      TYR  15  22.615  -3.675  20.067
   96    HB3  TYR  15           HB3      TYR  15  23.368  -3.889  18.506
   97    HD1  TYR  15           HD2      TYR  15  23.123  -5.129  21.965
   98    HD2  TYR  15           HD1      TYR  15  25.037  -5.705  18.139
   99    HE1  TYR  15           HE2      TYR  15  23.865  -7.402  22.671
  100    HE2  TYR  15           HE1      TYR  15  25.785  -7.966  18.857
  101    HH   TYR  15           HH       TYR  15  25.792  -9.531  20.523
  102    H    ASP  16           H        ASP  16  26.767  -3.148  21.076
  103    HA   ASP  16           HA       ASP  16  25.763  -2.962  23.853
  104    HB2  ASP  16           HB2      ASP  16  27.177  -4.863  22.998
  105    HB3  ASP  16           HB3      ASP  16  28.511  -3.724  22.811
  106    H    ILE  17           H        ILE  17  27.044  -0.758  21.655
  107    HA   ILE  17           HA       ILE  17  27.955   1.083  23.831
  108    HB   ILE  17           HB       ILE  17  29.958   0.231  22.856
  109   HG12  ILE  17          HG12      ILE  17  29.448   3.050  21.809
  110   HG13  ILE  17          HG13      ILE  17  29.851   2.621  23.474
  111   HG21  ILE  17          HG21      ILE  17  28.937   1.072  20.107
  112   HG22  ILE  17          HG22      ILE  17  30.551   0.438  20.472
  113   HG23  ILE  17          HG23      ILE  17  29.153  -0.592  20.688
  114   HD11  ILE  17          HD11      ILE  17  32.039   1.678  22.613
  115   HD12  ILE  17          HD12      ILE  17  31.624   2.360  21.018
  116   HD13  ILE  17          HD13      ILE  17  31.831   3.430  22.409
  117    H    LEU  18           H        LEU  18  26.405   0.734  20.683
  118    HA   LEU  18           HA       LEU  18  25.186   3.445  20.964
  119    HB2  LEU  18           HB2      LEU  18  26.207   2.142  18.406
  120    HB3  LEU  18           HB3      LEU  18  25.357   3.676  18.496
  121    HG   LEU  18           HG       LEU  18  28.133   3.159  19.649
  122   HD11  LEU  18          HD11      LEU  18  28.946   4.488  17.784
  123   HD12  LEU  18          HD12      LEU  18  27.295   4.694  17.163
  124   HD13  LEU  18          HD13      LEU  18  28.056   3.086  17.176
  125   HD21  LEU  18          HD21      LEU  18  28.239   5.674  19.719
  126   HD22  LEU  18          HD22      LEU  18  27.138   4.955  20.881
  127   HD23  LEU  18          HD23      LEU  18  26.489   5.711  19.402
  128    H    ARG  19           H        ARG  19  23.199   3.597  19.594
  129    HA   ARG  19           HA       ARG  19  21.934   0.989  18.834
  130    HB2  ARG  19           HB2      ARG  19  20.955   1.830  20.995
  131    HB3  ARG  19           HB3      ARG  19  20.562   3.342  20.186
  132    HG2  ARG  19           HG2      ARG  19  18.536   2.114  20.267
  133    HG3  ARG  19           HG3      ARG  19  19.060   2.029  18.605
  134    HD2  ARG  19           HD2      ARG  19  18.373  -0.166  19.073
  135    HD3  ARG  19           HD3      ARG  19  20.117  -0.271  19.237
  136    HE   ARG  19           HE       ARG  19  19.903  -0.595  21.547
  137   HH11  ARG  19          HH11      ARG  19  16.728   0.202  20.283
  138   HH12  ARG  19          HH12      ARG  19  15.930  -0.232  21.768
  139   HH21  ARG  19          HH21      ARG  19  18.813  -1.111  23.416
  140   HH22  ARG  19          HH22      ARG  19  17.085  -0.939  23.492
  141    H    ARG  20           H        ARG  20  20.731   1.052  16.962
  142    HA   ARG  20           HA       ARG  20  20.964   3.510  15.257
  143    HB2  ARG  20           HB2      ARG  20  21.018   0.652  14.223
  144    HB3  ARG  20           HB3      ARG  20  21.364   2.138  13.356
  145    HG2  ARG  20           HG2      ARG  20  23.547   1.749  13.733
  146    HG3  ARG  20           HG3      ARG  20  23.268   2.187  15.412
  147    HD2  ARG  20           HD2      ARG  20  24.357   0.114  15.518
  148    HD3  ARG  20           HD3      ARG  20  22.653  -0.274  15.819
  149    HE   ARG  20           HE       ARG  20  23.289  -0.456  13.002
  150   HH11  ARG  20          HH11      ARG  20  23.658  -2.312  15.945
  151   HH12  ARG  20          HH12      ARG  20  23.837  -3.815  15.075
  152   HH21  ARG  20          HH21      ARG  20  23.573  -2.386  11.962
  153   HH22  ARG  20          HH22      ARG  20  23.829  -3.842  12.876
  154    H    CYS  21           H        CYS  21  19.169   4.206  14.278
  155    HA   CYS  21           HA       CYS  21  16.605   2.908  14.975
  156    HB2  CYS  21           HB2      CYS  21  17.100   5.284  15.492
  157    HB3  CYS  21           HB3      CYS  21  17.254   5.608  13.760
  158    H    SER  22           H        SER  22  15.699   1.530  13.588
  159    HA   SER  22           HA       SER  22  16.596   1.003  10.947
  160    HB2  SER  22           HB2      SER  22  14.673  -0.550  10.848
  161    HB3  SER  22           HB3      SER  22  15.610  -0.710  12.341
  162    HG   SER  22           HG       SER  22  13.323  -0.666  12.704
  163    H    GLN  23           H        GLN  23  14.597   3.546  11.863
  164    HA   GLN  23           HA       GLN  23  13.585   3.895   9.077
  165    HB2  GLN  23           HB2      GLN  23  11.509   4.803   9.955
  166    HB3  GLN  23           HB3      GLN  23  11.761   3.138  10.469
  167    HG2  GLN  23           HG2      GLN  23  12.552   3.963  12.697
  168    HG3  GLN  23           HG3      GLN  23  12.197   5.619  12.191
  169   HE21  GLN  23          HE21      GLN  23  11.020   3.788  14.372
  170   HE22  GLN  23          HE22      GLN  23   9.291   3.874  14.065
  171    H    CYS  24           H        CYS  24  15.740   5.159  11.193
  172    HA   CYS  24           HA       CYS  24  15.491   7.905  10.024
  173    HB2  CYS  24           HB2      CYS  24  16.503   7.284  12.809
  174    HB3  CYS  24           HB3      CYS  24  16.246   8.867  12.089
  175    H    GLY  25           H        GLY  25  17.679   5.264  10.956
  176    HA2  GLY  25           HA2      GLY  25  19.769   4.750  10.196
  177    HA3  GLY  25           HA3      GLY  25  19.742   6.171   9.153
  178    H    ILE  26           H        ILE  26  19.208   7.476  12.115
  179    HA   ILE  26           HA       ILE  26  21.915   8.376  12.568
  180    HB   ILE  26           HB       ILE  26  19.936   9.759  13.004
  181   HG12  ILE  26          HG12      ILE  26  20.457  10.712  15.177
  182   HG13  ILE  26          HG13      ILE  26  21.412   9.311  15.624
  183   HG21  ILE  26          HG21      ILE  26  19.299   7.836  15.284
  184   HG22  ILE  26          HG22      ILE  26  18.504   9.390  14.981
  185   HG23  ILE  26          HG23      ILE  26  18.346   8.081  13.813
  186   HD11  ILE  26          HD11      ILE  26  23.063   9.863  13.846
  187   HD12  ILE  26          HD12      ILE  26  22.042  11.227  13.334
  188   HD13  ILE  26          HD13      ILE  26  22.805  11.232  14.937
  189    H    LEU  27           H        LEU  27  23.163   8.077  14.510
  190    HA   LEU  27           HA       LEU  27  22.677   5.571  16.046
  191    HB2  LEU  27           HB2      LEU  27  25.359   6.647  15.064
  192    HB3  LEU  27           HB3      LEU  27  25.140   5.409  16.288
  193    HG   LEU  27           HG       LEU  27  23.757   4.155  14.430
  194   HD11  LEU  27          HD11      LEU  27  24.705   4.458  12.171
  195   HD12  LEU  27          HD12      LEU  27  25.609   5.883  12.733
  196   HD13  LEU  27          HD13      LEU  27  23.835   5.899  12.687
  197   HD21  LEU  27          HD21      LEU  27  25.846   3.337  15.454
  198   HD22  LEU  27          HD22      LEU  27  26.798   4.380  14.374
  199   HD23  LEU  27          HD23      LEU  27  25.851   3.030  13.713
  200    H    LEU  28           H        LEU  28  22.500   5.901  18.159
  201    HA   LEU  28           HA       LEU  28  23.629   8.388  19.398
  202    HB2  LEU  28           HB2      LEU  28  21.045   6.964  20.157
  203    HB3  LEU  28           HB3      LEU  28  21.758   8.323  20.987
  204    HG   LEU  28           HG       LEU  28  19.992   9.246  19.884
  205   HD11  LEU  28          HD11      LEU  28  20.821  10.809  18.281
  206   HD12  LEU  28          HD12      LEU  28  22.207   9.781  17.890
  207   HD13  LEU  28          HD13      LEU  28  22.086  10.531  19.492
  208   HD21  LEU  28          HD21      LEU  28  20.690   7.804  17.313
  209   HD22  LEU  28          HD22      LEU  28  19.341   8.922  17.575
  210   HD23  LEU  28          HD23      LEU  28  19.388   7.378  18.439
  211    HA   PRO  29           HA       PRO  29  25.567   5.456  22.154
  212    HB2  PRO  29           HB2      PRO  29  26.257   7.040  24.289
  213    HB3  PRO  29           HB3      PRO  29  27.057   7.101  22.695
  214    HG2  PRO  29           HG2      PRO  29  24.882   8.938  23.739
  215    HG3  PRO  29           HG3      PRO  29  26.394   9.370  22.889
  216    HD2  PRO  29           HD2      PRO  29  23.990   9.175  21.601
  217    HD3  PRO  29           HD3      PRO  29  25.525   8.723  20.812
  218    H    LEU  30           H        LEU  30  23.835   7.531  24.472
  219    HA   LEU  30           HA       LEU  30  21.864   5.518  25.210
  220    HB2  LEU  30           HB2      LEU  30  24.490   5.577  26.533
  221    HB3  LEU  30           HB3      LEU  30  23.206   5.863  27.690
  222    HG   LEU  30           HG       LEU  30  23.067   3.511  25.769
  223   HD11  LEU  30          HD11      LEU  30  24.001   2.130  27.574
  224   HD12  LEU  30          HD12      LEU  30  24.321   3.592  28.540
  225   HD13  LEU  30          HD13      LEU  30  25.173   3.325  27.001
  226   HD21  LEU  30          HD21      LEU  30  20.978   4.164  26.955
  227   HD22  LEU  30          HD22      LEU  30  21.832   4.016  28.507
  228   HD23  LEU  30          HD23      LEU  30  21.587   2.587  27.480
  229    HA   PRO  31           HA       PRO  31  21.051   9.377  27.881
  230    HB2  PRO  31           HB2      PRO  31  22.772  11.495  28.068
  231    HB3  PRO  31           HB3      PRO  31  22.944  10.006  29.044
  232    HG2  PRO  31           HG2      PRO  31  24.342  10.678  26.430
  233    HG3  PRO  31           HG3      PRO  31  25.086  10.140  27.972
  234    HD2  PRO  31           HD2      PRO  31  24.553   8.378  26.010
  235    HD3  PRO  31           HD3      PRO  31  24.261   7.947  27.714
  236    H    ILE  32           H        ILE  32  21.974   9.495  24.666
  237    HA   ILE  32           HA       ILE  32  20.267  11.887  24.064
  238    HB   ILE  32           HB       ILE  32  22.358  10.617  22.266
  239   HG12  ILE  32          HG12      ILE  32  22.639  13.150  23.951
  240   HG13  ILE  32          HG13      ILE  32  23.441  11.619  24.290
  241   HG21  ILE  32          HG21      ILE  32  20.572  11.869  21.066
  242   HG22  ILE  32          HG22      ILE  32  20.886  13.290  22.083
  243   HG23  ILE  32          HG23      ILE  32  22.105  12.697  20.936
  244   HD11  ILE  32          HD11      ILE  32  25.047  13.016  23.263
  245   HD12  ILE  32          HD12      ILE  32  24.623  11.754  22.092
  246   HD13  ILE  32          HD13      ILE  32  23.981  13.408  21.909
  247    H    LEU  33           H        LEU  33  20.638   8.418  23.654
  248    HA   LEU  33           HA       LEU  33  18.935   7.947  21.442
  249    HB2  LEU  33           HB2      LEU  33  20.401   6.235  22.446
  250    HB3  LEU  33           HB3      LEU  33  19.463   6.285  23.938
  251    HG   LEU  33           HG       LEU  33  17.467   5.413  22.739
  252   HD11  LEU  33          HD11      LEU  33  19.345   5.255  20.344
  253   HD12  LEU  33          HD12      LEU  33  17.853   6.207  20.463
  254   HD13  LEU  33          HD13      LEU  33  17.764   4.449  20.456
  255   HD21  LEU  33          HD21      LEU  33  18.329   3.133  22.410
  256   HD22  LEU  33          HD22      LEU  33  18.971   3.884  23.875
  257   HD23  LEU  33          HD23      LEU  33  19.997   3.765  22.434
  258    H    ASN  34           H        ASN  34  18.116   8.371  24.912
  259    HA   ASN  34           HA       ASN  34  15.349   7.836  24.724
  260    HB2  ASN  34           HB2      ASN  34  15.175   9.334  26.757
  261    HB3  ASN  34           HB3      ASN  34  16.322   8.008  26.866
  262   HD21  ASN  34          HD21      ASN  34  16.058  11.561  26.664
  263   HD22  ASN  34          HD22      ASN  34  17.755  11.817  27.059
  264    H    GLN  35           H        GLN  35  17.015  10.964  24.009
  265    HA   GLN  35           HA       GLN  35  14.557  12.392  23.557
  266    HB2  GLN  35           HB2      GLN  35  16.749  13.459  24.067
  267    HB3  GLN  35           HB3      GLN  35  17.328  13.010  22.453
  268    HG2  GLN  35           HG2      GLN  35  15.536  14.374  21.416
  269    HG3  GLN  35           HG3      GLN  35  14.869  14.742  23.009
  270   HE21  GLN  35          HE21      GLN  35  16.041  16.264  24.396
  271   HE22  GLN  35          HE22      GLN  35  17.279  17.296  23.694
  272    H    HIS  36           H        HIS  36  16.736  10.583  21.306
  273    HA   HIS  36           HA       HIS  36  15.137  11.132  18.965
  274    HB2  HIS  36           HB2      HIS  36  17.437  10.147  18.859
  275    HB3  HIS  36           HB3      HIS  36  16.793   8.627  19.488
  276    HD1  HIS  36           HD1      HIS  36  16.442  10.934  16.410
  277    HD2  HIS  36           HD2      HIS  36  15.444   7.066  17.714
  278    HE1  HIS  36           HE1      HIS  36  15.470   9.756  14.396
  279    H    GLN  37           H        GLN  37  15.044   8.438  21.348
  280    HA   GLN  37           HA       GLN  37  13.081   6.933  20.054
  281    HB2  GLN  37           HB2      GLN  37  14.674   6.298  21.918
  282    HB3  GLN  37           HB3      GLN  37  13.530   7.010  23.062
  283    HG2  GLN  37           HG2      GLN  37  11.832   5.376  22.443
  284    HG3  GLN  37           HG3      GLN  37  12.791   4.825  21.061
  285   HE21  GLN  37          HE21      GLN  37  14.973   3.798  21.575
  286   HE22  GLN  37          HE22      GLN  37  15.081   2.887  23.075
  287    H    GLU  38           H        GLU  38  12.531   9.540  22.509
  288    HA   GLU  38           HA       GLU  38   9.656   9.229  22.502
  289    HB2  GLU  38           HB2      GLU  38  11.273  11.760  23.010
  290    HB3  GLU  38           HB3      GLU  38   9.564  11.527  23.356
  291    HG2  GLU  38           HG2      GLU  38  11.935  10.298  24.764
  292    HG3  GLU  38           HG3      GLU  38  10.693  11.337  25.420
  293    H    LYS  39           H        LYS  39  11.767  11.365  20.489
  294    HA   LYS  39           HA       LYS  39   9.570  12.568  19.063
  295    HB2  LYS  39           HB2      LYS  39  11.662  13.733  19.163
  296    HB3  LYS  39           HB3      LYS  39  12.557  12.345  18.554
  297    HG2  LYS  39           HG2      LYS  39  12.409  14.062  16.844
  298    HG3  LYS  39           HG3      LYS  39  11.595  12.595  16.339
  299    HD2  LYS  39           HD2      LYS  39   9.445  13.950  17.355
  300    HD3  LYS  39           HD3      LYS  39  10.461  15.320  16.934
  301    HE2  LYS  39           HE2      LYS  39   9.669  13.027  15.076
  302    HE3  LYS  39           HE3      LYS  39   8.842  14.584  15.147
  303    HZ1  LYS  39           HZ1      LYS  39  11.689  14.226  14.365
  304    HZ2  LYS  39           HZ2      LYS  39  10.899  15.657  14.420
  305    HZ3  LYS  39           HZ3      LYS  39  10.460  14.523  13.336
  306    H    CYS  40           H        CYS  40  11.695   9.865  18.210
  307    HA   CYS  40           HA       CYS  40  10.698   9.292  15.628
  308    HB2  CYS  40           HB2      CYS  40  12.832   8.607  16.891
  309    HB3  CYS  40           HB3      CYS  40  11.877   7.335  17.651
  310    H    ARG  41           H        ARG  41   9.776   7.956  18.849
  311    HA   ARG  41           HA       ARG  41   7.565   6.362  17.940
  312    HB2  ARG  41           HB2      ARG  41   8.716   6.108  20.127
  313    HB3  ARG  41           HB3      ARG  41   8.010   7.641  20.674
  314    HG2  ARG  41           HG2      ARG  41   5.741   6.684  20.453
  315    HG3  ARG  41           HG3      ARG  41   6.423   5.190  19.782
  316    HD2  ARG  41           HD2      ARG  41   7.676   4.845  21.917
  317    HD3  ARG  41           HD3      ARG  41   6.908   6.279  22.594
  318    HE   ARG  41           HE       ARG  41   5.704   3.631  22.095
  319   HH11  ARG  41          HH11      ARG  41   4.952   6.952  22.941
  320   HH12  ARG  41          HH12      ARG  41   3.362   6.534  23.516
  321   HH21  ARG  41          HH21      ARG  41   3.673   3.177  22.836
  322   HH22  ARG  41          HH22      ARG  41   2.663   4.450  23.457
  323    H    TRP  42           H        TRP  42   7.628   9.781  19.119
  324    HA   TRP  42           HA       TRP  42   4.830  10.215  18.979
  325    HB2  TRP  42           HB2      TRP  42   6.549  11.754  19.981
  326    HB3  TRP  42           HB3      TRP  42   6.990  12.266  18.358
  327    HD1  TRP  42           HD1      TRP  42   4.476  12.757  21.086
  328    HE1  TRP  42           HE1      TRP  42   2.763  14.568  20.477
  329    HE3  TRP  42           HE3      TRP  42   5.704  13.431  16.143
  330    HZ2  TRP  42           HZ2      TRP  42   1.967  16.051  18.142
  331    HZ3  TRP  42           HZ3      TRP  42   4.421  15.034  14.748
  332    HH2  TRP  42           HH2      TRP  42   2.551  16.342  15.730
  333    H    LEU  43           H        LEU  43   7.300  10.768  16.415
  334    HA   LEU  43           HA       LEU  43   5.472  11.555  14.389
  335    HB2  LEU  43           HB2      LEU  43   7.990  11.820  14.377
  336    HB3  LEU  43           HB3      LEU  43   8.125  10.092  14.062
  337    HG   LEU  43           HG       LEU  43   6.709  10.497  11.944
  338   HD11  LEU  43          HD11      LEU  43   5.793  12.729  12.537
  339   HD12  LEU  43          HD12      LEU  43   6.734  12.800  11.043
  340   HD13  LEU  43          HD13      LEU  43   7.439  13.399  12.560
  341   HD21  LEU  43          HD21      LEU  43   8.627  11.335  10.656
  342   HD22  LEU  43          HD22      LEU  43   9.128  10.136  11.857
  343   HD23  LEU  43          HD23      LEU  43   9.420  11.864  12.158
  344    H    ALA  44           H        ALA  44   6.812   8.267  15.082
  345    HA   ALA  44           HA       ALA  44   5.409   6.909  13.032
  346    HB1  ALA  44           HB1      ALA  44   6.367   5.900  15.746
  347    HB2  ALA  44           HB2      ALA  44   5.951   4.890  14.344
  348    HB3  ALA  44           HB3      ALA  44   7.337   5.995  14.257
  349    H    SER  45           H        SER  45   4.366   7.641  16.379
  350    HA   SER  45           HA       SER  45   1.887   6.196  16.296
  351    HB2  SER  45           HB2      SER  45   3.057   6.970  18.361
  352    HB3  SER  45           HB3      SER  45   2.640   8.641  17.948
  353    HG   SER  45           HG       SER  45   0.887   6.477  18.583
  354    H    SER  46           H        SER  46   2.618   9.690  15.663
  355    HA   SER  46           HA       SER  46  -0.074  10.375  14.922
  356    HB2  SER  46           HB2      SER  46   2.594  11.701  14.323
  357    HB3  SER  46           HB3      SER  46   1.020  12.409  13.920
  358    HG   SER  46           HG       SER  46   0.473  12.401  16.114
  359    H    LYS  47           H        LYS  47   2.613   9.088  12.988
  360    HA   LYS  47           HA       LYS  47   1.254   9.380  10.430
  361    HB2  LYS  47           HB2      LYS  47   3.802   9.287  10.910
  362    HB3  LYS  47           HB3      LYS  47   3.598   7.547  11.048
  363    HG2  LYS  47           HG2      LYS  47   4.246   7.825   8.812
  364    HG3  LYS  47           HG3      LYS  47   2.500   7.716   8.663
  365    HD2  LYS  47           HD2      LYS  47   3.079   9.500   7.265
  366    HD3  LYS  47           HD3      LYS  47   2.482  10.309   8.721
  367    HE2  LYS  47           HE2      LYS  47   4.867  10.555   9.502
  368    HE3  LYS  47           HE3      LYS  47   5.407   9.770   8.013
  369    HZ1  LYS  47           HZ1      LYS  47   4.378  11.613   6.766
  370    HZ2  LYS  47           HZ2      LYS  47   5.518  12.170   7.788
  371    HZ3  LYS  47           HZ3      LYS  47   3.940  12.351   8.157
  372    H    GLY  48           H        GLY  48  -0.590   8.269  12.034
  373    HA2  GLY  48           HA2      GLY  48  -0.724   5.338  11.703
  374    HA3  GLY  48           HA3      GLY  48  -1.874   6.377  12.541
  375    H    LYS  49           H        LYS  49  -1.391   7.782   9.554
  376    HA   LYS  49           HA       LYS  49  -3.476   6.271   8.072
  377    HB2  LYS  49           HB2      LYS  49  -4.421   7.987   9.811
  378    HB3  LYS  49           HB3      LYS  49  -3.839   9.230   8.723
  379    HG2  LYS  49           HG2      LYS  49  -5.908   7.065   8.114
  380    HG3  LYS  49           HG3      LYS  49  -6.224   8.767   8.468
  381    HD2  LYS  49           HD2      LYS  49  -4.837   9.340   6.399
  382    HD3  LYS  49           HD3      LYS  49  -4.901   7.601   6.004
  383    HE2  LYS  49           HE2      LYS  49  -7.382   7.702   6.038
  384    HE3  LYS  49           HE3      LYS  49  -7.295   9.439   6.372
  385    HZ1  LYS  49           HZ1      LYS  49  -6.229   8.102   3.941
  386    HZ2  LYS  49           HZ2      LYS  49  -6.076   9.691   4.255
  387    HZ3  LYS  49           HZ3      LYS  49  -7.562   9.050   3.998
  388    H    GLN  50           H        GLN  50  -2.701   6.086   6.067
  389    HA   GLN  50           HA       GLN  50  -0.588   7.577   4.913
  390    HB2  GLN  50           HB2      GLN  50  -2.734   5.842   3.600
  391    HB3  GLN  50           HB3      GLN  50  -1.344   6.518   2.763
  392    HG2  GLN  50           HG2      GLN  50  -0.522   4.459   3.193
  393    HG3  GLN  50           HG3      GLN  50   0.092   5.299   4.604
  394   HE21  GLN  50          HE21      GLN  50  -1.524   2.499   3.579
  395   HE22  GLN  50          HE22      GLN  50  -2.240   2.066   5.126
  396    H    VAL  51           H        VAL  51  -0.479   9.029   3.197
  397    HA   VAL  51           HA       VAL  51  -2.717  10.990   3.090
  398    HB   VAL  51           HB       VAL  51  -0.983  12.635   2.492
  399   HG11  VAL  51          HG11      VAL  51  -0.331  11.091   5.030
  400   HG12  VAL  51          HG12      VAL  51   0.055  12.787   4.677
  401   HG13  VAL  51          HG13      VAL  51  -1.634  12.282   4.840
  402   HG21  VAL  51          HG21      VAL  51   1.063  10.436   3.050
  403   HG22  VAL  51          HG22      VAL  51   0.673  11.063   1.434
  404   HG23  VAL  51          HG23      VAL  51   1.379  12.134   2.651
  405    H    ARG  52           H        ARG  52  -2.378   8.564   1.295
  406    HA   ARG  52           HA       ARG  52  -2.523   7.908  -0.878
  407    HB2  ARG  52           HB2      ARG  52  -4.656   9.307  -0.352
  408    HB3  ARG  52           HB3      ARG  52  -3.959  10.530  -1.395
  409    HG2  ARG  52           HG2      ARG  52  -5.502   9.292  -2.716
  410    HG3  ARG  52           HG3      ARG  52  -3.911   8.799  -3.264
  411    HD2  ARG  52           HD2      ARG  52  -5.266   6.844  -3.144
  412    HD3  ARG  52           HD3      ARG  52  -4.098   6.740  -1.822
  413    HE   ARG  52           HE       ARG  52  -6.655   7.963  -1.067
  414   HH11  ARG  52          HH11      ARG  52  -5.078   4.851  -1.396
  415   HH12  ARG  52          HH12      ARG  52  -6.184   4.074  -0.296
  416   HH21  ARG  52          HH21      ARG  52  -8.046   6.904   0.299
  417   HH22  ARG  52          HH22      ARG  52  -7.822   5.210   0.629
  418    H    ASN  53           H        ASN  53  -0.058   9.123  -0.316
  419    HA   ASN  53           HA       ASN  53   0.861   9.768  -3.037
  420    HB2  ASN  53           HB2      ASN  53   0.181  11.956  -1.863
  421    HB3  ASN  53           HB3      ASN  53   1.478  11.651  -0.711
  422   HD21  ASN  53          HD21      ASN  53   0.707  12.538  -4.040
  423   HD22  ASN  53          HD22      ASN  53   2.352  12.997  -4.461
  424    H    PHE  54           H        PHE  54   3.132   9.472  -3.331
  425    HA   PHE  54           HA       PHE  54   4.297   7.411  -1.654
  426    HB2  PHE  54           HB2      PHE  54   4.378   7.644  -4.193
  427    HB3  PHE  54           HB3      PHE  54   5.559   8.924  -3.969
  428    HD1  PHE  54           HD2      PHE  54   4.854   5.299  -3.520
  429    HD2  PHE  54           HD1      PHE  54   7.882   8.371  -3.418
  430    HE1  PHE  54           HE2      PHE  54   6.625   3.555  -3.472
  431    HE2  PHE  54           HE1      PHE  54   9.648   6.624  -3.374
  432    HZ   PHE  54           HZ       PHE  54   9.022   4.215  -3.404
  433    H    SER  55           H        SER  55   4.849  10.861  -2.058
  434    HA   SER  55           HA       SER  55   6.474  12.336  -1.356
  435    HB2  SER  55           HB2      SER  55   5.458  11.086   1.211
  436    HB3  SER  55           HB3      SER  55   6.381  12.601   1.136
  437    HG   SER  55           HG       SER  55   4.185  12.330  -0.595
  Start of MODEL   12
    1    H1   GLY   1           H1       GLY   1  10.308  -0.704   0.014
    2    H2   GLY   1           H2       GLY   1   9.768  -0.833  -1.527
    3    H3   GLY   1           H3       GLY   1   9.647   0.596  -0.735
    4    HA2  GLY   1           HA2      GLY   1  12.164  -0.719  -1.526
    5    HA3  GLY   1           HA3      GLY   1  11.449   0.696  -2.318
    6    H    SER   2           H        SER   2  13.545  -0.392   0.104
    7    HA   SER   2           HA       SER   2  14.024   2.352   1.148
    8    HB2  SER   2           HB2      SER   2  14.075   1.468   3.482
    9    HB3  SER   2           HB3      SER   2  12.478   1.439   2.736
   10    HG   SER   2           HG       SER   2  14.237  -0.758   3.171
   11    H    GLU   3           H        GLU   3  15.432   0.562  -0.717
   12    HA   GLU   3           HA       GLU   3  17.729  -0.582   0.691
   13    HB2  GLU   3           HB2      GLU   3  17.125  -0.360  -2.289
   14    HB3  GLU   3           HB3      GLU   3  18.416  -1.302  -1.557
   15    HG2  GLU   3           HG2      GLU   3  16.777  -2.885  -2.031
   16    HG3  GLU   3           HG3      GLU   3  16.674  -2.631  -0.294
   17    H    PHE   4           H        PHE   4  17.148   2.579  -0.097
   18    HA   PHE   4           HA       PHE   4  19.538   3.454  -1.385
   19    HB2  PHE   4           HB2      PHE   4  17.696   4.972   0.499
   20    HB3  PHE   4           HB3      PHE   4  18.849   5.681  -0.621
   21    HD1  PHE   4           HD2      PHE   4  18.545   4.872  -3.186
   22    HD2  PHE   4           HD1      PHE   4  15.445   4.896  -0.183
   23    HE1  PHE   4           HE2      PHE   4  16.816   4.937  -4.968
   24    HE2  PHE   4           HE1      PHE   4  13.721   4.965  -1.969
   25    HZ   PHE   4           HZ       PHE   4  14.403   4.985  -4.362
   26    H    THR   5           H        THR   5  21.558   3.354  -0.653
   27    HA   THR   5           HA       THR   5  22.246   3.979   2.177
   28    HB   THR   5           HB       THR   5  23.849   2.062   2.202
   29    HG1  THR   5           HG1      THR   5  23.926   1.543   0.035
   30   HG21  THR   5          HG21      THR   5  22.252   0.375   2.832
   31   HG22  THR   5          HG22      THR   5  20.952   1.186   1.936
   32   HG23  THR   5          HG23      THR   5  21.666   1.958   3.371
   33    H    SER   6           H        SER   6  22.539   5.884   0.482
   34    HA   SER   6           HA       SER   6  25.252   5.842  -0.741
   35    HB2  SER   6           HB2      SER   6  22.908   7.709  -1.225
   36    HB3  SER   6           HB3      SER   6  24.450   7.694  -2.107
   37    HG   SER   6           HG       SER   6  22.834   6.513  -3.220
   38    H    SER   7           H        SER   7  25.488   6.045   1.914
   39    HA   SER   7           HA       SER   7  26.348   8.853   2.433
   40    HB2  SER   7           HB2      SER   7  25.467   8.623   4.771
   41    HB3  SER   7           HB3      SER   7  24.279   8.855   3.489
   42    HG   SER   7           HG       SER   7  23.686   6.729   3.600
   43    HA   PRO   8           HA       PRO   8  29.636   5.724   3.428
   44    HB2  PRO   8           HB2      PRO   8  31.671   6.653   1.883
   45    HB3  PRO   8           HB3      PRO   8  30.292   5.745   1.210
   46    HG2  PRO   8           HG2      PRO   8  30.619   8.766   1.322
   47    HG3  PRO   8           HG3      PRO   8  30.233   7.750  -0.105
   48    HD2  PRO   8           HD2      PRO   8  28.290   8.977   1.354
   49    HD3  PRO   8           HD3      PRO   8  28.044   7.353   0.645
   50    H    ARG   9           H        ARG   9  29.113   7.016   5.502
   51    HA   ARG   9           HA       ARG   9  31.628   8.259   6.488
   52    HB2  ARG   9           HB2      ARG   9  30.071  10.083   5.660
   53    HB3  ARG   9           HB3      ARG   9  28.871   9.538   6.822
   54    HG2  ARG   9           HG2      ARG   9  29.984  11.487   7.666
   55    HG3  ARG   9           HG3      ARG   9  30.444  10.121   8.689
   56    HD2  ARG   9           HD2      ARG   9  32.631   9.989   7.638
   57    HD3  ARG   9           HD3      ARG   9  32.140  11.130   6.367
   58    HE   ARG   9           HE       ARG   9  31.850  12.376   8.928
   59   HH11  ARG   9          HH11      ARG   9  34.423  11.413   6.754
   60   HH12  ARG   9          HH12      ARG   9  35.475  12.698   7.283
   61   HH21  ARG   9          HH21      ARG   9  33.236  14.003   9.544
   62   HH22  ARG   9          HH22      ARG   9  34.814  14.120   8.823
   63    H    GLY  10           H        GLY  10  32.182   7.414   8.386
   64    HA2  GLY  10           HA2      GLY  10  31.053   7.439  10.762
   65    HA3  GLY  10           HA3      GLY  10  30.223   6.012  10.141
   66    H    ASP  11           H        ASP  11  31.579   4.217   9.388
   67    HA   ASP  11           HA       ASP  11  32.959   2.500   9.950
   68    HB2  ASP  11           HB2      ASP  11  35.031   4.666   9.485
   69    HB3  ASP  11           HB3      ASP  11  35.311   2.927   9.384
   70    H    LYS  12           H        LYS  12  32.027   3.813  12.331
   71    HA   LYS  12           HA       LYS  12  33.978   4.173  14.317
   72    HB2  LYS  12           HB2      LYS  12  32.244   4.380  15.826
   73    HB3  LYS  12           HB3      LYS  12  31.505   4.853  14.318
   74    HG2  LYS  12           HG2      LYS  12  31.153   2.233  15.839
   75    HG3  LYS  12           HG3      LYS  12  29.983   3.520  15.660
   76    HD2  LYS  12           HD2      LYS  12  30.918   1.694  13.410
   77    HD3  LYS  12           HD3      LYS  12  29.420   1.554  14.326
   78    HE2  LYS  12           HE2      LYS  12  28.705   3.794  13.530
   79    HE3  LYS  12           HE3      LYS  12  30.176   3.933  12.573
   80    HZ1  LYS  12           HZ1      LYS  12  29.463   1.935  11.330
   81    HZ2  LYS  12           HZ2      LYS  12  28.334   3.112  11.217
   82    HZ3  LYS  12           HZ3      LYS  12  28.093   1.841  12.210
   83    H    ALA  13           H        ALA  13  34.422   3.015  16.259
   84    HA   ALA  13           HA       ALA  13  34.536   0.038  15.959
   85    HB1  ALA  13           HB1      ALA  13  36.151   1.924  17.724
   86    HB2  ALA  13           HB2      ALA  13  36.382   0.169  17.563
   87    HB3  ALA  13           HB3      ALA  13  36.684   1.230  16.174
   88    H    ALA  14           H        ALA  14  33.141   2.565  17.963
   89    HA   ALA  14           HA       ALA  14  32.574   0.847  20.243
   90    HB1  ALA  14           HB1      ALA  14  31.726   2.927  21.211
   91    HB2  ALA  14           HB2      ALA  14  33.285   3.214  20.433
   92    HB3  ALA  14           HB3      ALA  14  31.781   3.727  19.627
   93    H    TYR  15           H        TYR  15  31.274  -0.039  17.763
   94    HA   TYR  15           HA       TYR  15  28.525   0.716  17.645
   95    HB2  TYR  15           HB2      TYR  15  28.279  -0.953  16.049
   96    HB3  TYR  15           HB3      TYR  15  29.943  -0.438  15.857
   97    HD1  TYR  15           HD1      TYR  15  31.819  -1.969  16.519
   98    HD2  TYR  15           HD2      TYR  15  27.685  -3.153  16.919
   99    HE1  TYR  15           HE1      TYR  15  32.522  -4.332  16.888
  100    HE2  TYR  15           HE2      TYR  15  28.391  -5.505  17.289
  101    HH   TYR  15           HH       TYR  15  30.148  -6.956  17.480
  102    H    ASP  16           H        ASP  16  30.096  -1.282  19.973
  103    HA   ASP  16           HA       ASP  16  27.791  -2.900  20.724
  104    HB2  ASP  16           HB2      ASP  16  29.197  -3.719  22.467
  105    HB3  ASP  16           HB3      ASP  16  30.158  -3.629  20.998
  106    H    ILE  17           H        ILE  17  28.710   0.353  21.370
  107    HA   ILE  17           HA       ILE  17  26.742   0.523  23.623
  108    HB   ILE  17           HB       ILE  17  28.838   0.982  24.516
  109   HG12  ILE  17          HG12      ILE  17  26.856   2.523  25.068
  110   HG13  ILE  17          HG13      ILE  17  28.463   2.911  25.650
  111   HG21  ILE  17          HG21      ILE  17  29.406   2.984  22.307
  112   HG22  ILE  17          HG22      ILE  17  30.371   2.776  23.781
  113   HG23  ILE  17          HG23      ILE  17  30.242   1.449  22.632
  114   HD11  ILE  17          HD11      ILE  17  27.218   4.905  24.881
  115   HD12  ILE  17          HD12      ILE  17  28.744   4.684  24.015
  116   HD13  ILE  17          HD13      ILE  17  27.211   4.268  23.228
  117    H    LEU  18           H        LEU  18  27.943   2.166  20.668
  118    HA   LEU  18           HA       LEU  18  25.746   4.036  20.487
  119    HB2  LEU  18           HB2      LEU  18  27.589   2.793  18.405
  120    HB3  LEU  18           HB3      LEU  18  26.445   4.080  18.049
  121    HG   LEU  18           HG       LEU  18  28.631   4.420  20.144
  122   HD11  LEU  18          HD11      LEU  18  29.914   5.605  18.408
  123   HD12  LEU  18          HD12      LEU  18  28.706   5.141  17.186
  124   HD13  LEU  18          HD13      LEU  18  29.690   3.898  18.000
  125   HD21  LEU  18          HD21      LEU  18  27.028   6.439  18.501
  126   HD22  LEU  18          HD22      LEU  18  28.255   6.811  19.734
  127   HD23  LEU  18          HD23      LEU  18  26.738   6.043  20.204
  128    H    ARG  19           H        ARG  19  23.747   3.855  19.536
  129    HA   ARG  19           HA       ARG  19  22.902   1.188  18.432
  130    HB2  ARG  19           HB2      ARG  19  22.337   1.825  20.910
  131    HB3  ARG  19           HB3      ARG  19  21.150   2.905  20.206
  132    HG2  ARG  19           HG2      ARG  19  21.292  -0.126  19.825
  133    HG3  ARG  19           HG3      ARG  19  20.263   0.722  20.972
  134    HD2  ARG  19           HD2      ARG  19  19.204   1.909  18.958
  135    HD3  ARG  19           HD3      ARG  19  20.020   0.716  17.946
  136    HE   ARG  19           HE       ARG  19  17.714   0.314  19.705
  137   HH11  ARG  19          HH11      ARG  19  20.221  -1.450  17.986
  138   HH12  ARG  19          HH12      ARG  19  19.307  -2.931  18.023
  139   HH21  ARG  19          HH21      ARG  19  16.632  -1.610  19.717
  140   HH22  ARG  19          HH22      ARG  19  17.340  -3.014  18.976
  141    H    ARG  20           H        ARG  20  21.967   1.294  16.525
  142    HA   ARG  20           HA       ARG  20  21.376   3.874  15.252
  143    HB2  ARG  20           HB2      ARG  20  21.067   2.568  13.198
  144    HB3  ARG  20           HB3      ARG  20  22.648   2.369  13.912
  145    HG2  ARG  20           HG2      ARG  20  20.566   0.283  14.548
  146    HG3  ARG  20           HG3      ARG  20  21.229   0.322  12.926
  147    HD2  ARG  20           HD2      ARG  20  23.014   0.195  15.388
  148    HD3  ARG  20           HD3      ARG  20  22.354  -1.236  14.581
  149    HE   ARG  20           HE       ARG  20  23.607   0.374  12.606
  150   HH11  ARG  20          HH11      ARG  20  24.591  -1.616  15.321
  151   HH12  ARG  20          HH12      ARG  20  26.076  -2.092  14.546
  152   HH21  ARG  20          HH21      ARG  20  25.504  -0.310  11.668
  153   HH22  ARG  20          HH22      ARG  20  26.577  -1.360  12.546
  154    H    CYS  21           H        CYS  21  19.464   4.679  14.620
  155    HA   CYS  21           HA       CYS  21  16.931   3.438  15.467
  156    HB2  CYS  21           HB2      CYS  21  17.311   5.881  15.537
  157    HB3  CYS  21           HB3      CYS  21  17.546   5.892  13.783
  158    H    SER  22           H        SER  22  15.929   1.900  14.289
  159    HA   SER  22           HA       SER  22  16.802   1.037  11.690
  160    HB2  SER  22           HB2      SER  22  14.866  -0.508  11.833
  161    HB3  SER  22           HB3      SER  22  15.903  -0.545  13.265
  162    HG   SER  22           HG       SER  22  13.656  -0.467  13.801
  163    H    GLN  23           H        GLN  23  14.835   3.678  12.456
  164    HA   GLN  23           HA       GLN  23  13.545   3.646   9.756
  165    HB2  GLN  23           HB2      GLN  23  12.129   3.497  11.937
  166    HB3  GLN  23           HB3      GLN  23  12.577   5.181  12.175
  167    HG2  GLN  23           HG2      GLN  23  10.457   5.240  11.184
  168    HG3  GLN  23           HG3      GLN  23  11.523   5.636   9.853
  169   HE21  GLN  23          HE21      GLN  23   8.859   3.755  10.695
  170   HE22  GLN  23          HE22      GLN  23   9.013   2.536   9.438
  171    H    CYS  24           H        CYS  24  15.837   5.324  11.718
  172    HA   CYS  24           HA       CYS  24  15.762   7.713   9.917
  173    HB2  CYS  24           HB2      CYS  24  16.806   7.604  12.753
  174    HB3  CYS  24           HB3      CYS  24  16.515   9.024  11.762
  175    H    GLY  25           H        GLY  25  17.853   5.149  11.109
  176    HA2  GLY  25           HA2      GLY  25  19.892   4.465  10.321
  177    HA3  GLY  25           HA3      GLY  25  19.943   5.846   9.229
  178    H    ILE  26           H        ILE  26  19.562   7.533  11.895
  179    HA   ILE  26           HA       ILE  26  22.344   8.095  12.402
  180    HB   ILE  26           HB       ILE  26  20.564   9.772  12.512
  181   HG12  ILE  26          HG12      ILE  26  21.939   9.515  15.216
  182   HG13  ILE  26          HG13      ILE  26  22.739  10.041  13.730
  183   HG21  ILE  26          HG21      ILE  26  18.991   9.926  14.375
  184   HG22  ILE  26          HG22      ILE  26  18.763   8.392  13.546
  185   HG23  ILE  26          HG23      ILE  26  19.627   8.433  15.087
  186   HD11  ILE  26          HD11      ILE  26  20.464  11.468  15.163
  187   HD12  ILE  26          HD12      ILE  26  22.148  11.985  15.017
  188   HD13  ILE  26          HD13      ILE  26  21.114  11.948  13.575
  189    H    LEU  27           H        LEU  27  23.572   7.767  14.282
  190    HA   LEU  27           HA       LEU  27  22.742   5.535  16.099
  191    HB2  LEU  27           HB2      LEU  27  25.462   6.371  15.014
  192    HB3  LEU  27           HB3      LEU  27  25.289   5.447  16.493
  193    HG   LEU  27           HG       LEU  27  24.122   3.635  15.250
  194   HD11  LEU  27          HD11      LEU  27  23.324   4.764  13.242
  195   HD12  LEU  27          HD12      LEU  27  24.505   3.553  12.756
  196   HD13  LEU  27          HD13      LEU  27  24.975   5.266  12.811
  197   HD21  LEU  27          HD21      LEU  27  26.898   4.417  14.288
  198   HD22  LEU  27          HD22      LEU  27  26.196   2.777  14.204
  199   HD23  LEU  27          HD23      LEU  27  26.518   3.519  15.774
  200    H    LEU  28           H        LEU  28  22.651   5.952  18.223
  201    HA   LEU  28           HA       LEU  28  23.790   8.511  19.295
  202    HB2  LEU  28           HB2      LEU  28  21.202   7.116  20.080
  203    HB3  LEU  28           HB3      LEU  28  21.895   8.500  20.883
  204    HG   LEU  28           HG       LEU  28  20.147   9.372  19.707
  205   HD11  LEU  28          HD11      LEU  28  21.006  10.914  18.113
  206   HD12  LEU  28          HD12      LEU  28  22.389   9.878  17.736
  207   HD13  LEU  28          HD13      LEU  28  22.271  10.647  19.328
  208   HD21  LEU  28          HD21      LEU  28  19.507   8.978  17.440
  209   HD22  LEU  28          HD22      LEU  28  19.659   7.422  18.270
  210   HD23  LEU  28          HD23      LEU  28  20.924   7.957  17.143
  211    HA   PRO  29           HA       PRO  29  25.854   5.850  22.170
  212    HB2  PRO  29           HB2      PRO  29  26.388   7.525  24.290
  213    HB3  PRO  29           HB3      PRO  29  27.205   7.603  22.704
  214    HG2  PRO  29           HG2      PRO  29  24.890   9.295  23.684
  215    HG3  PRO  29           HG3      PRO  29  26.374   9.820  22.833
  216    HD2  PRO  29           HD2      PRO  29  24.013   9.431  21.525
  217    HD3  PRO  29           HD3      PRO  29  25.581   9.039  20.766
  218    H    LEU  30           H        LEU  30  23.644   7.827  24.210
  219    HA   LEU  30           HA       LEU  30  22.027   5.621  25.096
  220    HB2  LEU  30           HB2      LEU  30  24.569   6.040  26.495
  221    HB3  LEU  30           HB3      LEU  30  23.234   6.285  27.600
  222    HG   LEU  30           HG       LEU  30  23.267   3.804  25.853
  223   HD11  LEU  30          HD11      LEU  30  25.454   3.871  26.958
  224   HD12  LEU  30          HD12      LEU  30  24.425   2.617  27.664
  225   HD13  LEU  30          HD13      LEU  30  24.674   4.153  28.531
  226   HD21  LEU  30          HD21      LEU  30  22.166   4.368  28.635
  227   HD22  LEU  30          HD22      LEU  30  21.970   2.874  27.693
  228   HD23  LEU  30          HD23      LEU  30  21.211   4.376  27.134
  229    HA   PRO  31           HA       PRO  31  20.676   9.442  27.613
  230    HB2  PRO  31           HB2      PRO  31  22.052  11.837  27.455
  231    HB3  PRO  31           HB3      PRO  31  22.359  10.566  28.674
  232    HG2  PRO  31           HG2      PRO  31  23.838  11.045  26.073
  233    HG3  PRO  31           HG3      PRO  31  24.522  10.761  27.705
  234    HD2  PRO  31           HD2      PRO  31  24.331   8.752  25.927
  235    HD3  PRO  31           HD3      PRO  31  23.962   8.473  27.648
  236    H    ILE  32           H        ILE  32  22.111  10.068  24.441
  237    HA   ILE  32           HA       ILE  32  19.980  11.915  23.617
  238    HB   ILE  32           HB       ILE  32  22.102  10.686  21.835
  239   HG12  ILE  32          HG12      ILE  32  22.399  13.181  23.568
  240   HG13  ILE  32          HG13      ILE  32  23.274  11.665  23.783
  241   HG21  ILE  32          HG21      ILE  32  20.593  13.342  21.719
  242   HG22  ILE  32          HG22      ILE  32  21.761  12.760  20.516
  243   HG23  ILE  32          HG23      ILE  32  20.239  11.920  20.718
  244   HD11  ILE  32          HD11      ILE  32  23.612  13.596  21.480
  245   HD12  ILE  32          HD12      ILE  32  24.771  13.158  22.741
  246   HD13  ILE  32          HD13      ILE  32  24.309  11.955  21.522
  247    H    LEU  33           H        LEU  33  20.653   8.458  23.319
  248    HA   LEU  33           HA       LEU  33  19.013   7.828  21.081
  249    HB2  LEU  33           HB2      LEU  33  20.723   6.376  22.499
  250    HB3  LEU  33           HB3      LEU  33  19.322   6.008  23.478
  251    HG   LEU  33           HG       LEU  33  20.043   5.153  20.689
  252   HD11  LEU  33          HD11      LEU  33  19.212   2.982  21.547
  253   HD12  LEU  33          HD12      LEU  33  18.694   3.768  23.045
  254   HD13  LEU  33          HD13      LEU  33  20.423   3.692  22.631
  255   HD21  LEU  33          HD21      LEU  33  17.144   5.132  21.587
  256   HD22  LEU  33          HD22      LEU  33  17.820   4.296  20.171
  257   HD23  LEU  33          HD23      LEU  33  17.816   6.054  20.213
  258    H    ASN  34           H        ASN  34  18.223   7.980  24.577
  259    HA   ASN  34           HA       ASN  34  15.521   7.198  24.441
  260    HB2  ASN  34           HB2      ASN  34  16.958   9.144  26.303
  261    HB3  ASN  34           HB3      ASN  34  15.289   8.630  26.535
  262   HD21  ASN  34          HD21      ASN  34  16.613   8.076  28.650
  263   HD22  ASN  34          HD22      ASN  34  17.118   6.392  28.712
  264    H    GLN  35           H        GLN  35  16.810  10.559  24.115
  265    HA   GLN  35           HA       GLN  35  14.266  11.780  23.674
  266    HB2  GLN  35           HB2      GLN  35  16.320  12.992  24.314
  267    HB3  GLN  35           HB3      GLN  35  17.022  12.672  22.718
  268    HG2  GLN  35           HG2      GLN  35  15.265  14.001  21.634
  269    HG3  GLN  35           HG3      GLN  35  14.397  14.170  23.161
  270   HE21  GLN  35          HE21      GLN  35  14.872  16.001  24.406
  271   HE22  GLN  35          HE22      GLN  35  16.262  17.034  24.104
  272    H    HIS  36           H        HIS  36  16.637  10.428  21.306
  273    HA   HIS  36           HA       HIS  36  15.111  11.073  18.972
  274    HB2  HIS  36           HB2      HIS  36  17.494  10.327  18.973
  275    HB3  HIS  36           HB3      HIS  36  16.966   8.693  19.390
  276    HD1  HIS  36           HD1      HIS  36  16.990  11.150  16.454
  277    HD2  HIS  36           HD2      HIS  36  15.652   7.290  17.444
  278    HE1  HIS  36           HE1      HIS  36  16.245  10.086  14.269
  279    H    GLN  37           H        GLN  37  15.021   8.171  21.089
  280    HA   GLN  37           HA       GLN  37  13.147   6.711  19.552
  281    HB2  GLN  37           HB2      GLN  37  14.706   5.935  21.451
  282    HB3  GLN  37           HB3      GLN  37  13.491   6.537  22.572
  283    HG2  GLN  37           HG2      GLN  37  13.235   4.137  22.232
  284    HG3  GLN  37           HG3      GLN  37  11.819   4.975  21.595
  285   HE21  GLN  37          HE21      GLN  37  15.112   3.996  20.334
  286   HE22  GLN  37          HE22      GLN  37  14.460   3.352  18.835
  287    H    GLU  38           H        GLU  38  12.547   9.007  22.284
  288    HA   GLU  38           HA       GLU  38   9.680   8.709  22.246
  289    HB2  GLU  38           HB2      GLU  38  11.286  11.191  22.975
  290    HB3  GLU  38           HB3      GLU  38   9.588  10.910  23.322
  291    HG2  GLU  38           HG2      GLU  38  11.991   9.593  24.584
  292    HG3  GLU  38           HG3      GLU  38  10.744  10.550  25.342
  293    H    LYS  39           H        LYS  39  11.848  10.768  20.283
  294    HA   LYS  39           HA       LYS  39   9.677  12.198  19.014
  295    HB2  LYS  39           HB2      LYS  39  12.213  12.790  19.327
  296    HB3  LYS  39           HB3      LYS  39  12.450  11.946  17.805
  297    HG2  LYS  39           HG2      LYS  39  10.395  14.178  18.199
  298    HG3  LYS  39           HG3      LYS  39  12.073  14.538  17.863
  299    HD2  LYS  39           HD2      LYS  39  10.316  12.870  16.027
  300    HD3  LYS  39           HD3      LYS  39  10.524  14.601  15.864
  301    HE2  LYS  39           HE2      LYS  39  12.825  12.594  15.755
  302    HE3  LYS  39           HE3      LYS  39  11.952  13.178  14.338
  303    HZ1  LYS  39           HZ1      LYS  39  12.639  15.445  14.917
  304    HZ2  LYS  39           HZ2      LYS  39  13.939  14.492  14.682
  305    HZ3  LYS  39           HZ3      LYS  39  13.499  14.902  16.197
  306    H    CYS  40           H        CYS  40  11.642   9.379  17.919
  307    HA   CYS  40           HA       CYS  40  10.277   8.823  15.502
  308    HB2  CYS  40           HB2      CYS  40  11.707   7.131  17.578
  309    HB3  CYS  40           HB3      CYS  40  10.864   6.366  16.231
  310    H    ARG  41           H        ARG  41   9.465   7.702  18.837
  311    HA   ARG  41           HA       ARG  41   7.028   6.354  18.223
  312    HB2  ARG  41           HB2      ARG  41   8.160   7.712  20.681
  313    HB3  ARG  41           HB3      ARG  41   6.478   7.233  20.701
  314    HG2  ARG  41           HG2      ARG  41   8.733   5.282  20.072
  315    HG3  ARG  41           HG3      ARG  41   8.092   5.587  21.691
  316    HD2  ARG  41           HD2      ARG  41   5.755   5.032  20.711
  317    HD3  ARG  41           HD3      ARG  41   6.613   4.416  19.305
  318    HE   ARG  41           HE       ARG  41   7.295   2.556  20.516
  319   HH11  ARG  41          HH11      ARG  41   5.980   4.849  22.829
  320   HH12  ARG  41          HH12      ARG  41   5.972   3.678  24.117
  321   HH21  ARG  41          HH21      ARG  41   7.241   1.118  22.208
  322   HH22  ARG  41          HH22      ARG  41   6.663   1.627  23.769
  323    H    TRP  42           H        TRP  42   7.434   9.805  19.159
  324    HA   TRP  42           HA       TRP  42   4.672  10.426  19.023
  325    HB2  TRP  42           HB2      TRP  42   6.523  11.799  20.060
  326    HB3  TRP  42           HB3      TRP  42   6.951  12.350  18.445
  327    HD1  TRP  42           HD1      TRP  42   4.519  12.854  21.256
  328    HE1  TRP  42           HE1      TRP  42   2.863  14.748  20.749
  329    HE3  TRP  42           HE3      TRP  42   5.660  13.640  16.314
  330    HZ2  TRP  42           HZ2      TRP  42   2.064  16.328  18.476
  331    HZ3  TRP  42           HZ3      TRP  42   4.398  15.324  14.994
  332    HH2  TRP  42           HH2      TRP  42   2.600  16.667  16.059
  333    H    LEU  43           H        LEU  43   7.170  10.781  16.443
  334    HA   LEU  43           HA       LEU  43   5.377  11.771  14.438
  335    HB2  LEU  43           HB2      LEU  43   8.021  10.269  14.316
  336    HB3  LEU  43           HB3      LEU  43   7.169  10.768  12.860
  337    HG   LEU  43           HG       LEU  43   8.117  12.701  15.018
  338   HD11  LEU  43          HD11      LEU  43   9.258  12.031  12.265
  339   HD12  LEU  43          HD12      LEU  43   9.990  11.610  13.828
  340   HD13  LEU  43          HD13      LEU  43   9.842  13.313  13.345
  341   HD21  LEU  43          HD21      LEU  43   6.224  13.638  13.752
  342   HD22  LEU  43          HD22      LEU  43   6.993  13.171  12.216
  343   HD23  LEU  43          HD23      LEU  43   7.723  14.417  13.251
  344    H    ALA  44           H        ALA  44   6.423   8.367  15.076
  345    HA   ALA  44           HA       ALA  44   4.863   7.234  12.985
  346    HB1  ALA  44           HB1      ALA  44   5.803   6.009  15.615
  347    HB2  ALA  44           HB2      ALA  44   5.264   5.114  14.178
  348    HB3  ALA  44           HB3      ALA  44   6.739   6.096  14.105
  349    H    SER  45           H        SER  45   3.983   7.921  16.391
  350    HA   SER  45           HA       SER  45   1.355   6.699  16.239
  351    HB2  SER  45           HB2      SER  45   2.400   8.822  18.154
  352    HB3  SER  45           HB3      SER  45   0.914   7.873  18.343
  353    HG   SER  45           HG       SER  45   3.608   6.983  18.374
  354    H    SER  46           H        SER  46   2.542  10.036  15.704
  355    HA   SER  46           HA       SER  46  -0.049  11.235  15.303
  356    HB2  SER  46           HB2      SER  46   2.007  12.501  15.866
  357    HB3  SER  46           HB3      SER  46   2.700  12.072  14.294
  358    HG   SER  46           HG       SER  46   0.425  13.701  14.846
  359    H    LYS  47           H        LYS  47   2.382   9.909  13.025
  360    HA   LYS  47           HA       LYS  47   0.336   9.376  10.980
  361    HB2  LYS  47           HB2      LYS  47   1.446  10.696   9.235
  362    HB3  LYS  47           HB3      LYS  47   0.758  11.667  10.525
  363    HG2  LYS  47           HG2      LYS  47   3.144  11.825  11.513
  364    HG3  LYS  47           HG3      LYS  47   3.698  11.149   9.970
  365    HD2  LYS  47           HD2      LYS  47   2.492  13.027   8.790
  366    HD3  LYS  47           HD3      LYS  47   2.136  13.724  10.387
  367    HE2  LYS  47           HE2      LYS  47   4.614  13.740  10.865
  368    HE3  LYS  47           HE3      LYS  47   4.898  13.164   9.215
  369    HZ1  LYS  47           HZ1      LYS  47   5.108  15.564   9.319
  370    HZ2  LYS  47           HZ2      LYS  47   3.612  15.742   9.945
  371    HZ3  LYS  47           HZ3      LYS  47   3.800  15.207   8.411
  372    H    GLY  48           H        GLY  48   0.780   7.248  11.191
  373    HA2  GLY  48           HA2      GLY  48   3.416   6.240  10.153
  374    HA3  GLY  48           HA3      GLY  48   2.317   5.357  11.208
  375    H    LYS  49           H        LYS  49   0.545   6.947   8.856
  376    HA   LYS  49           HA       LYS  49   0.579   4.781   6.808
  377    HB2  LYS  49           HB2      LYS  49  -1.869   4.478   7.024
  378    HB3  LYS  49           HB3      LYS  49  -0.988   3.939   8.438
  379    HG2  LYS  49           HG2      LYS  49  -1.948   6.778   8.549
  380    HG3  LYS  49           HG3      LYS  49  -3.219   5.574   8.471
  381    HD2  LYS  49           HD2      LYS  49  -0.954   5.343  10.490
  382    HD3  LYS  49           HD3      LYS  49  -2.346   6.370  10.808
  383    HE2  LYS  49           HE2      LYS  49  -2.616   3.423  10.072
  384    HE3  LYS  49           HE3      LYS  49  -2.386   3.971  11.735
  385    HZ1  LYS  49           HZ1      LYS  49  -4.738   3.723  11.233
  386    HZ2  LYS  49           HZ2      LYS  49  -4.659   4.787  10.001
  387    HZ3  LYS  49           HZ3      LYS  49  -4.417   5.291  11.538
  388    H    GLN  50           H        GLN  50   0.277   8.076   7.439
  389    HA   GLN  50           HA       GLN  50  -0.907   8.666   4.755
  390    HB2  GLN  50           HB2      GLN  50  -1.240  10.140   7.398
  391    HB3  GLN  50           HB3      GLN  50  -1.703  10.806   5.827
  392    HG2  GLN  50           HG2      GLN  50  -3.289   8.974   5.447
  393    HG3  GLN  50           HG3      GLN  50  -2.832   8.225   6.973
  394   HE21  GLN  50          HE21      GLN  50  -4.275   8.660   8.643
  395   HE22  GLN  50          HE22      GLN  50  -5.228  10.133   8.747
  396    H    VAL  51           H        VAL  51   1.771   8.084   5.122
  397    HA   VAL  51           HA       VAL  51   3.457  10.413   5.396
  398    HB   VAL  51           HB       VAL  51   5.271   8.918   4.726
  399   HG11  VAL  51          HG11      VAL  51   3.378   7.489   6.635
  400   HG12  VAL  51          HG12      VAL  51   5.142   7.345   6.546
  401   HG13  VAL  51          HG13      VAL  51   4.410   8.874   7.058
  402   HG21  VAL  51          HG21      VAL  51   4.150   7.568   2.976
  403   HG22  VAL  51          HG22      VAL  51   4.885   6.548   4.213
  404   HG23  VAL  51          HG23      VAL  51   3.130   6.796   4.210
  405    H    ARG  52           H        ARG  52   1.333  10.443   3.224
  406    HA   ARG  52           HA       ARG  52   2.991  11.337   0.901
  407    HB2  ARG  52           HB2      ARG  52   0.452   9.639   0.853
  408    HB3  ARG  52           HB3      ARG  52   1.150  10.400  -0.570
  409    HG2  ARG  52           HG2      ARG  52   2.646   8.362   1.137
  410    HG3  ARG  52           HG3      ARG  52   1.643   7.918  -0.231
  411    HD2  ARG  52           HD2      ARG  52   3.996   9.839  -0.479
  412    HD3  ARG  52           HD3      ARG  52   4.123   8.085  -0.672
  413    HE   ARG  52           HE       ARG  52   2.023   9.167  -2.342
  414   HH11  ARG  52          HH11      ARG  52   5.507   8.804  -2.287
  415   HH12  ARG  52          HH12      ARG  52   5.615   8.715  -4.025
  416   HH21  ARG  52          HH21      ARG  52   2.235   9.036  -4.549
  417   HH22  ARG  52          HH22      ARG  52   3.809   8.856  -5.263
  418    H    ASN  53           H        ASN  53   2.410  13.219   0.096
  419    HA   ASN  53           HA       ASN  53  -0.122  14.556   0.961
  420    HB2  ASN  53           HB2      ASN  53   1.206  16.626   1.246
  421    HB3  ASN  53           HB3      ASN  53   1.666  15.344   2.355
  422   HD21  ASN  53          HD21      ASN  53   3.576  16.903   2.524
  423   HD22  ASN  53          HD22      ASN  53   4.905  16.579   1.420
  424    H    PHE  54           H        PHE  54   1.852  13.729  -1.700
  425    HA   PHE  54           HA       PHE  54  -0.103  14.949  -3.532
  426    HB2  PHE  54           HB2      PHE  54   2.918  15.275  -3.819
  427    HB3  PHE  54           HB3      PHE  54   1.752  15.608  -5.088
  428    HD1  PHE  54           HD1      PHE  54  -0.017  17.428  -4.722
  429    HD2  PHE  54           HD2      PHE  54   3.442  16.965  -2.189
  430    HE1  PHE  54           HE1      PHE  54  -0.312  19.751  -3.890
  431    HE2  PHE  54           HE2      PHE  54   3.139  19.284  -1.351
  432    HZ   PHE  54           HZ       PHE  54   1.261  20.680  -2.200
  433    H    SER  55           H        SER  55  -0.510  13.636  -5.280
  434    HA   SER  55           HA       SER  55   1.075  11.269  -5.946
  435    HB2  SER  55           HB2      SER  55  -0.763   9.675  -5.433
  436    HB3  SER  55           HB3      SER  55  -0.052  10.411  -3.990
  437    HG   SER  55           HG       SER  55  -2.364  10.412  -3.912
  Start of MODEL   13
    1    H1   GLY   1           H1       GLY   1  20.002  -7.649  -1.163
    2    H2   GLY   1           H2       GLY   1  19.565  -7.976  -2.717
    3    H3   GLY   1           H3       GLY   1  18.507  -8.256  -1.489
    4    HA2  GLY   1           HA2      GLY   1  17.868  -6.274  -2.662
    5    HA3  GLY   1           HA3      GLY   1  18.371  -5.879  -1.023
    6    H    SER   2           H        SER   2  20.250  -4.697  -0.686
    7    HA   SER   2           HA       SER   2  21.916  -3.864  -3.029
    8    HB2  SER   2           HB2      SER   2  20.686  -2.003  -0.942
    9    HB3  SER   2           HB3      SER   2  21.878  -1.538  -2.170
   10    HG   SER   2           HG       SER   2  19.715  -1.073  -2.833
   11    H    GLU   3           H        GLU   3  23.991  -2.920  -2.348
   12    HA   GLU   3           HA       GLU   3  24.961  -3.744   0.342
   13    HB2  GLU   3           HB2      GLU   3  25.188  -5.659  -1.253
   14    HB3  GLU   3           HB3      GLU   3  26.190  -4.651  -2.291
   15    HG2  GLU   3           HG2      GLU   3  27.628  -6.065  -0.991
   16    HG3  GLU   3           HG3      GLU   3  27.843  -4.419  -0.415
   17    H    PHE   4           H        PHE   4  25.716  -1.911   1.155
   18    HA   PHE   4           HA       PHE   4  26.848   0.202  -0.516
   19    HB2  PHE   4           HB2      PHE   4  25.214   0.558   1.345
   20    HB3  PHE   4           HB3      PHE   4  26.464   0.116   2.495
   21    HD1  PHE   4           HD1      PHE   4  25.768   2.463  -0.372
   22    HD2  PHE   4           HD2      PHE   4  27.847   1.862   3.358
   23    HE1  PHE   4           HE1      PHE   4  26.498   4.836  -0.398
   24    HE2  PHE   4           HE2      PHE   4  28.566   4.240   3.335
   25    HZ   PHE   4           HZ       PHE   4  27.892   5.726   1.459
   26    H    THR   5           H        THR   5  28.652  -0.976  -1.301
   27    HA   THR   5           HA       THR   5  30.998  -1.170   0.551
   28    HB   THR   5           HB       THR   5  29.884  -3.322   0.010
   29    HG1  THR   5           HG1      THR   5  31.806  -4.387  -0.359
   30   HG21  THR   5          HG21      THR   5  30.234  -4.407  -2.129
   31   HG22  THR   5          HG22      THR   5  31.021  -2.967  -2.792
   32   HG23  THR   5          HG23      THR   5  29.299  -2.930  -2.370
   33    H    SER   6           H        SER   6  30.121   0.965  -1.343
   34    HA   SER   6           HA       SER   6  32.473   1.155  -3.171
   35    HB2  SER   6           HB2      SER   6  30.850   2.130  -4.825
   36    HB3  SER   6           HB3      SER   6  30.647   0.412  -4.470
   37    HG   SER   6           HG       SER   6  28.643   1.542  -4.481
   38    H    SER   7           H        SER   7  32.829   2.303  -0.840
   39    HA   SER   7           HA       SER   7  32.467   5.251  -1.249
   40    HB2  SER   7           HB2      SER   7  32.074   3.572   1.256
   41    HB3  SER   7           HB3      SER   7  32.390   5.309   1.333
   42    HG   SER   7           HG       SER   7  30.236   4.035  -0.030
   43    HA   PRO   8           HA       PRO   8  36.812   5.586  -0.671
   44    HB2  PRO   8           HB2      PRO   8  37.162   8.057   0.461
   45    HB3  PRO   8           HB3      PRO   8  36.555   7.818  -1.205
   46    HG2  PRO   8           HG2      PRO   8  34.926   8.271   1.318
   47    HG3  PRO   8           HG3      PRO   8  34.799   9.138  -0.247
   48    HD2  PRO   8           HD2      PRO   8  33.144   7.089   0.354
   49    HD3  PRO   8           HD3      PRO   8  33.791   7.274  -1.300
   50    H    ARG   9           H        ARG   9  34.837   5.608   2.166
   51    HA   ARG   9           HA       ARG   9  36.955   4.373   3.786
   52    HB2  ARG   9           HB2      ARG   9  36.782   5.869   5.649
   53    HB3  ARG   9           HB3      ARG   9  37.136   6.838   4.227
   54    HG2  ARG   9           HG2      ARG   9  34.557   7.248   4.100
   55    HG3  ARG   9           HG3      ARG   9  34.510   6.614   5.748
   56    HD2  ARG   9           HD2      ARG   9  36.078   9.018   4.739
   57    HD3  ARG   9           HD3      ARG   9  34.610   9.064   5.727
   58    HE   ARG   9           HE       ARG   9  36.391   7.575   7.249
   59   HH11  ARG   9          HH11      ARG   9  36.439  10.836   5.966
   60   HH12  ARG   9          HH12      ARG   9  37.536  11.403   7.195
   61   HH21  ARG   9          HH21      ARG   9  37.811   8.362   8.781
   62   HH22  ARG   9          HH22      ARG   9  38.280  10.037   8.747
   63    H    GLY  10           H        GLY  10  36.080   3.423   5.789
   64    HA2  GLY  10           HA2      GLY  10  33.285   3.265   6.348
   65    HA3  GLY  10           HA3      GLY  10  33.764   1.835   5.428
   66    H    ASP  11           H        ASP  11  32.767   1.912   8.089
   67    HA   ASP  11           HA       ASP  11  34.682   0.305   9.552
   68    HB2  ASP  11           HB2      ASP  11  34.885   1.739  11.504
   69    HB3  ASP  11           HB3      ASP  11  35.538   2.560  10.106
   70    H    LYS  12           H        LYS  12  33.652  -0.007  11.922
   71    HA   LYS  12           HA       LYS  12  30.694   0.083  11.871
   72    HB2  LYS  12           HB2      LYS  12  31.797  -2.266  11.136
   73    HB3  LYS  12           HB3      LYS  12  32.014  -2.448  12.866
   74    HG2  LYS  12           HG2      LYS  12  29.941  -3.478  12.466
   75    HG3  LYS  12           HG3      LYS  12  29.484  -1.894  13.078
   76    HD2  LYS  12           HD2      LYS  12  28.058  -2.327  11.222
   77    HD3  LYS  12           HD3      LYS  12  29.233  -1.147  10.630
   78    HE2  LYS  12           HE2      LYS  12  30.564  -3.051   9.640
   79    HE3  LYS  12           HE3      LYS  12  29.318  -4.171  10.197
   80    HZ1  LYS  12           HZ1      LYS  12  28.897  -1.972   8.242
   81    HZ2  LYS  12           HZ2      LYS  12  27.725  -2.989   8.766
   82    HZ3  LYS  12           HZ3      LYS  12  28.971  -3.563   7.883
   83    H    ALA  13           H        ALA  13  29.808   0.544  13.784
   84    HA   ALA  13           HA       ALA  13  31.453   0.596  16.271
   85    HB1  ALA  13           HB1      ALA  13  29.836   2.919  15.135
   86    HB2  ALA  13           HB2      ALA  13  30.742   2.910  16.666
   87    HB3  ALA  13           HB3      ALA  13  31.609   2.783  15.129
   88    H    ALA  14           H        ALA  14  29.325  -1.223  15.392
   89    HA   ALA  14           HA       ALA  14  27.004  -0.604  17.113
   90    HB1  ALA  14           HB1      ALA  14  26.704  -1.430  14.796
   91    HB2  ALA  14           HB2      ALA  14  27.578  -2.923  15.216
   92    HB3  ALA  14           HB3      ALA  14  26.019  -2.550  15.986
   93    H    TYR  15           H        TYR  15  29.918  -1.646  17.957
   94    HA   TYR  15           HA       TYR  15  29.466  -4.160  19.284
   95    HB2  TYR  15           HB2      TYR  15  31.620  -3.328  18.285
   96    HB3  TYR  15           HB3      TYR  15  31.768  -2.207  19.626
   97    HD1  TYR  15           HD1      TYR  15  31.440  -5.844  18.758
   98    HD2  TYR  15           HD2      TYR  15  32.786  -2.960  21.674
   99    HE1  TYR  15           HE1      TYR  15  32.525  -7.669  20.069
  100    HE2  TYR  15           HE2      TYR  15  33.867  -4.783  22.979
  101    HH   TYR  15           HH       TYR  15  34.285  -7.031  23.127
  102    H    ASP  16           H        ASP  16  27.446  -3.128  20.322
  103    HA   ASP  16           HA       ASP  16  26.251  -2.462  22.127
  104    HB2  ASP  16           HB2      ASP  16  28.570  -3.712  23.639
  105    HB3  ASP  16           HB3      ASP  16  26.965  -3.397  24.295
  106    H    ILE  17           H        ILE  17  28.032  -0.433  21.088
  107    HA   ILE  17           HA       ILE  17  28.398   1.369  23.446
  108    HB   ILE  17           HB       ILE  17  30.479   0.740  22.432
  109   HG12  ILE  17          HG12      ILE  17  29.796   3.623  21.693
  110   HG13  ILE  17          HG13      ILE  17  30.215   3.039  23.311
  111   HG21  ILE  17          HG21      ILE  17  29.688   0.165  20.130
  112   HG22  ILE  17          HG22      ILE  17  29.507   1.894  19.786
  113   HG23  ILE  17          HG23      ILE  17  31.099   1.197  20.117
  114   HD11  ILE  17          HD11      ILE  17  32.018   3.146  20.860
  115   HD12  ILE  17          HD12      ILE  17  32.140   4.084  22.353
  116   HD13  ILE  17          HD13      ILE  17  32.463   2.336  22.388
  117    H    LEU  18           H        LEU  18  26.849   1.081  20.325
  118    HA   LEU  18           HA       LEU  18  25.393   3.630  20.741
  119    HB2  LEU  18           HB2      LEU  18  26.596   2.697  18.107
  120    HB3  LEU  18           HB3      LEU  18  25.583   4.104  18.325
  121    HG   LEU  18           HG       LEU  18  28.367   3.817  19.505
  122   HD11  LEU  18          HD11      LEU  18  29.114   5.301  17.752
  123   HD12  LEU  18          HD12      LEU  18  27.487   5.431  17.096
  124   HD13  LEU  18          HD13      LEU  18  28.356   3.898  17.012
  125   HD21  LEU  18          HD21      LEU  18  28.222   6.304  19.744
  126   HD22  LEU  18          HD22      LEU  18  27.086   5.422  20.779
  127   HD23  LEU  18          HD23      LEU  18  26.487   6.214  19.282
  128    H    ARG  19           H        ARG  19  23.354   3.677  19.582
  129    HA   ARG  19           HA       ARG  19  22.312   1.051  18.545
  130    HB2  ARG  19           HB2      ARG  19  21.487   1.566  20.826
  131    HB3  ARG  19           HB3      ARG  19  20.831   3.096  20.267
  132    HG2  ARG  19           HG2      ARG  19  19.945   0.474  18.997
  133    HG3  ARG  19           HG3      ARG  19  19.304   0.979  20.561
  134    HD2  ARG  19           HD2      ARG  19  18.462   3.068  19.614
  135    HD3  ARG  19           HD3      ARG  19  19.079   2.630  18.016
  136    HE   ARG  19           HE       ARG  19  17.365   0.550  18.994
  137   HH11  ARG  19          HH11      ARG  19  17.123   3.774  17.667
  138   HH12  ARG  19          HH12      ARG  19  15.631   3.448  16.837
  139   HH21  ARG  19          HH21      ARG  19  15.354   0.233  18.079
  140   HH22  ARG  19          HH22      ARG  19  14.578   1.537  17.225
  141    H    ARG  20           H        ARG  20  21.317   1.133  16.632
  142    HA   ARG  20           HA       ARG  20  20.969   3.765  15.259
  143    HB2  ARG  20           HB2      ARG  20  22.585   1.883  14.371
  144    HB3  ARG  20           HB3      ARG  20  21.097   1.080  13.869
  145    HG2  ARG  20           HG2      ARG  20  20.576   3.454  12.745
  146    HG3  ARG  20           HG3      ARG  20  22.310   3.683  12.906
  147    HD2  ARG  20           HD2      ARG  20  20.842   1.510  11.364
  148    HD3  ARG  20           HD3      ARG  20  21.752   2.875  10.698
  149    HE   ARG  20           HE       ARG  20  23.415   1.177  12.370
  150   HH11  ARG  20          HH11      ARG  20  22.107   1.393   9.123
  151   HH12  ARG  20          HH12      ARG  20  23.308   0.316   8.468
  152   HH21  ARG  20          HH21      ARG  20  24.897  -0.227  11.470
  153   HH22  ARG  20          HH22      ARG  20  24.835  -0.573   9.766
  154    H    CYS  21           H        CYS  21  19.093   4.223  14.169
  155    HA   CYS  21           HA       CYS  21  16.684   2.630  14.905
  156    HB2  CYS  21           HB2      CYS  21  17.148   5.101  15.578
  157    HB3  CYS  21           HB3      CYS  21  16.828   5.470  13.882
  158    H    SER  22           H        SER  22  15.589   1.561  13.392
  159    HA   SER  22           HA       SER  22  16.698   1.100  10.835
  160    HB2  SER  22           HB2      SER  22  14.756  -0.396  10.507
  161    HB3  SER  22           HB3      SER  22  15.546  -0.622  12.075
  162    HG   SER  22           HG       SER  22  13.249  -0.532  12.249
  163    H    GLN  23           H        GLN  23  14.549   3.610  11.652
  164    HA   GLN  23           HA       GLN  23  13.814   4.040   8.775
  165    HB2  GLN  23           HB2      GLN  23  12.352   4.861  11.310
  166    HB3  GLN  23           HB3      GLN  23  11.926   5.397   9.688
  167    HG2  GLN  23           HG2      GLN  23  11.575   3.023   8.996
  168    HG3  GLN  23           HG3      GLN  23  11.926   2.512  10.648
  169   HE21  GLN  23          HE21      GLN  23   9.793   1.564  10.884
  170   HE22  GLN  23          HE22      GLN  23   8.384   2.601  11.049
  171    H    CYS  24           H        CYS  24  16.003   5.113  11.020
  172    HA   CYS  24           HA       CYS  24  15.923   7.945  10.071
  173    HB2  CYS  24           HB2      CYS  24  16.974   7.186  12.748
  174    HB3  CYS  24           HB3      CYS  24  16.318   8.697  12.205
  175    H    GLY  25           H        GLY  25  18.032   5.214  10.882
  176    HA2  GLY  25           HA2      GLY  25  20.119   4.688  10.100
  177    HA3  GLY  25           HA3      GLY  25  20.128   6.165   9.141
  178    H    ILE  26           H        ILE  26  19.720   7.708  11.826
  179    HA   ILE  26           HA       ILE  26  22.449   8.257  12.482
  180    HB   ILE  26           HB       ILE  26  20.636   9.874  12.724
  181   HG12  ILE  26          HG12      ILE  26  21.050  10.833  14.931
  182   HG13  ILE  26          HG13      ILE  26  21.832   9.363  15.472
  183   HG21  ILE  26          HG21      ILE  26  18.979   9.771  14.555
  184   HG22  ILE  26          HG22      ILE  26  18.785   8.404  13.451
  185   HG23  ILE  26          HG23      ILE  26  19.575   8.161  15.027
  186   HD11  ILE  26          HD11      ILE  26  22.799  11.158  13.202
  187   HD12  ILE  26          HD12      ILE  26  23.456  11.121  14.847
  188   HD13  ILE  26          HD13      ILE  26  23.641   9.713  13.795
  189    H    LEU  27           H        LEU  27  23.585   7.894  14.452
  190    HA   LEU  27           HA       LEU  27  22.813   5.482  16.040
  191    HB2  LEU  27           HB2      LEU  27  25.594   6.438  15.200
  192    HB3  LEU  27           HB3      LEU  27  25.260   5.240  16.433
  193    HG   LEU  27           HG       LEU  27  24.033   3.891  14.598
  194   HD11  LEU  27          HD11      LEU  27  24.061   5.611  12.797
  195   HD12  LEU  27          HD12      LEU  27  24.991   4.194  12.325
  196   HD13  LEU  27          HD13      LEU  27  25.830   5.664  12.867
  197   HD21  LEU  27          HD21      LEU  27  27.059   4.274  14.545
  198   HD22  LEU  27          HD22      LEU  27  26.184   2.860  13.912
  199   HD23  LEU  27          HD23      LEU  27  26.154   3.210  15.646
  200    H    LEU  28           H        LEU  28  22.562   5.855  18.168
  201    HA   LEU  28           HA       LEU  28  23.745   8.319  19.410
  202    HB2  LEU  28           HB2      LEU  28  21.077   6.997  20.059
  203    HB3  LEU  28           HB3      LEU  28  21.803   8.320  20.936
  204    HG   LEU  28           HG       LEU  28  20.138   9.314  19.750
  205   HD11  LEU  28          HD11      LEU  28  22.326  10.503  19.499
  206   HD12  LEU  28          HD12      LEU  28  21.133  10.876  18.241
  207   HD13  LEU  28          HD13      LEU  28  22.480   9.788  17.885
  208   HD21  LEU  28          HD21      LEU  28  19.613   9.069  17.409
  209   HD22  LEU  28          HD22      LEU  28  19.557   7.499  18.231
  210   HD23  LEU  28          HD23      LEU  28  20.934   7.906  17.186
  211    HA   PRO  29           HA       PRO  29  25.582   5.404  22.223
  212    HB2  PRO  29           HB2      PRO  29  26.279   7.010  24.350
  213    HB3  PRO  29           HB3      PRO  29  27.096   7.022  22.763
  214    HG2  PRO  29           HG2      PRO  29  24.945   8.913  23.757
  215    HG3  PRO  29           HG3      PRO  29  26.473   9.311  22.915
  216    HD2  PRO  29           HD2      PRO  29  24.092   9.150  21.596
  217    HD3  PRO  29           HD3      PRO  29  25.621   8.627  20.837
  218    H    LEU  30           H        LEU  30  23.717   7.545  24.408
  219    HA   LEU  30           HA       LEU  30  21.812   5.519  25.166
  220    HB2  LEU  30           HB2      LEU  30  24.390   5.483  26.524
  221    HB3  LEU  30           HB3      LEU  30  23.150   5.924  27.682
  222    HG   LEU  30           HG       LEU  30  22.879   3.484  25.880
  223   HD11  LEU  30          HD11      LEU  30  23.610   2.167  27.816
  224   HD12  LEU  30          HD12      LEU  30  23.958   3.660  28.722
  225   HD13  LEU  30          HD13      LEU  30  24.891   3.253  27.262
  226   HD21  LEU  30          HD21      LEU  30  21.246   2.771  27.562
  227   HD22  LEU  30          HD22      LEU  30  20.768   4.338  26.889
  228   HD23  LEU  30          HD23      LEU  30  21.520   4.257  28.499
  229    HA   PRO  31           HA       PRO  31  20.917   9.336  27.867
  230    HB2  PRO  31           HB2      PRO  31  22.531  11.577  27.811
  231    HB3  PRO  31           HB3      PRO  31  22.722  10.218  28.959
  232    HG2  PRO  31           HG2      PRO  31  24.217  10.691  26.365
  233    HG3  PRO  31           HG3      PRO  31  24.885  10.245  27.967
  234    HD2  PRO  31           HD2      PRO  31  24.462   8.380  26.058
  235    HD3  PRO  31           HD3      PRO  31  24.124   8.024  27.774
  236    H    ILE  32           H        ILE  32  22.548  10.147  24.797
  237    HA   ILE  32           HA       ILE  32  20.601  12.144  24.000
  238    HB   ILE  32           HB       ILE  32  22.560  10.650  22.225
  239   HG12  ILE  32          HG12      ILE  32  23.003  13.212  23.811
  240   HG13  ILE  32          HG13      ILE  32  23.766  11.662  24.133
  241   HG21  ILE  32          HG21      ILE  32  22.385  12.680  20.785
  242   HG22  ILE  32          HG22      ILE  32  20.806  11.958  20.999
  243   HG23  ILE  32          HG23      ILE  32  21.246  13.397  21.938
  244   HD11  ILE  32          HD11      ILE  32  25.394  12.990  23.030
  245   HD12  ILE  32          HD12      ILE  32  24.872  11.732  21.890
  246   HD13  ILE  32          HD13      ILE  32  24.292  13.415  21.711
  247    H    LEU  33           H        LEU  33  20.787   8.627  23.645
  248    HA   LEU  33           HA       LEU  33  18.973   8.279  21.504
  249    HB2  LEU  33           HB2      LEU  33  20.430   6.494  22.439
  250    HB3  LEU  33           HB3      LEU  33  19.466   6.489  23.913
  251    HG   LEU  33           HG       LEU  33  17.485   5.716  22.636
  252   HD11  LEU  33          HD11      LEU  33  18.145   6.631  20.372
  253   HD12  LEU  33          HD12      LEU  33  17.644   4.944  20.367
  254   HD13  LEU  33          HD13      LEU  33  19.377   5.355  20.278
  255   HD21  LEU  33          HD21      LEU  33  18.932   4.092  23.729
  256   HD22  LEU  33          HD22      LEU  33  19.986   4.025  22.300
  257   HD23  LEU  33          HD23      LEU  33  18.307   3.432  22.209
  258    H    ASN  34           H        ASN  34  18.288   9.104  24.863
  259    HA   ASN  34           HA       ASN  34  15.551   8.432  25.038
  260    HB2  ASN  34           HB2      ASN  34  17.091  10.802  26.185
  261    HB3  ASN  34           HB3      ASN  34  15.460  10.358  26.673
  262   HD21  ASN  34          HD21      ASN  34  18.301  10.316  27.998
  263   HD22  ASN  34          HD22      ASN  34  18.246   8.762  28.823
  264    H    GLN  35           H        GLN  35  16.972  11.448  23.623
  265    HA   GLN  35           HA       GLN  35  14.392  12.613  23.088
  266    HB2  GLN  35           HB2      GLN  35  15.498  14.392  22.163
  267    HB3  GLN  35           HB3      GLN  35  16.696  13.759  23.283
  268    HG2  GLN  35           HG2      GLN  35  17.711  12.542  21.215
  269    HG3  GLN  35           HG3      GLN  35  16.618  13.511  20.246
  270   HE21  GLN  35          HE21      GLN  35  18.838  14.129  19.307
  271   HE22  GLN  35          HE22      GLN  35  19.632  15.497  20.075
  272    H    HIS  36           H        HIS  36  16.505  10.480  21.216
  273    HA   HIS  36           HA       HIS  36  15.007  10.630  18.748
  274    HB2  HIS  36           HB2      HIS  36  17.423   9.836  19.075
  275    HB3  HIS  36           HB3      HIS  36  16.747   8.317  19.686
  276    HD1  HIS  36           HD1      HIS  36  17.265  10.274  16.480
  277    HD2  HIS  36           HD2      HIS  36  15.221   6.856  17.855
  278    HE1  HIS  36           HE1      HIS  36  16.466   9.067  14.402
  279    H    GLN  37           H        GLN  37  14.934   8.389  21.563
  280    HA   GLN  37           HA       GLN  37  13.039   6.573  20.532
  281    HB2  GLN  37           HB2      GLN  37  14.537   6.505  22.705
  282    HB3  GLN  37           HB3      GLN  37  13.183   7.315  23.469
  283    HG2  GLN  37           HG2      GLN  37  12.533   5.179  23.898
  284    HG3  GLN  37           HG3      GLN  37  11.831   5.262  22.289
  285   HE21  GLN  37          HE21      GLN  37  13.757   4.670  20.467
  286   HE22  GLN  37          HE22      GLN  37  14.626   3.218  20.924
  287    H    GLU  38           H        GLU  38  12.450   9.523  22.528
  288    HA   GLU  38           HA       GLU  38   9.577   9.306  22.413
  289    HB2  GLU  38           HB2      GLU  38  11.341  11.746  22.859
  290    HB3  GLU  38           HB3      GLU  38   9.581  11.695  23.052
  291    HG2  GLU  38           HG2      GLU  38   9.922   9.774  24.711
  292    HG3  GLU  38           HG3      GLU  38  11.644  10.170  24.693
  293    H    LYS  39           H        LYS  39  11.898  10.997  20.225
  294    HA   LYS  39           HA       LYS  39   9.878  12.208  18.606
  295    HB2  LYS  39           HB2      LYS  39  12.157  13.007  18.521
  296    HB3  LYS  39           HB3      LYS  39  12.752  11.436  18.000
  297    HG2  LYS  39           HG2      LYS  39  12.724  12.971  16.132
  298    HG3  LYS  39           HG3      LYS  39  11.597  11.656  15.849
  299    HD2  LYS  39           HD2      LYS  39   9.750  13.287  16.709
  300    HD3  LYS  39           HD3      LYS  39  10.964  14.552  16.545
  301    HE2  LYS  39           HE2      LYS  39   9.990  12.666  14.354
  302    HE3  LYS  39           HE3      LYS  39   9.439  14.319  14.584
  303    HZ1  LYS  39           HZ1      LYS  39  11.143  14.214  12.872
  304    HZ2  LYS  39           HZ2      LYS  39  12.228  13.557  13.900
  305    HZ3  LYS  39           HZ3      LYS  39  11.698  15.091  14.133
  306    H    CYS  40           H        CYS  40  11.621   9.083  18.040
  307    HA   CYS  40           HA       CYS  40  10.176   8.350  15.712
  308    HB2  CYS  40           HB2      CYS  40  11.706   6.843  17.832
  309    HB3  CYS  40           HB3      CYS  40  10.771   5.955  16.632
  310    H    ARG  41           H        ARG  41   9.409   7.649  19.163
  311    HA   ARG  41           HA       ARG  41   6.966   6.219  18.714
  312    HB2  ARG  41           HB2      ARG  41   7.986   7.946  21.001
  313    HB3  ARG  41           HB3      ARG  41   6.403   7.199  21.066
  314    HG2  ARG  41           HG2      ARG  41   8.957   5.591  20.642
  315    HG3  ARG  41           HG3      ARG  41   8.258   5.950  22.221
  316    HD2  ARG  41           HD2      ARG  41   6.067   4.896  21.306
  317    HD3  ARG  41           HD3      ARG  41   7.048   4.302  19.970
  318    HE   ARG  41           HE       ARG  41   8.008   2.719  21.366
  319   HH11  ARG  41          HH11      ARG  41   6.332   5.006  23.438
  320   HH12  ARG  41          HH12      ARG  41   6.562   4.023  24.856
  321   HH21  ARG  41          HH21      ARG  41   8.255   1.520  23.224
  322   HH22  ARG  41          HH22      ARG  41   7.620   2.111  24.733
  323    H    TRP  42           H        TRP  42   7.418   9.751  19.254
  324    HA   TRP  42           HA       TRP  42   4.654  10.387  19.012
  325    HB2  TRP  42           HB2      TRP  42   6.504  11.845  19.935
  326    HB3  TRP  42           HB3      TRP  42   6.974  12.206  18.278
  327    HD1  TRP  42           HD1      TRP  42   4.423  12.970  20.937
  328    HE1  TRP  42           HE1      TRP  42   2.815  14.828  20.197
  329    HE3  TRP  42           HE3      TRP  42   5.831  13.363  16.015
  330    HZ2  TRP  42           HZ2      TRP  42   2.158  16.238  17.774
  331    HZ3  TRP  42           HZ3      TRP  42   4.682  14.976  14.514
  332    HH2  TRP  42           HH2      TRP  42   2.838  16.402  15.374
  333    H    LEU  43           H        LEU  43   7.228  10.417  16.494
  334    HA   LEU  43           HA       LEU  43   5.545  11.332  14.399
  335    HB2  LEU  43           HB2      LEU  43   8.103  11.313  14.548
  336    HB3  LEU  43           HB3      LEU  43   8.037   9.607  14.134
  337    HG   LEU  43           HG       LEU  43   6.827  10.275  11.993
  338   HD11  LEU  43          HD11      LEU  43   6.015  12.539  12.637
  339   HD12  LEU  43          HD12      LEU  43   7.116  12.662  11.252
  340   HD13  LEU  43          HD13      LEU  43   7.700  13.077  12.891
  341   HD21  LEU  43          HD21      LEU  43   9.606  11.428  12.445
  342   HD22  LEU  43          HD22      LEU  43   8.887  11.064  10.876
  343   HD23  LEU  43          HD23      LEU  43   9.236   9.760  12.005
  344    H    ALA  44           H        ALA  44   6.414   7.962  15.347
  345    HA   ALA  44           HA       ALA  44   4.886   6.689  13.281
  346    HB1  ALA  44           HB1      ALA  44   5.670   5.711  16.068
  347    HB2  ALA  44           HB2      ALA  44   5.106   4.688  14.728
  348    HB3  ALA  44           HB3      ALA  44   6.650   5.551  14.590
  349    H    SER  45           H        SER  45   3.973   7.827  16.551
  350    HA   SER  45           HA       SER  45   1.310   6.737  16.539
  351    HB2  SER  45           HB2      SER  45   2.577   7.428  18.567
  352    HB3  SER  45           HB3      SER  45   2.423   9.120  18.070
  353    HG   SER  45           HG       SER  45   0.365   7.289  18.812
  354    H    SER  46           H        SER  46   2.547  10.035  15.662
  355    HA   SER  46           HA       SER  46  -0.072  11.074  15.061
  356    HB2  SER  46           HB2      SER  46   1.067  13.015  14.228
  357    HB3  SER  46           HB3      SER  46   1.845  12.481  15.725
  358    HG   SER  46           HG       SER  46   3.388  12.984  14.150
  359    H    LYS  47           H        LYS  47   2.419   9.560  13.029
  360    HA   LYS  47           HA       LYS  47   0.945   9.887  10.540
  361    HB2  LYS  47           HB2      LYS  47   3.492   9.704  10.879
  362    HB3  LYS  47           HB3      LYS  47   3.250   7.982  11.111
  363    HG2  LYS  47           HG2      LYS  47   3.919   8.321   8.855
  364    HG3  LYS  47           HG3      LYS  47   2.203   7.923   8.780
  365    HD2  LYS  47           HD2      LYS  47   1.639  10.313   8.454
  366    HD3  LYS  47           HD3      LYS  47   3.319  10.763   8.744
  367    HE2  LYS  47           HE2      LYS  47   2.982  10.868   6.397
  368    HE3  LYS  47           HE3      LYS  47   4.003   9.470   6.720
  369    HZ1  LYS  47           HZ1      LYS  47   1.077   9.369   6.189
  370    HZ2  LYS  47           HZ2      LYS  47   2.023   8.059   6.466
  371    HZ3  LYS  47           HZ3      LYS  47   2.241   8.960   5.123
  372    H    GLY  48           H        GLY  48  -0.966   9.028  11.939
  373    HA2  GLY  48           HA2      GLY  48  -1.525   6.379  12.571
  374    HA3  GLY  48           HA3      GLY  48  -2.724   7.560  12.069
  375    H    LYS  49           H        LYS  49  -0.709   4.911  11.063
  376    HA   LYS  49           HA       LYS  49  -1.272   4.896   8.269
  377    HB2  LYS  49           HB2      LYS  49   0.579   3.727   9.884
  378    HB3  LYS  49           HB3      LYS  49  -0.527   2.375   9.756
  379    HG2  LYS  49           HG2      LYS  49   1.140   2.079   8.100
  380    HG3  LYS  49           HG3      LYS  49  -0.301   2.584   7.209
  381    HD2  LYS  49           HD2      LYS  49   0.606   4.877   6.996
  382    HD3  LYS  49           HD3      LYS  49   1.943   4.461   8.068
  383    HE2  LYS  49           HE2      LYS  49   2.833   4.429   5.880
  384    HE3  LYS  49           HE3      LYS  49   2.723   2.752   6.407
  385    HZ1  LYS  49           HZ1      LYS  49   0.710   2.528   5.044
  386    HZ2  LYS  49           HZ2      LYS  49   1.934   3.069   4.120
  387    HZ3  LYS  49           HZ3      LYS  49   0.777   4.108   4.604
  388    H    GLN  50           H        GLN  50  -2.244   3.078   7.086
  389    HA   GLN  50           HA       GLN  50  -4.772   2.047   8.301
  390    HB2  GLN  50           HB2      GLN  50  -5.938   2.513   6.254
  391    HB3  GLN  50           HB3      GLN  50  -5.168   3.958   6.868
  392    HG2  GLN  50           HG2      GLN  50  -4.795   4.133   4.595
  393    HG3  GLN  50           HG3      GLN  50  -3.263   3.503   5.161
  394   HE21  GLN  50          HE21      GLN  50  -2.477   1.792   3.865
  395   HE22  GLN  50          HE22      GLN  50  -3.522   0.754   2.910
  396    H    VAL  51           H        VAL  51  -2.004   0.792   7.760
  397    HA   VAL  51           HA       VAL  51  -2.304  -1.352   5.879
  398    HB   VAL  51           HB       VAL  51  -0.506  -2.475   7.217
  399   HG11  VAL  51          HG11      VAL  51   0.029   0.415   6.448
  400   HG12  VAL  51          HG12      VAL  51   1.247  -0.863   6.656
  401   HG13  VAL  51          HG13      VAL  51   0.042  -0.990   5.364
  402   HG21  VAL  51          HG21      VAL  51  -1.045  -1.575   9.475
  403   HG22  VAL  51          HG22      VAL  51   0.636  -1.295   9.008
  404   HG23  VAL  51          HG23      VAL  51  -0.525   0.039   8.944
  405    H    ARG  52           H        ARG  52  -2.469  -3.616   6.328
  406    HA   ARG  52           HA       ARG  52  -4.805  -4.442   7.743
  407    HB2  ARG  52           HB2      ARG  52  -2.406  -6.079   6.802
  408    HB3  ARG  52           HB3      ARG  52  -3.958  -6.744   7.322
  409    HG2  ARG  52           HG2      ARG  52  -5.103  -5.532   5.459
  410    HG3  ARG  52           HG3      ARG  52  -3.550  -4.870   4.945
  411    HD2  ARG  52           HD2      ARG  52  -3.983  -6.668   3.505
  412    HD3  ARG  52           HD3      ARG  52  -2.709  -7.218   4.603
  413    HE   ARG  52           HE       ARG  52  -5.118  -8.047   5.774
  414   HH11  ARG  52          HH11      ARG  52  -3.531  -8.713   2.721
  415   HH12  ARG  52          HH12      ARG  52  -4.315 -10.260   2.546
  416   HH21  ARG  52          HH21      ARG  52  -6.072 -10.038   5.495
  417   HH22  ARG  52          HH22      ARG  52  -5.708 -10.986   4.083
  418    H    ASN  53           H        ASN  53  -5.175  -5.226   9.721
  419    HA   ASN  53           HA       ASN  53  -2.967  -5.584  11.690
  420    HB2  ASN  53           HB2      ASN  53  -3.649  -3.205  11.747
  421    HB3  ASN  53           HB3      ASN  53  -5.327  -3.672  12.014
  422   HD21  ASN  53          HD21      ASN  53  -5.916  -4.542  14.108
  423   HD22  ASN  53          HD22      ASN  53  -4.834  -4.339  15.482
  424    H    PHE  54           H        PHE  54  -3.332  -7.754  11.878
  425    HA   PHE  54           HA       PHE  54  -5.782  -8.621  13.280
  426    HB2  PHE  54           HB2      PHE  54  -6.038  -8.807  10.703
  427    HB3  PHE  54           HB3      PHE  54  -4.832 -10.079  10.787
  428    HD1  PHE  54           HD1      PHE  54  -8.238  -9.017  11.830
  429    HD2  PHE  54           HD2      PHE  54  -5.458 -12.303  11.619
  430    HE1  PHE  54           HE1      PHE  54 -10.077 -10.604  12.354
  431    HE2  PHE  54           HE2      PHE  54  -7.295 -13.890  12.145
  432    HZ   PHE  54           HZ       PHE  54  -9.605 -13.041  12.510
  433    H    SER  55           H        SER  55  -5.482 -10.446  14.545
  434    HA   SER  55           HA       SER  55  -2.915 -10.868  15.665
  435    HB2  SER  55           HB2      SER  55  -5.407 -12.600  15.907
  436    HB3  SER  55           HB3      SER  55  -4.013 -12.611  17.003
  437    HG   SER  55           HG       SER  55  -4.458 -10.405  17.507
  Start of MODEL   14
    1    H1   GLY   1           H1       GLY   1   5.574  18.754   8.775
    2    H2   GLY   1           H2       GLY   1   4.031  19.208   9.075
    3    H3   GLY   1           H3       GLY   1   5.097  19.060  10.309
    4    HA2  GLY   1           HA2      GLY   1   4.484  21.388   9.115
    5    HA3  GLY   1           HA3      GLY   1   5.960  21.092  10.049
    6    H    SER   2           H        SER   2   7.841  21.376   9.057
    7    HA   SER   2           HA       SER   2   8.106  21.110   6.091
    8    HB2  SER   2           HB2      SER   2   9.100  23.440   7.785
    9    HB3  SER   2           HB3      SER   2   9.472  23.172   6.075
   10    HG   SER   2           HG       SER   2   7.728  24.643   6.370
   11    H    GLU   3           H        GLU   3  10.222  20.665   5.371
   12    HA   GLU   3           HA       GLU   3  11.946  19.212   7.236
   13    HB2  GLU   3           HB2      GLU   3  13.254  18.662   5.280
   14    HB3  GLU   3           HB3      GLU   3  11.541  18.384   4.983
   15    HG2  GLU   3           HG2      GLU   3  11.460  20.617   3.769
   16    HG3  GLU   3           HG3      GLU   3  13.211  20.722   3.961
   17    H    PHE   4           H        PHE   4  14.295  19.574   7.284
   18    HA   PHE   4           HA       PHE   4  15.209  22.403   7.162
   19    HB2  PHE   4           HB2      PHE   4  15.464  20.589   9.597
   20    HB3  PHE   4           HB3      PHE   4  16.154  22.193   9.435
   21    HD1  PHE   4           HD1      PHE   4  14.489  24.181   9.003
   22    HD2  PHE   4           HD2      PHE   4  13.345  20.354  10.629
   23    HE1  PHE   4           HE1      PHE   4  12.456  25.208   9.996
   24    HE2  PHE   4           HE2      PHE   4  11.317  21.385  11.625
   25    HZ   PHE   4           HZ       PHE   4  10.870  23.812  11.309
   26    H    THR   5           H        THR   5  17.640  22.475   7.675
   27    HA   THR   5           HA       THR   5  19.134  20.695   5.995
   28    HB   THR   5           HB       THR   5  19.787  23.015   6.596
   29    HG1  THR   5           HG1      THR   5  21.958  21.461   7.325
   30   HG21  THR   5          HG21      THR   5  20.833  21.822   9.205
   31   HG22  THR   5          HG22      THR   5  19.470  22.952   9.066
   32   HG23  THR   5          HG23      THR   5  21.096  23.468   8.595
   33    H    SER   6           H        SER   6  20.767  19.172   6.557
   34    HA   SER   6           HA       SER   6  20.765  17.987   9.264
   35    HB2  SER   6           HB2      SER   6  18.964  16.796   8.016
   36    HB3  SER   6           HB3      SER   6  20.158  16.308   6.798
   37    HG   SER   6           HG       SER   6  19.818  14.722   8.465
   38    H    SER   7           H        SER   7  22.788  17.779   9.807
   39    HA   SER   7           HA       SER   7  24.942  17.199   7.814
   40    HB2  SER   7           HB2      SER   7  24.967  19.447   9.861
   41    HB3  SER   7           HB3      SER   7  26.304  18.986   8.788
   42    HG   SER   7           HG       SER   7  25.087  20.752   7.965
   43    HA   PRO   8           HA       PRO   8  25.197  14.796  11.866
   44    HB2  PRO   8           HB2      PRO   8  25.050  12.228  10.941
   45    HB3  PRO   8           HB3      PRO   8  23.603  13.245  11.214
   46    HG2  PRO   8           HG2      PRO   8  25.082  12.792   8.596
   47    HG3  PRO   8           HG3      PRO   8  23.323  12.632   8.911
   48    HD2  PRO   8           HD2      PRO   8  24.378  14.907   7.863
   49    HD3  PRO   8           HD3      PRO   8  23.039  14.961   9.049
   50    H    ARG   9           H        ARG   9  26.844  13.308  12.602
   51    HA   ARG   9           HA       ARG   9  29.522  13.760  11.579
   52    HB2  ARG   9           HB2      ARG   9  28.379  11.854  13.671
   53    HB3  ARG   9           HB3      ARG   9  30.105  12.017  13.343
   54    HG2  ARG   9           HG2      ARG   9  30.069  14.388  13.932
   55    HG3  ARG   9           HG3      ARG   9  28.330  14.338  14.237
   56    HD2  ARG   9           HD2      ARG   9  30.374  12.652  15.741
   57    HD3  ARG   9           HD3      ARG   9  29.785  14.233  16.281
   58    HE   ARG   9           HE       ARG   9  27.563  12.483  15.745
   59   HH11  ARG   9          HH11      ARG   9  30.003  13.021  18.196
   60   HH12  ARG   9          HH12      ARG   9  28.993  12.395  19.470
   61   HH21  ARG   9          HH21      ARG   9  26.331  11.679  17.409
   62   HH22  ARG   9          HH22      ARG   9  26.967  11.659  19.026
   63    H    GLY  10           H        GLY  10  31.046  12.030  11.077
   64    HA2  GLY  10           HA2      GLY  10  30.215  10.330   8.882
   65    HA3  GLY  10           HA3      GLY  10  31.805  10.385   9.635
   66    H    ASP  11           H        ASP  11  31.209   8.009   8.917
   67    HA   ASP  11           HA       ASP  11  29.663   6.295  10.578
   68    HB2  ASP  11           HB2      ASP  11  30.539   5.764   8.314
   69    HB3  ASP  11           HB3      ASP  11  32.183   5.748   8.959
   70    H    LYS  12           H        LYS  12  30.304   4.761  12.180
   71    HA   LYS  12           HA       LYS  12  32.881   5.201  13.598
   72    HB2  LYS  12           HB2      LYS  12  30.909   6.525  14.657
   73    HB3  LYS  12           HB3      LYS  12  30.253   4.956  15.107
   74    HG2  LYS  12           HG2      LYS  12  31.450   5.613  17.015
   75    HG3  LYS  12           HG3      LYS  12  32.583   4.520  16.222
   76    HD2  LYS  12           HD2      LYS  12  33.693   6.602  15.191
   77    HD3  LYS  12           HD3      LYS  12  32.558   7.572  16.129
   78    HE2  LYS  12           HE2      LYS  12  34.480   7.588  17.448
   79    HE3  LYS  12           HE3      LYS  12  33.447   6.387  18.224
   80    HZ1  LYS  12           HZ1      LYS  12  35.709   5.798  16.375
   81    HZ2  LYS  12           HZ2      LYS  12  34.767   4.655  17.075
   82    HZ3  LYS  12           HZ3      LYS  12  35.736   5.594  17.989
   83    H    ALA  13           H        ALA  13  33.887   3.395  13.909
   84    HA   ALA  13           HA       ALA  13  32.806   0.833  13.189
   85    HB1  ALA  13           HB1      ALA  13  35.524   1.653  14.308
   86    HB2  ALA  13           HB2      ALA  13  35.144   0.124  13.484
   87    HB3  ALA  13           HB3      ALA  13  35.061   1.649  12.590
   88    H    ALA  14           H        ALA  14  31.258   1.536  15.380
   89    HA   ALA  14           HA       ALA  14  32.331   0.008  17.723
   90    HB1  ALA  14           HB1      ALA  14  30.636   1.210  19.019
   91    HB2  ALA  14           HB2      ALA  14  31.706   2.329  18.155
   92    HB3  ALA  14           HB3      ALA  14  30.066   2.029  17.547
   93    H    TYR  15           H        TYR  15  29.028   0.490  16.366
   94    HA   TYR  15           HA       TYR  15  27.190  -0.799  16.442
   95    HB2  TYR  15           HB2      TYR  15  28.895  -1.709  14.541
   96    HB3  TYR  15           HB3      TYR  15  28.632  -3.198  15.410
   97    HD1  TYR  15           HD1      TYR  15  26.273  -4.173  15.505
   98    HD2  TYR  15           HD2      TYR  15  27.219  -0.653  13.195
   99    HE1  TYR  15           HE1      TYR  15  24.148  -4.430  14.243
  100    HE2  TYR  15           HE2      TYR  15  25.100  -0.932  11.914
  101    HH   TYR  15           HH       TYR  15  22.825  -3.630  12.568
  102    H    ASP  16           H        ASP  16  28.647  -0.896  18.986
  103    HA   ASP  16           HA       ASP  16  27.448  -3.383  20.162
  104    HB2  ASP  16           HB2      ASP  16  30.242  -2.265  20.578
  105    HB3  ASP  16           HB3      ASP  16  29.452  -3.267  21.785
  106    H    ILE  17           H        ILE  17  29.048  -0.323  21.269
  107    HA   ILE  17           HA       ILE  17  27.081  -0.063  23.430
  108    HB   ILE  17           HB       ILE  17  29.338   0.461  23.884
  109   HG12  ILE  17          HG12      ILE  17  27.399   1.734  24.971
  110   HG13  ILE  17          HG13      ILE  17  29.047   2.258  25.239
  111   HG21  ILE  17          HG21      ILE  17  30.555   2.405  23.008
  112   HG22  ILE  17          HG22      ILE  17  30.235   1.213  21.751
  113   HG23  ILE  17          HG23      ILE  17  29.271   2.705  21.827
  114   HD11  ILE  17          HD11      ILE  17  27.490   4.153  24.948
  115   HD12  ILE  17          HD12      ILE  17  28.790   4.166  23.752
  116   HD13  ILE  17          HD13      ILE  17  27.158   3.649  23.289
  117    H    LEU  18           H        LEU  18  27.759   1.654  20.366
  118    HA   LEU  18           HA       LEU  18  25.638   3.586  20.620
  119    HB2  LEU  18           HB2      LEU  18  26.924   2.400  18.119
  120    HB3  LEU  18           HB3      LEU  18  25.883   3.817  18.154
  121    HG   LEU  18           HG       LEU  18  28.643   3.607  19.428
  122   HD11  LEU  18          HD11      LEU  18  27.651   5.229  17.041
  123   HD12  LEU  18          HD12      LEU  18  28.576   3.709  16.926
  124   HD13  LEU  18          HD13      LEU  18  29.313   5.145  17.679
  125   HD21  LEU  18          HD21      LEU  18  28.433   6.078  19.730
  126   HD22  LEU  18          HD22      LEU  18  27.312   5.159  20.736
  127   HD23  LEU  18          HD23      LEU  18  26.720   5.970  19.259
  128    H    ARG  19           H        ARG  19  23.605   3.634  19.725
  129    HA   ARG  19           HA       ARG  19  22.448   1.099  18.619
  130    HB2  ARG  19           HB2      ARG  19  21.650   1.535  20.939
  131    HB3  ARG  19           HB3      ARG  19  21.125   3.143  20.453
  132    HG2  ARG  19           HG2      ARG  19  19.231   1.630  20.620
  133    HG3  ARG  19           HG3      ARG  19  19.420   2.163  18.951
  134    HD2  ARG  19           HD2      ARG  19  20.493   0.006  18.379
  135    HD3  ARG  19           HD3      ARG  19  20.381  -0.508  20.074
  136    HE   ARG  19           HE       ARG  19  17.772   0.132  19.357
  137   HH11  ARG  19          HH11      ARG  19  20.109  -2.171  18.117
  138   HH12  ARG  19          HH12      ARG  19  18.870  -3.259  17.556
  139   HH21  ARG  19          HH21      ARG  19  16.248  -1.320  18.644
  140   HH22  ARG  19          HH22      ARG  19  16.747  -2.791  17.861
  141    H    ARG  20           H        ARG  20  21.203   1.309  16.832
  142    HA   ARG  20           HA       ARG  20  20.923   4.020  15.616
  143    HB2  ARG  20           HB2      ARG  20  21.589   3.270  13.534
  144    HB3  ARG  20           HB3      ARG  20  22.727   2.484  14.629
  145    HG2  ARG  20           HG2      ARG  20  21.422   0.361  14.445
  146    HG3  ARG  20           HG3      ARG  20  20.313   1.169  13.317
  147    HD2  ARG  20           HD2      ARG  20  22.383   1.725  11.889
  148    HD3  ARG  20           HD3      ARG  20  23.278   0.623  12.931
  149    HE   ARG  20           HE       ARG  20  22.270  -1.194  11.904
  150   HH11  ARG  20          HH11      ARG  20  20.486   1.658  10.877
  151   HH12  ARG  20          HH12      ARG  20  19.645   0.786   9.629
  152   HH21  ARG  20          HH21      ARG  20  21.133  -2.235  10.327
  153   HH22  ARG  20          HH22      ARG  20  19.984  -1.371   9.345
  154    H    CYS  21           H        CYS  21  19.246   4.320  14.123
  155    HA   CYS  21           HA       CYS  21  16.753   2.850  14.832
  156    HB2  CYS  21           HB2      CYS  21  17.019   5.314  15.194
  157    HB3  CYS  21           HB3      CYS  21  17.195   5.507  13.442
  158    H    SER  22           H        SER  22  15.971   1.417  13.429
  159    HA   SER  22           HA       SER  22  17.059   0.830  10.859
  160    HB2  SER  22           HB2      SER  22  14.382   0.004  12.044
  161    HB3  SER  22           HB3      SER  22  15.203  -0.778  10.683
  162    HG   SER  22           HG       SER  22  16.863  -1.410  12.058
  163    H    GLN  23           H        GLN  23  15.064   3.404  11.600
  164    HA   GLN  23           HA       GLN  23  14.064   3.639   8.780
  165    HB2  GLN  23           HB2      GLN  23  12.266   3.261  10.430
  166    HB3  GLN  23           HB3      GLN  23  12.816   4.660  11.358
  167    HG2  GLN  23           HG2      GLN  23  12.301   6.132   9.397
  168    HG3  GLN  23           HG3      GLN  23  11.733   4.714   8.502
  169   HE21  GLN  23          HE21      GLN  23  11.164   6.485  11.621
  170   HE22  GLN  23          HE22      GLN  23   9.439   6.161  11.634
  171    H    CYS  24           H        CYS  24  15.295   5.498  11.639
  172    HA   CYS  24           HA       CYS  24  15.565   7.905  10.048
  173    HB2  CYS  24           HB2      CYS  24  16.647   7.426  12.827
  174    HB3  CYS  24           HB3      CYS  24  16.211   8.949  12.072
  175    H    GLY  25           H        GLY  25  17.791   5.317  10.938
  176    HA2  GLY  25           HA2      GLY  25  19.863   4.822  10.086
  177    HA3  GLY  25           HA3      GLY  25  19.837   6.312   9.150
  178    H    ILE  26           H        ILE  26  19.448   7.752  11.918
  179    HA   ILE  26           HA       ILE  26  22.182   8.425  12.447
  180    HB   ILE  26           HB       ILE  26  20.237   9.904  12.735
  181   HG12  ILE  26          HG12      ILE  26  21.779   9.639  15.344
  182   HG13  ILE  26          HG13      ILE  26  22.415  10.363  13.862
  183   HG21  ILE  26          HG21      ILE  26  18.742   9.762  14.625
  184   HG22  ILE  26          HG22      ILE  26  18.670   8.234  13.753
  185   HG23  ILE  26          HG23      ILE  26  19.584   8.334  15.263
  186   HD11  ILE  26          HD11      ILE  26  20.550  12.053  13.958
  187   HD12  ILE  26          HD12      ILE  26  20.089  11.378  15.543
  188   HD13  ILE  26          HD13      ILE  26  21.679  12.119  15.325
  189    H    LEU  27           H        LEU  27  23.343   8.201  14.487
  190    HA   LEU  27           HA       LEU  27  22.793   5.711  16.041
  191    HB2  LEU  27           HB2      LEU  27  25.510   6.784  15.139
  192    HB3  LEU  27           HB3      LEU  27  25.244   5.512  16.316
  193    HG   LEU  27           HG       LEU  27  23.937   4.305  14.388
  194   HD11  LEU  27          HD11      LEU  27  24.932   4.707  12.154
  195   HD12  LEU  27          HD12      LEU  27  25.809   6.117  12.795
  196   HD13  LEU  27          HD13      LEU  27  24.038   6.119  12.702
  197   HD21  LEU  27          HD21      LEU  27  26.974   4.549  14.389
  198   HD22  LEU  27          HD22      LEU  27  26.036   3.223  13.665
  199   HD23  LEU  27          HD23      LEU  27  26.004   3.465  15.416
  200    H    LEU  28           H        LEU  28  22.801   5.951  18.204
  201    HA   LEU  28           HA       LEU  28  23.886   8.446  19.460
  202    HB2  LEU  28           HB2      LEU  28  21.278   7.019  20.139
  203    HB3  LEU  28           HB3      LEU  28  21.984   8.312  21.065
  204    HG   LEU  28           HG       LEU  28  20.230   9.284  19.969
  205   HD11  LEU  28          HD11      LEU  28  22.521  10.029  18.137
  206   HD12  LEU  28          HD12      LEU  28  22.357  10.595  19.808
  207   HD13  LEU  28          HD13      LEU  28  21.127  11.013  18.597
  208   HD21  LEU  28          HD21      LEU  28  19.791   7.519  18.286
  209   HD22  LEU  28          HD22      LEU  28  21.067   8.206  17.266
  210   HD23  LEU  28          HD23      LEU  28  19.637   9.166  17.659
  211    HA   PRO  29           HA       PRO  29  25.827   5.531  22.206
  212    HB2  PRO  29           HB2      PRO  29  26.363   7.042  24.434
  213    HB3  PRO  29           HB3      PRO  29  27.208   7.225  22.872
  214    HG2  PRO  29           HG2      PRO  29  24.900   8.873  23.936
  215    HG3  PRO  29           HG3      PRO  29  26.409   9.442  23.163
  216    HD2  PRO  29           HD2      PRO  29  24.059   9.184  21.789
  217    HD3  PRO  29           HD3      PRO  29  25.641   8.858  21.022
  218    H    LEU  30           H        LEU  30  23.778   7.452  24.443
  219    HA   LEU  30           HA       LEU  30  21.951   5.287  25.020
  220    HB2  LEU  30           HB2      LEU  30  23.766   4.298  26.186
  221    HB3  LEU  30           HB3      LEU  30  24.248   5.803  26.934
  222    HG   LEU  30           HG       LEU  30  22.204   5.755  28.357
  223   HD11  LEU  30          HD11      LEU  30  20.655   4.481  26.912
  224   HD12  LEU  30          HD12      LEU  30  20.853   3.682  28.472
  225   HD13  LEU  30          HD13      LEU  30  21.696   3.048  27.044
  226   HD21  LEU  30          HD21      LEU  30  23.800   3.157  28.417
  227   HD22  LEU  30          HD22      LEU  30  22.882   3.869  29.768
  228   HD23  LEU  30          HD23      LEU  30  24.307   4.711  29.128
  229    HA   PRO  31           HA       PRO  31  20.610   8.876  27.763
  230    HB2  PRO  31           HB2      PRO  31  22.039  11.223  28.036
  231    HB3  PRO  31           HB3      PRO  31  22.206   9.793  29.095
  232    HG2  PRO  31           HG2      PRO  31  23.937  10.582  26.746
  233    HG3  PRO  31           HG3      PRO  31  24.450  10.007  28.358
  234    HD2  PRO  31           HD2      PRO  31  24.349   8.333  26.229
  235    HD3  PRO  31           HD3      PRO  31  23.885   7.791  27.870
  236    H    ILE  32           H        ILE  32  22.366  10.124  24.873
  237    HA   ILE  32           HA       ILE  32  20.257  11.996  24.175
  238    HB   ILE  32           HB       ILE  32  22.469  10.899  22.398
  239   HG12  ILE  32          HG12      ILE  32  23.159  13.516  23.033
  240   HG13  ILE  32          HG13      ILE  32  22.435  13.001  24.543
  241   HG21  ILE  32          HG21      ILE  32  22.103  12.983  21.091
  242   HG22  ILE  32          HG22      ILE  32  20.682  11.952  21.067
  243   HG23  ILE  32          HG23      ILE  32  20.711  13.380  22.123
  244   HD11  ILE  32          HD11      ILE  32  24.762  11.694  23.060
  245   HD12  ILE  32          HD12      ILE  32  24.841  12.617  24.574
  246   HD13  ILE  32          HD13      ILE  32  24.040  11.035  24.541
  247    H    LEU  33           H        LEU  33  20.647   8.552  23.627
  248    HA   LEU  33           HA       LEU  33  18.851   8.196  21.448
  249    HB2  LEU  33           HB2      LEU  33  20.393   6.453  22.461
  250    HB3  LEU  33           HB3      LEU  33  19.283   6.366  23.828
  251    HG   LEU  33           HG       LEU  33  17.461   5.628  22.260
  252   HD11  LEU  33          HD11      LEU  33  18.096   4.721  20.064
  253   HD12  LEU  33          HD12      LEU  33  19.755   5.297  20.280
  254   HD13  LEU  33          HD13      LEU  33  18.420   6.457  20.112
  255   HD21  LEU  33          HD21      LEU  33  18.707   4.045  23.633
  256   HD22  LEU  33          HD22      LEU  33  19.960   3.911  22.382
  257   HD23  LEU  33          HD23      LEU  33  18.302   3.338  22.063
  258    H    ASN  34           H        ASN  34  18.176   8.960  24.841
  259    HA   ASN  34           HA       ASN  34  15.426   8.315  24.990
  260    HB2  ASN  34           HB2      ASN  34  16.850   9.083  26.888
  261    HB3  ASN  34           HB3      ASN  34  16.944  10.687  26.160
  262   HD21  ASN  34          HD21      ASN  34  15.779  11.995  27.540
  263   HD22  ASN  34          HD22      ASN  34  14.140  11.631  28.060
  264    H    GLN  35           H        GLN  35  16.948  11.312  23.664
  265    HA   GLN  35           HA       GLN  35  14.472  12.601  22.961
  266    HB2  GLN  35           HB2      GLN  35  16.665  13.751  23.192
  267    HB3  GLN  35           HB3      GLN  35  17.247  12.927  21.738
  268    HG2  GLN  35           HG2      GLN  35  15.497  14.046  20.387
  269    HG3  GLN  35           HG3      GLN  35  14.825  14.785  21.842
  270   HE21  GLN  35          HE21      GLN  35  15.633  16.831  22.405
  271   HE22  GLN  35          HE22      GLN  35  17.083  17.519  21.685
  272    H    HIS  36           H        HIS  36  16.603  10.321  21.185
  273    HA   HIS  36           HA       HIS  36  15.145  10.464  18.718
  274    HB2  HIS  36           HB2      HIS  36  17.481   9.456  19.110
  275    HB3  HIS  36           HB3      HIS  36  16.642   7.998  19.660
  276    HD1  HIS  36           HD1      HIS  36  17.191  10.142  16.557
  277    HD2  HIS  36           HD2      HIS  36  15.132   6.678  17.726
  278    HE1  HIS  36           HE1      HIS  36  16.284   9.132  14.429
  279    H    GLN  37           H        GLN  37  14.827   8.213  21.523
  280    HA   GLN  37           HA       GLN  37  12.755   6.604  20.392
  281    HB2  GLN  37           HB2      GLN  37  13.408   7.274  23.294
  282    HB3  GLN  37           HB3      GLN  37  12.187   6.097  22.812
  283    HG2  GLN  37           HG2      GLN  37  15.156   5.938  22.181
  284    HG3  GLN  37           HG3      GLN  37  14.302   4.987  23.384
  285   HE21  GLN  37          HE21      GLN  37  15.661   4.654  20.422
  286   HE22  GLN  37          HE22      GLN  37  14.570   3.453  19.744
  287    H    GLU  38           H        GLU  38  12.463   9.578  22.447
  288    HA   GLU  38           HA       GLU  38   9.596   9.594  22.357
  289    HB2  GLU  38           HB2      GLU  38  11.527  11.926  22.672
  290    HB3  GLU  38           HB3      GLU  38   9.784  12.004  22.926
  291    HG2  GLU  38           HG2      GLU  38  11.779  10.383  24.554
  292    HG3  GLU  38           HG3      GLU  38  10.907  11.817  25.064
  293    H    LYS  39           H        LYS  39  11.958  11.109  20.072
  294    HA   LYS  39           HA       LYS  39   9.906  12.294  18.442
  295    HB2  LYS  39           HB2      LYS  39  12.140  13.152  18.305
  296    HB3  LYS  39           HB3      LYS  39  12.802  11.570  17.895
  297    HG2  LYS  39           HG2      LYS  39  12.753  13.005  15.930
  298    HG3  LYS  39           HG3      LYS  39  11.719  11.605  15.713
  299    HD2  LYS  39           HD2      LYS  39   9.780  13.262  16.492
  300    HD3  LYS  39           HD3      LYS  39  10.937  14.518  16.069
  301    HE2  LYS  39           HE2      LYS  39   9.974  12.252  14.255
  302    HE3  LYS  39           HE3      LYS  39   9.310  13.885  14.252
  303    HZ1  LYS  39           HZ1      LYS  39  12.122  13.203  13.564
  304    HZ2  LYS  39           HZ2      LYS  39  11.492  14.714  13.564
  305    HZ3  LYS  39           HZ3      LYS  39  10.959  13.606  12.495
  306    H    CYS  40           H        CYS  40  11.642   9.161  18.001
  307    HA   CYS  40           HA       CYS  40  10.281   8.347  15.649
  308    HB2  CYS  40           HB2      CYS  40  11.846   7.011  17.835
  309    HB3  CYS  40           HB3      CYS  40  10.771   5.978  16.903
  310    H    ARG  41           H        ARG  41   9.404   7.737  19.096
  311    HA   ARG  41           HA       ARG  41   6.933   6.362  18.531
  312    HB2  ARG  41           HB2      ARG  41   7.889   7.930  20.956
  313    HB3  ARG  41           HB3      ARG  41   6.378   7.037  20.929
  314    HG2  ARG  41           HG2      ARG  41   9.058   5.669  20.392
  315    HG3  ARG  41           HG3      ARG  41   8.396   5.909  22.003
  316    HD2  ARG  41           HD2      ARG  41   7.769   3.737  21.455
  317    HD3  ARG  41           HD3      ARG  41   6.301   4.700  21.251
  318    HE   ARG  41           HE       ARG  41   7.958   4.218  18.835
  319   HH11  ARG  41          HH11      ARG  41   5.177   3.097  20.643
  320   HH12  ARG  41          HH12      ARG  41   4.545   2.196  19.293
  321   HH21  ARG  41          HH21      ARG  41   7.085   3.053  17.146
  322   HH22  ARG  41          HH22      ARG  41   5.603   2.173  17.375
  323    H    TRP  42           H        TRP  42   7.523   9.861  19.131
  324    HA   TRP  42           HA       TRP  42   4.777  10.608  18.996
  325    HB2  TRP  42           HB2      TRP  42   6.666  12.027  19.835
  326    HB3  TRP  42           HB3      TRP  42   7.175  12.287  18.170
  327    HD1  TRP  42           HD1      TRP  42   4.714  13.378  20.780
  328    HE1  TRP  42           HE1      TRP  42   3.243  15.306  19.944
  329    HE3  TRP  42           HE3      TRP  42   6.068  13.359  15.823
  330    HZ2  TRP  42           HZ2      TRP  42   2.646  16.602  17.440
  331    HZ3  TRP  42           HZ3      TRP  42   4.996  14.936  14.233
  332    HH2  TRP  42           HH2      TRP  42   3.286  16.555  15.025
  333    H    LEU  43           H        LEU  43   7.239  10.470  16.341
  334    HA   LEU  43           HA       LEU  43   5.373  11.295  14.325
  335    HB2  LEU  43           HB2      LEU  43   7.885  11.333  14.144
  336    HB3  LEU  43           HB3      LEU  43   7.862   9.575  13.990
  337    HG   LEU  43           HG       LEU  43   6.448   9.829  11.908
  338   HD11  LEU  43          HD11      LEU  43   5.437  12.046  12.285
  339   HD12  LEU  43          HD12      LEU  43   6.399  12.070  10.808
  340   HD13  LEU  43          HD13      LEU  43   7.048  12.801  12.291
  341   HD21  LEU  43          HD21      LEU  43   8.281  10.615  10.477
  342   HD22  LEU  43          HD22      LEU  43   8.892   9.572  11.769
  343   HD23  LEU  43          HD23      LEU  43   9.094  11.335  11.884
  344    H    ALA  44           H        ALA  44   6.308   8.024  15.504
  345    HA   ALA  44           HA       ALA  44   4.741   6.527  13.701
  346    HB1  ALA  44           HB1      ALA  44   4.929   4.730  15.408
  347    HB2  ALA  44           HB2      ALA  44   6.477   5.551  15.136
  348    HB3  ALA  44           HB3      ALA  44   5.516   5.915  16.586
  349    H    SER  45           H        SER  45   3.694   7.944  16.883
  350    HA   SER  45           HA       SER  45   1.001   6.856  16.575
  351    HB2  SER  45           HB2      SER  45   0.455   8.096  18.568
  352    HB3  SER  45           HB3      SER  45   1.977   7.219  18.782
  353    HG   SER  45           HG       SER  45   2.105   9.368  19.565
  354    H    SER  46           H        SER  46   2.548   9.919  15.701
  355    HA   SER  46           HA       SER  46   0.138  11.344  14.997
  356    HB2  SER  46           HB2      SER  46   2.339  12.393  15.507
  357    HB3  SER  46           HB3      SER  46   2.988  11.729  13.993
  358    HG   SER  46           HG       SER  46   2.106  13.983  13.985
  359    H    LYS  47           H        LYS  47   2.010   8.936  13.312
  360    HA   LYS  47           HA       LYS  47   0.505   9.340  10.741
  361    HB2  LYS  47           HB2      LYS  47   3.328   8.284  11.202
  362    HB3  LYS  47           HB3      LYS  47   2.540   8.419   9.639
  363    HG2  LYS  47           HG2      LYS  47   3.244  10.801  11.403
  364    HG3  LYS  47           HG3      LYS  47   4.179  10.197  10.037
  365    HD2  LYS  47           HD2      LYS  47   2.227  10.611   8.528
  366    HD3  LYS  47           HD3      LYS  47   1.348  11.326   9.899
  367    HE2  LYS  47           HE2      LYS  47   3.094  13.035  10.168
  368    HE3  LYS  47           HE3      LYS  47   4.054  12.296   8.882
  369    HZ1  LYS  47           HZ1      LYS  47   2.255  12.809   7.321
  370    HZ2  LYS  47           HZ2      LYS  47   2.778  14.176   8.038
  371    HZ3  LYS  47           HZ3      LYS  47   1.365  13.503   8.502
  372    H    GLY  48           H        GLY  48   1.150   7.051   9.450
  373    HA2  GLY  48           HA2      GLY  48  -0.521   5.019  10.809
  374    HA3  GLY  48           HA3      GLY  48  -0.005   5.025   9.127
  375    H    LYS  49           H        LYS  49   0.571   3.758  12.213
  376    HA   LYS  49           HA       LYS  49   2.789   2.026  11.291
  377    HB2  LYS  49           HB2      LYS  49   2.925   4.002  13.601
  378    HB3  LYS  49           HB3      LYS  49   3.821   2.509  13.714
  379    HG2  LYS  49           HG2      LYS  49   4.216   4.583  11.526
  380    HG3  LYS  49           HG3      LYS  49   5.224   4.339  12.950
  381    HD2  LYS  49           HD2      LYS  49   5.606   1.945  12.184
  382    HD3  LYS  49           HD3      LYS  49   4.870   2.385  10.638
  383    HE2  LYS  49           HE2      LYS  49   7.287   3.766  11.891
  384    HE3  LYS  49           HE3      LYS  49   7.388   2.462  10.710
  385    HZ1  LYS  49           HZ1      LYS  49   6.149   5.110  10.197
  386    HZ2  LYS  49           HZ2      LYS  49   6.209   3.876   9.121
  387    HZ3  LYS  49           HZ3      LYS  49   7.595   4.581   9.632
  388    H    GLN  50           H        GLN  50   3.295   0.352  12.962
  389    HA   GLN  50           HA       GLN  50   0.906  -1.017  13.896
  390    HB2  GLN  50           HB2      GLN  50   3.863  -1.637  14.276
  391    HB3  GLN  50           HB3      GLN  50   2.521  -2.668  14.792
  392    HG2  GLN  50           HG2      GLN  50   1.728  -2.735  12.387
  393    HG3  GLN  50           HG3      GLN  50   3.207  -1.886  11.927
  394   HE21  GLN  50          HE21      GLN  50   5.223  -3.089  11.917
  395   HE22  GLN  50          HE22      GLN  50   5.231  -4.826  12.192
  396    H    VAL  51           H        VAL  51  -0.010   0.543  15.260
  397    HA   VAL  51           HA       VAL  51   1.148   0.736  18.022
  398    HB   VAL  51           HB       VAL  51  -0.225   2.725  18.344
  399   HG11  VAL  51          HG11      VAL  51   1.072   4.277  17.018
  400   HG12  VAL  51          HG12      VAL  51   2.105   2.951  17.573
  401   HG13  VAL  51          HG13      VAL  51   1.544   2.995  15.886
  402   HG21  VAL  51          HG21      VAL  51  -1.328   3.884  16.515
  403   HG22  VAL  51          HG22      VAL  51  -0.896   2.602  15.371
  404   HG23  VAL  51          HG23      VAL  51  -2.044   2.276  16.688
  405    H    ARG  52           H        ARG  52  -1.178   1.400  19.412
  406    HA   ARG  52           HA       ARG  52  -3.001  -0.963  19.066
  407    HB2  ARG  52           HB2      ARG  52  -1.785   0.151  21.634
  408    HB3  ARG  52           HB3      ARG  52  -3.062  -1.053  21.596
  409    HG2  ARG  52           HG2      ARG  52  -0.306  -1.540  20.363
  410    HG3  ARG  52           HG3      ARG  52  -0.711  -1.869  22.040
  411    HD2  ARG  52           HD2      ARG  52  -0.934  -3.930  20.954
  412    HD3  ARG  52           HD3      ARG  52  -2.578  -3.363  21.272
  413    HE   ARG  52           HE       ARG  52  -1.600  -2.637  18.607
  414   HH11  ARG  52          HH11      ARG  52  -3.056  -5.294  20.383
  415   HH12  ARG  52          HH12      ARG  52  -3.701  -6.027  18.941
  416   HH21  ARG  52          HH21      ARG  52  -2.449  -3.620  16.818
  417   HH22  ARG  52          HH22      ARG  52  -3.352  -5.103  16.969
  418    H    ASN  53           H        ASN  53  -5.104  -0.720  19.800
  419    HA   ASN  53           HA       ASN  53  -6.294   1.877  19.437
  420    HB2  ASN  53           HB2      ASN  53  -7.422  -0.706  20.602
  421    HB3  ASN  53           HB3      ASN  53  -8.384   0.698  20.149
  422   HD21  ASN  53          HD21      ASN  53  -8.044  -2.231  19.060
  423   HD22  ASN  53          HD22      ASN  53  -7.956  -1.940  17.330
  424    H    PHE  54           H        PHE  54  -4.976   0.353  22.258
  425    HA   PHE  54           HA       PHE  54  -6.306   2.234  24.137
  426    HB2  PHE  54           HB2      PHE  54  -4.595  -0.222  24.659
  427    HB3  PHE  54           HB3      PHE  54  -5.508   0.685  25.850
  428    HD1  PHE  54           HD2      PHE  54  -8.027   0.646  25.831
  429    HD2  PHE  54           HD1      PHE  54  -5.662  -1.929  23.304
  430    HE1  PHE  54           HE2      PHE  54  -9.994  -0.835  25.492
  431    HE2  PHE  54           HE1      PHE  54  -7.633  -3.400  22.959
  432    HZ   PHE  54           HZ       PHE  54  -9.798  -2.857  24.055
  433    H    SER  55           H        SER  55  -3.356   2.098  22.431
  434    HA   SER  55           HA       SER  55  -2.036   4.071  24.147
  435    HB2  SER  55           HB2      SER  55  -1.489   1.833  25.186
  436    HB3  SER  55           HB3      SER  55  -0.648   1.401  23.685
  437    HG   SER  55           HG       SER  55   0.733   2.389  25.327
  Start of MODEL   15
    1    H1   GLY   1           H1       GLY   1  18.251 -15.557  10.898
    2    H2   GLY   1           H2       GLY   1  16.886 -14.658  10.850
    3    H3   GLY   1           H3       GLY   1  17.737 -14.774  12.243
    4    HA2  GLY   1           HA2      GLY   1  18.691 -13.485   9.763
    5    HA3  GLY   1           HA3      GLY   1  18.109 -12.627  11.199
    6    H    SER   2           H        SER   2  20.770 -14.488   9.808
    7    HA   SER   2           HA       SER   2  22.379 -14.632  12.215
    8    HB2  SER   2           HB2      SER   2  24.166 -15.286  10.506
    9    HB3  SER   2           HB3      SER   2  22.743 -16.328  10.655
   10    HG   SER   2           HG       SER   2  23.310 -15.841   8.453
   11    H    GLU   3           H        GLU   3  22.094 -12.234   9.633
   12    HA   GLU   3           HA       GLU   3  23.402 -10.322  11.378
   13    HB2  GLU   3           HB2      GLU   3  25.010  -9.433   9.872
   14    HB3  GLU   3           HB3      GLU   3  25.381 -11.118  10.128
   15    HG2  GLU   3           HG2      GLU   3  23.948 -10.027   7.658
   16    HG3  GLU   3           HG3      GLU   3  25.683 -10.220   7.787
   17    H    PHE   4           H        PHE   4  23.235  -8.053  10.461
   18    HA   PHE   4           HA       PHE   4  20.591  -7.726   9.082
   19    HB2  PHE   4           HB2      PHE   4  22.107  -5.866  10.954
   20    HB3  PHE   4           HB3      PHE   4  20.569  -5.517  10.189
   21    HD1  PHE   4           HD1      PHE   4  18.488  -6.618  10.927
   22    HD2  PHE   4           HD2      PHE   4  22.262  -7.423  12.856
   23    HE1  PHE   4           HE1      PHE   4  17.290  -7.620  12.860
   24    HE2  PHE   4           HE2      PHE   4  21.062  -8.434  14.781
   25    HZ   PHE   4           HZ       PHE   4  18.575  -8.528  14.789
   26    H    THR   5           H        THR   5  23.730  -6.008   9.362
   27    HA   THR   5           HA       THR   5  24.225  -5.809   6.548
   28    HB   THR   5           HB       THR   5  22.456  -4.121   6.617
   29    HG1  THR   5           HG1      THR   5  23.624  -2.485   5.700
   30   HG21  THR   5          HG21      THR   5  22.584  -3.362   8.959
   31   HG22  THR   5          HG22      THR   5  22.685  -2.012   7.825
   32   HG23  THR   5          HG23      THR   5  24.156  -2.595   8.634
   33    H    SER   6           H        SER   6  26.267  -4.638   6.148
   34    HA   SER   6           HA       SER   6  27.870  -3.685   8.374
   35    HB2  SER   6           HB2      SER   6  28.129  -6.168   8.582
   36    HB3  SER   6           HB3      SER   6  28.876  -6.192   6.977
   37    HG   SER   6           HG       SER   6  30.429  -6.039   8.668
   38    H    SER   7           H        SER   7  27.718  -1.843   7.084
   39    HA   SER   7           HA       SER   7  29.611  -1.676   4.782
   40    HB2  SER   7           HB2      SER   7  26.772  -0.586   4.778
   41    HB3  SER   7           HB3      SER   7  27.993  -0.311   3.526
   42    HG   SER   7           HG       SER   7  28.023  -2.582   3.153
   43    HA   PRO   8           HA       PRO   8  30.120   1.846   7.878
   44    HB2  PRO   8           HB2      PRO   8  32.752   1.470   8.519
   45    HB3  PRO   8           HB3      PRO   8  31.419   0.604   9.341
   46    HG2  PRO   8           HG2      PRO   8  33.140  -0.387   7.046
   47    HG3  PRO   8           HG3      PRO   8  32.747  -1.230   8.579
   48    HD2  PRO   8           HD2      PRO   8  31.367  -1.707   6.280
   49    HD3  PRO   8           HD3      PRO   8  30.554  -1.696   7.873
   50    H    ARG   9           H        ARG   9  31.425   3.759   7.554
   51    HA   ARG   9           HA       ARG   9  32.662   4.058   4.838
   52    HB2  ARG   9           HB2      ARG   9  30.561   5.904   6.043
   53    HB3  ARG   9           HB3      ARG   9  31.445   6.163   4.533
   54    HG2  ARG   9           HG2      ARG   9  30.499   3.844   3.808
   55    HG3  ARG   9           HG3      ARG   9  29.337   4.068   5.121
   56    HD2  ARG   9           HD2      ARG   9  29.824   5.916   2.753
   57    HD3  ARG   9           HD3      ARG   9  28.449   4.823   2.946
   58    HE   ARG   9           HE       ARG   9  28.117   6.304   5.150
   59   HH11  ARG   9          HH11      ARG   9  28.801   7.439   1.903
   60   HH12  ARG   9          HH12      ARG   9  28.010   8.968   2.172
   61   HH21  ARG   9          HH21      ARG   9  27.124   8.276   5.421
   62   HH22  ARG   9          HH22      ARG   9  27.081   9.417   4.109
   63    H    GLY  10           H        GLY  10  34.139   3.682   7.063
   64    HA2  GLY  10           HA2      GLY  10  36.378   4.792   6.930
   65    HA3  GLY  10           HA3      GLY  10  35.585   6.291   7.422
   66    H    ASP  11           H        ASP  11  34.242   6.050   9.508
   67    HA   ASP  11           HA       ASP  11  35.837   4.761  11.648
   68    HB2  ASP  11           HB2      ASP  11  33.385   6.568  11.669
   69    HB3  ASP  11           HB3      ASP  11  34.114   5.871  13.115
   70    H    LYS  12           H        LYS  12  35.258   2.943  12.713
   71    HA   LYS  12           HA       LYS  12  33.230   1.180  11.646
   72    HB2  LYS  12           HB2      LYS  12  35.364   0.410  12.595
   73    HB3  LYS  12           HB3      LYS  12  34.901   1.010  14.196
   74    HG2  LYS  12           HG2      LYS  12  32.984  -0.558  14.233
   75    HG3  LYS  12           HG3      LYS  12  33.426  -1.168  12.638
   76    HD2  LYS  12           HD2      LYS  12  35.127  -1.316  15.170
   77    HD3  LYS  12           HD3      LYS  12  34.140  -2.633  14.548
   78    HE2  LYS  12           HE2      LYS  12  36.501  -1.374  13.070
   79    HE3  LYS  12           HE3      LYS  12  36.583  -2.840  14.045
   80    HZ1  LYS  12           HZ1      LYS  12  34.973  -3.873  12.534
   81    HZ2  LYS  12           HZ2      LYS  12  36.300  -3.395  11.718
   82    HZ3  LYS  12           HZ3      LYS  12  34.923  -2.531  11.601
   83    H    ALA  13           H        ALA  13  33.418   2.985  14.702
   84    HA   ALA  13           HA       ALA  13  31.951   3.246  16.434
   85    HB1  ALA  13           HB1      ALA  13  30.119   4.716  15.770
   86    HB2  ALA  13           HB2      ALA  13  31.587   5.091  14.857
   87    HB3  ALA  13           HB3      ALA  13  30.271   4.182  14.082
   88    H    ALA  14           H        ALA  14  31.921   0.651  16.344
   89    HA   ALA  14           HA       ALA  14  29.079  -0.198  16.614
   90    HB1  ALA  14           HB1      ALA  14  31.160  -1.716  14.989
   91    HB2  ALA  14           HB2      ALA  14  29.451  -2.135  15.205
   92    HB3  ALA  14           HB3      ALA  14  29.887  -0.680  14.299
   93    H    TYR  15           H        TYR  15  31.016   0.336  18.706
   94    HA   TYR  15           HA       TYR  15  32.040  -2.076  19.878
   95    HB2  TYR  15           HB2      TYR  15  31.533   0.752  20.835
   96    HB3  TYR  15           HB3      TYR  15  32.064  -0.472  21.963
   97    HD1  TYR  15           HD2      TYR  15  34.184  -1.747  21.613
   98    HD2  TYR  15           HD1      TYR  15  33.182   1.818  19.393
   99    HE1  TYR  15           HE2      TYR  15  36.591  -1.407  21.082
  100    HE2  TYR  15           HE1      TYR  15  35.597   2.152  18.857
  101    HH   TYR  15           HH       TYR  15  38.140  -0.082  20.043
  102    H    ASP  16           H        ASP  16  29.052  -2.163  19.233
  103    HA   ASP  16           HA       ASP  16  27.041  -2.728  20.089
  104    HB2  ASP  16           HB2      ASP  16  28.453  -4.776  20.214
  105    HB3  ASP  16           HB3      ASP  16  28.718  -4.460  21.928
  106    H    ILE  17           H        ILE  17  27.759  -0.331  21.097
  107    HA   ILE  17           HA       ILE  17  26.217  -0.208  23.649
  108    HB   ILE  17           HB       ILE  17  28.443   0.102  24.313
  109   HG12  ILE  17          HG12      ILE  17  26.629   1.676  25.203
  110   HG13  ILE  17          HG13      ILE  17  28.312   1.983  25.581
  111   HG21  ILE  17          HG21      ILE  17  29.605   0.637  22.269
  112   HG22  ILE  17          HG22      ILE  17  28.855   2.245  22.193
  113   HG23  ILE  17          HG23      ILE  17  29.979   1.837  23.500
  114   HD11  ILE  17          HD11      ILE  17  27.080   4.059  25.117
  115   HD12  ILE  17          HD12      ILE  17  28.427   3.835  23.997
  116   HD13  ILE  17          HD13      ILE  17  26.762   3.536  23.462
  117    H    LEU  18           H        LEU  18  27.285   1.583  20.748
  118    HA   LEU  18           HA       LEU  18  25.241   3.591  20.757
  119    HB2  LEU  18           HB2      LEU  18  26.833   2.239  18.537
  120    HB3  LEU  18           HB3      LEU  18  25.774   3.610  18.256
  121    HG   LEU  18           HG       LEU  18  27.973   3.871  20.328
  122   HD11  LEU  18          HD11      LEU  18  28.315   4.214  17.329
  123   HD12  LEU  18          HD12      LEU  18  29.112   2.998  18.353
  124   HD13  LEU  18          HD13      LEU  18  29.485   4.714  18.575
  125   HD21  LEU  18          HD21      LEU  18  26.245   5.657  20.042
  126   HD22  LEU  18          HD22      LEU  18  26.750   5.854  18.356
  127   HD23  LEU  18          HD23      LEU  18  27.881   6.218  19.679
  128    H    ARG  19           H        ARG  19  23.252   3.672  19.748
  129    HA   ARG  19           HA       ARG  19  22.009   1.096  18.818
  130    HB2  ARG  19           HB2      ARG  19  21.473   2.048  21.194
  131    HB3  ARG  19           HB3      ARG  19  20.553   3.272  20.343
  132    HG2  ARG  19           HG2      ARG  19  20.078   0.257  20.198
  133    HG3  ARG  19           HG3      ARG  19  19.233   1.382  21.257
  134    HD2  ARG  19           HD2      ARG  19  18.442   2.605  19.155
  135    HD3  ARG  19           HD3      ARG  19  19.035   1.229  18.234
  136    HE   ARG  19           HE       ARG  19  16.746   1.295  20.117
  137   HH11  ARG  19          HH11      ARG  19  18.626  -0.728  17.949
  138   HH12  ARG  19          HH12      ARG  19  17.450  -2.011  17.995
  139   HH21  ARG  19          HH21      ARG  19  15.288  -0.366  20.094
  140   HH22  ARG  19          HH22      ARG  19  15.610  -1.798  19.162
  141    H    ARG  20           H        ARG  20  20.995   1.193  16.926
  142    HA   ARG  20           HA       ARG  20  20.869   3.795  15.480
  143    HB2  ARG  20           HB2      ARG  20  21.164   2.583  13.448
  144    HB3  ARG  20           HB3      ARG  20  22.385   2.061  14.600
  145    HG2  ARG  20           HG2      ARG  20  20.879   0.022  15.090
  146    HG3  ARG  20           HG3      ARG  20  19.933   0.528  13.684
  147    HD2  ARG  20           HD2      ARG  20  21.494  -1.125  12.940
  148    HD3  ARG  20           HD3      ARG  20  22.035   0.440  12.307
  149    HE   ARG  20           HE       ARG  20  23.271  -0.223  14.862
  150   HH11  ARG  20          HH11      ARG  20  23.592  -0.928  11.447
  151   HH12  ARG  20          HH12      ARG  20  25.283  -1.325  11.599
  152   HH21  ARG  20          HH21      ARG  20  25.427  -0.717  14.980
  153   HH22  ARG  20          HH22      ARG  20  26.288  -1.200  13.548
  154    H    CYS  21           H        CYS  21  19.103   4.542  14.498
  155    HA   CYS  21           HA       CYS  21  16.487   3.371  15.168
  156    HB2  CYS  21           HB2      CYS  21  16.948   5.804  15.293
  157    HB3  CYS  21           HB3      CYS  21  17.277   5.814  13.547
  158    H    SER  22           H        SER  22  15.503   1.899  13.912
  159    HA   SER  22           HA       SER  22  16.489   0.956  11.419
  160    HB2  SER  22           HB2      SER  22  13.732   0.592  12.646
  161    HB3  SER  22           HB3      SER  22  14.422  -0.374  11.326
  162    HG   SER  22           HG       SER  22  14.709  -1.410  13.338
  163    H    GLN  23           H        GLN  23  14.541   3.737  11.978
  164    HA   GLN  23           HA       GLN  23  13.706   3.833   9.087
  165    HB2  GLN  23           HB2      GLN  23  12.445   5.068  11.564
  166    HB3  GLN  23           HB3      GLN  23  12.082   5.589   9.925
  167    HG2  GLN  23           HG2      GLN  23  10.357   4.102  10.538
  168    HG3  GLN  23           HG3      GLN  23  11.345   3.284   9.333
  169   HE21  GLN  23          HE21      GLN  23  11.099   3.581  12.959
  170   HE22  GLN  23          HE22      GLN  23  11.382   1.868  13.228
  171    H    CYS  24           H        CYS  24  15.254   5.727  11.727
  172    HA   CYS  24           HA       CYS  24  15.636   8.006   9.925
  173    HB2  CYS  24           HB2      CYS  24  16.623   7.666  12.768
  174    HB3  CYS  24           HB3      CYS  24  16.417   9.160  11.864
  175    H    GLY  25           H        GLY  25  17.560   5.268  10.959
  176    HA2  GLY  25           HA2      GLY  25  19.565   4.491  10.177
  177    HA3  GLY  25           HA3      GLY  25  19.705   5.904   9.131
  178    H    ILE  26           H        ILE  26  19.421   7.525  11.827
  179    HA   ILE  26           HA       ILE  26  22.214   7.969  12.310
  180    HB   ILE  26           HB       ILE  26  20.454   9.678  12.447
  181   HG12  ILE  26          HG12      ILE  26  21.892   9.460  15.117
  182   HG13  ILE  26          HG13      ILE  26  22.681   9.907  13.600
  183   HG21  ILE  26          HG21      ILE  26  18.943   9.864  14.366
  184   HG22  ILE  26          HG22      ILE  26  18.669   8.335  13.542
  185   HG23  ILE  26          HG23      ILE  26  19.580   8.358  15.055
  186   HD11  ILE  26          HD11      ILE  26  22.163  11.907  14.842
  187   HD12  ILE  26          HD12      ILE  26  21.136  11.860  13.396
  188   HD13  ILE  26          HD13      ILE  26  20.460  11.453  14.995
  189    H    LEU  27           H        LEU  27  23.399   7.711  14.269
  190    HA   LEU  27           HA       LEU  27  22.557   5.480  16.078
  191    HB2  LEU  27           HB2      LEU  27  25.320   6.241  15.021
  192    HB3  LEU  27           HB3      LEU  27  25.069   5.278  16.465
  193    HG   LEU  27           HG       LEU  27  23.744   3.643  15.058
  194   HD11  LEU  27          HD11      LEU  27  24.393   3.525  12.645
  195   HD12  LEU  27          HD12      LEU  27  25.156   5.123  12.791
  196   HD13  LEU  27          HD13      LEU  27  23.401   4.934  12.994
  197   HD21  LEU  27          HD21      LEU  27  25.996   3.171  15.887
  198   HD22  LEU  27          HD22      LEU  27  26.711   4.016  14.499
  199   HD23  LEU  27          HD23      LEU  27  25.793   2.512  14.263
  200    H    LEU  28           H        LEU  28  22.490   5.934  18.197
  201    HA   LEU  28           HA       LEU  28  23.800   8.410  19.264
  202    HB2  LEU  28           HB2      LEU  28  21.065   7.293  19.988
  203    HB3  LEU  28           HB3      LEU  28  21.887   8.567  20.851
  204    HG   LEU  28           HG       LEU  28  20.232   9.621  19.680
  205   HD11  LEU  28          HD11      LEU  28  22.629  10.046  17.873
  206   HD12  LEU  28          HD12      LEU  28  22.442  10.752  19.489
  207   HD13  LEU  28          HD13      LEU  28  21.301  11.170  18.198
  208   HD21  LEU  28          HD21      LEU  28  21.004   8.304  17.067
  209   HD22  LEU  28          HD22      LEU  28  19.674   9.433  17.360
  210   HD23  LEU  28          HD23      LEU  28  19.642   7.824  18.099
  211    HA   PRO  29           HA       PRO  29  25.557   5.546  22.139
  212    HB2  PRO  29           HB2      PRO  29  26.275   7.127  24.259
  213    HB3  PRO  29           HB3      PRO  29  27.062   7.178  22.657
  214    HG2  PRO  29           HG2      PRO  29  24.911   9.022  23.723
  215    HG3  PRO  29           HG3      PRO  29  26.416   9.453  22.861
  216    HD2  PRO  29           HD2      PRO  29  24.003   9.281  21.590
  217    HD3  PRO  29           HD3      PRO  29  25.528   8.812  20.786
  218    H    LEU  30           H        LEU  30  23.681   7.699  24.344
  219    HA   LEU  30           HA       LEU  30  21.796   5.617  25.074
  220    HB2  LEU  30           HB2      LEU  30  23.630   4.684  26.271
  221    HB3  LEU  30           HB3      LEU  30  24.121   6.227  26.926
  222    HG   LEU  30           HG       LEU  30  22.079   6.278  28.352
  223   HD11  LEU  30          HD11      LEU  30  20.711   4.223  28.586
  224   HD12  LEU  30          HD12      LEU  30  21.554   3.500  27.198
  225   HD13  LEU  30          HD13      LEU  30  20.523   4.932  26.981
  226   HD21  LEU  30          HD21      LEU  30  22.762   4.480  29.870
  227   HD22  LEU  30          HD22      LEU  30  24.181   5.282  29.178
  228   HD23  LEU  30          HD23      LEU  30  23.675   3.693  28.563
  229    HA   PRO  31           HA       PRO  31  20.561   9.372  27.652
  230    HB2  PRO  31           HB2      PRO  31  22.017  11.724  27.691
  231    HB3  PRO  31           HB3      PRO  31  22.193  10.381  28.857
  232    HG2  PRO  31           HG2      PRO  31  23.880  10.963  26.420
  233    HG3  PRO  31           HG3      PRO  31  24.416  10.499  28.062
  234    HD2  PRO  31           HD2      PRO  31  24.248   8.672  26.064
  235    HD3  PRO  31           HD3      PRO  31  23.808   8.263  27.747
  236    H    ILE  32           H        ILE  32  22.242  10.393  24.644
  237    HA   ILE  32           HA       ILE  32  20.038  12.114  23.796
  238    HB   ILE  32           HB       ILE  32  22.293  11.023  22.069
  239   HG12  ILE  32          HG12      ILE  32  22.977  13.651  22.608
  240   HG13  ILE  32          HG13      ILE  32  22.288  13.186  24.153
  241   HG21  ILE  32          HG21      ILE  32  21.845  13.063  20.720
  242   HG22  ILE  32          HG22      ILE  32  20.443  12.006  20.771
  243   HG23  ILE  32          HG23      ILE  32  20.482  13.464  21.787
  244   HD11  ILE  32          HD11      ILE  32  23.902  11.214  24.167
  245   HD12  ILE  32          HD12      ILE  32  24.591  11.844  22.660
  246   HD13  ILE  32          HD13      ILE  32  24.694  12.801  24.150
  247    H    LEU  33           H        LEU  33  20.786   8.687  23.437
  248    HA   LEU  33           HA       LEU  33  19.081   8.075  21.236
  249    HB2  LEU  33           HB2      LEU  33  20.777   6.544  22.185
  250    HB3  LEU  33           HB3      LEU  33  19.843   6.377  23.649
  251    HG   LEU  33           HG       LEU  33  19.773   4.479  22.045
  252   HD11  LEU  33          HD11      LEU  33  16.981   5.491  22.610
  253   HD12  LEU  33          HD12      LEU  33  18.062   4.791  23.838
  254   HD13  LEU  33          HD13      LEU  33  17.544   3.833  22.442
  255   HD21  LEU  33          HD21      LEU  33  17.933   6.263  20.393
  256   HD22  LEU  33          HD22      LEU  33  18.160   4.531  20.178
  257   HD23  LEU  33          HD23      LEU  33  19.520   5.623  19.897
  258    H    ASN  34           H        ASN  34  18.344   8.285  24.751
  259    HA   ASN  34           HA       ASN  34  15.627   7.534  24.586
  260    HB2  ASN  34           HB2      ASN  34  17.007   7.802  26.667
  261    HB3  ASN  34           HB3      ASN  34  16.907   9.553  26.478
  262   HD21  ASN  34          HD21      ASN  34  15.668  10.047  28.315
  263   HD22  ASN  34          HD22      ASN  34  14.059   9.388  28.575
  264    H    GLN  35           H        GLN  35  17.070  10.771  24.020
  265    HA   GLN  35           HA       GLN  35  14.566  12.151  23.657
  266    HB2  GLN  35           HB2      GLN  35  16.731  13.266  24.151
  267    HB3  GLN  35           HB3      GLN  35  17.317  12.838  22.538
  268    HG2  GLN  35           HG2      GLN  35  15.476  14.174  21.518
  269    HG3  GLN  35           HG3      GLN  35  14.873  14.571  23.131
  270   HE21  GLN  35          HE21      GLN  35  17.572  15.085  20.831
  271   HE22  GLN  35          HE22      GLN  35  18.180  16.517  21.649
  272    H    HIS  36           H        HIS  36  16.780  10.509  21.296
  273    HA   HIS  36           HA       HIS  36  15.132  11.061  19.001
  274    HB2  HIS  36           HB2      HIS  36  17.476  10.154  18.887
  275    HB3  HIS  36           HB3      HIS  36  16.863   8.588  19.420
  276    HD1  HIS  36           HD1      HIS  36  16.926  10.881  16.384
  277    HD2  HIS  36           HD2      HIS  36  15.175   7.267  17.611
  278    HE1  HIS  36           HE1      HIS  36  15.924   9.860  14.302
  279    H    GLN  37           H        GLN  37  15.130   8.295  21.305
  280    HA   GLN  37           HA       GLN  37  13.224   6.751  19.994
  281    HB2  GLN  37           HB2      GLN  37  14.754   6.301  22.117
  282    HB3  GLN  37           HB3      GLN  37  13.336   6.826  23.014
  283    HG2  GLN  37           HG2      GLN  37  13.069   4.516  22.924
  284    HG3  GLN  37           HG3      GLN  37  12.057   5.024  21.575
  285   HE21  GLN  37          HE21      GLN  37  12.982   4.693  19.323
  286   HE22  GLN  37          HE22      GLN  37  14.284   3.534  19.124
  287    H    GLU  38           H        GLU  38  12.581   9.280  22.489
  288    HA   GLU  38           HA       GLU  38   9.720   8.946  22.454
  289    HB2  GLU  38           HB2      GLU  38  11.438  11.338  23.218
  290    HB3  GLU  38           HB3      GLU  38   9.680  11.262  23.408
  291    HG2  GLU  38           HG2      GLU  38   9.978   9.172  24.793
  292    HG3  GLU  38           HG3      GLU  38  11.713   9.463  24.780
  293    H    LYS  39           H        LYS  39  11.797  11.251  20.576
  294    HA   LYS  39           HA       LYS  39   9.568  12.494  19.234
  295    HB2  LYS  39           HB2      LYS  39  11.660  13.664  19.327
  296    HB3  LYS  39           HB3      LYS  39  12.541  12.307  18.631
  297    HG2  LYS  39           HG2      LYS  39  12.332  14.090  17.000
  298    HG3  LYS  39           HG3      LYS  39  11.495  12.647  16.458
  299    HD2  LYS  39           HD2      LYS  39   9.345  13.848  17.473
  300    HD3  LYS  39           HD3      LYS  39  10.333  15.299  17.364
  301    HE2  LYS  39           HE2      LYS  39   9.686  13.361  15.088
  302    HE3  LYS  39           HE3      LYS  39   8.848  14.885  15.382
  303    HZ1  LYS  39           HZ1      LYS  39  10.949  16.053  14.975
  304    HZ2  LYS  39           HZ2      LYS  39  10.551  15.144  13.681
  305    HZ3  LYS  39           HZ3      LYS  39  11.729  14.643  14.689
  306    H    CYS  40           H        CYS  40  11.706   9.842  18.225
  307    HA   CYS  40           HA       CYS  40  10.637   9.433  15.639
  308    HB2  CYS  40           HB2      CYS  40  12.829   8.715  16.798
  309    HB3  CYS  40           HB3      CYS  40  11.926   7.338  17.433
  310    H    ARG  41           H        ARG  41   9.838   7.855  18.785
  311    HA   ARG  41           HA       ARG  41   7.642   6.255  17.863
  312    HB2  ARG  41           HB2      ARG  41   8.770   5.915  20.015
  313    HB3  ARG  41           HB3      ARG  41   8.183   7.478  20.604
  314    HG2  ARG  41           HG2      ARG  41   5.860   6.702  20.486
  315    HG3  ARG  41           HG3      ARG  41   6.369   5.160  19.782
  316    HD2  ARG  41           HD2      ARG  41   7.220   6.175  22.530
  317    HD3  ARG  41           HD3      ARG  41   5.824   5.121  22.243
  318    HE   ARG  41           HE       ARG  41   8.094   3.907  21.037
  319   HH11  ARG  41          HH11      ARG  41   6.913   4.547  24.273
  320   HH12  ARG  41          HH12      ARG  41   7.739   3.168  24.946
  321   HH21  ARG  41          HH21      ARG  41   9.114   2.160  21.958
  322   HH22  ARG  41          HH22      ARG  41   8.951   1.857  23.663
  323    H    TRP  42           H        TRP  42   7.640   9.613  19.194
  324    HA   TRP  42           HA       TRP  42   4.835   9.975  19.128
  325    HB2  TRP  42           HB2      TRP  42   6.487  11.489  20.224
  326    HB3  TRP  42           HB3      TRP  42   6.955  12.100  18.642
  327    HD1  TRP  42           HD1      TRP  42   4.287  12.326  21.293
  328    HE1  TRP  42           HE1      TRP  42   2.596  14.178  20.747
  329    HE3  TRP  42           HE3      TRP  42   5.818  13.462  16.524
  330    HZ2  TRP  42           HZ2      TRP  42   1.944  15.880  18.519
  331    HZ3  TRP  42           HZ3      TRP  42   4.621  15.197  15.210
  332    HH2  TRP  42           HH2      TRP  42   2.686  16.407  16.191
  333    H    LEU  43           H        LEU  43   7.226  10.752  16.553
  334    HA   LEU  43           HA       LEU  43   5.305  11.605  14.624
  335    HB2  LEU  43           HB2      LEU  43   7.741  12.102  14.570
  336    HB3  LEU  43           HB3      LEU  43   8.079  10.400  14.253
  337    HG   LEU  43           HG       LEU  43   6.832  10.574  12.085
  338   HD11  LEU  43          HD11      LEU  43   5.313  12.454  12.574
  339   HD12  LEU  43          HD12      LEU  43   6.327  12.833  11.181
  340   HD13  LEU  43          HD13      LEU  43   6.702  13.549  12.764
  341   HD21  LEU  43          HD21      LEU  43   9.053  12.624  12.446
  342   HD22  LEU  43          HD22      LEU  43   8.542  11.883  10.914
  343   HD23  LEU  43          HD23      LEU  43   9.273  10.881  12.175
  344    H    ALA  44           H        ALA  44   6.776   8.340  15.143
  345    HA   ALA  44           HA       ALA  44   5.409   7.044  13.006
  346    HB1  ALA  44           HB1      ALA  44   7.365   6.106  14.178
  347    HB2  ALA  44           HB2      ALA  44   6.402   5.925  15.663
  348    HB3  ALA  44           HB3      ALA  44   5.997   4.979  14.216
  349    H    SER  45           H        SER  45   4.318   7.795  16.311
  350    HA   SER  45           HA       SER  45   1.858   6.261  16.139
  351    HB2  SER  45           HB2      SER  45   3.028   6.836  18.255
  352    HB3  SER  45           HB3      SER  45   2.618   8.544  18.005
  353    HG   SER  45           HG       SER  45   1.128   7.397  19.378
  354    H    SER  46           H        SER  46   2.586   9.806  15.812
  355    HA   SER  46           HA       SER  46  -0.176  10.491  15.297
  356    HB2  SER  46           HB2      SER  46   0.635  12.729  14.947
  357    HB3  SER  46           HB3      SER  46   1.449  12.022  16.352
  358    HG   SER  46           HG       SER  46   2.947  13.072  15.046
  359    H    LYS  47           H        LYS  47   2.519   9.704  13.201
  360    HA   LYS  47           HA       LYS  47   0.815   9.902  10.751
  361    HB2  LYS  47           HB2      LYS  47   3.617  10.993  11.240
  362    HB3  LYS  47           HB3      LYS  47   2.996  10.725   9.621
  363    HG2  LYS  47           HG2      LYS  47   1.637  12.540  11.652
  364    HG3  LYS  47           HG3      LYS  47   2.823  13.092  10.488
  365    HD2  LYS  47           HD2      LYS  47   0.194  11.738   9.727
  366    HD3  LYS  47           HD3      LYS  47   0.415  13.473   9.814
  367    HE2  LYS  47           HE2      LYS  47   2.072  11.665   7.996
  368    HE3  LYS  47           HE3      LYS  47   0.567  12.433   7.499
  369    HZ1  LYS  47           HZ1      LYS  47   1.569  14.596   7.921
  370    HZ2  LYS  47           HZ2      LYS  47   2.483  13.769   6.858
  371    HZ3  LYS  47           HZ3      LYS  47   2.976  13.917   8.405
  372    H    GLY  48           H        GLY  48   0.756   7.601  11.780
  373    HA2  GLY  48           HA2      GLY  48   2.852   5.731  11.206
  374    HA3  GLY  48           HA3      GLY  48   1.174   5.351  11.578
  375    H    LYS  49           H        LYS  49   2.352   7.220   8.788
  376    HA   LYS  49           HA       LYS  49   0.853   5.694   6.814
  377    HB2  LYS  49           HB2      LYS  49   2.956   7.902   6.714
  378    HB3  LYS  49           HB3      LYS  49   2.314   7.189   5.241
  379    HG2  LYS  49           HG2      LYS  49   0.510   8.444   7.355
  380    HG3  LYS  49           HG3      LYS  49   1.233   9.356   6.026
  381    HD2  LYS  49           HD2      LYS  49   0.136   7.891   4.370
  382    HD3  LYS  49           HD3      LYS  49  -0.608   6.946   5.676
  383    HE2  LYS  49           HE2      LYS  49  -1.817   8.926   6.472
  384    HE3  LYS  49           HE3      LYS  49  -1.038   9.933   5.243
  385    HZ1  LYS  49           HZ1      LYS  49  -2.852   7.648   4.664
  386    HZ2  LYS  49           HZ2      LYS  49  -2.144   8.595   3.535
  387    HZ3  LYS  49           HZ3      LYS  49  -3.259   9.222   4.545
  388    H    GLN  50           H        GLN  50   1.780   4.690   4.948
  389    HA   GLN  50           HA       GLN  50   4.334   3.209   5.401
  390    HB2  GLN  50           HB2      GLN  50   1.622   1.973   4.779
  391    HB3  GLN  50           HB3      GLN  50   3.177   1.128   4.709
  392    HG2  GLN  50           HG2      GLN  50   3.540   1.654   7.139
  393    HG3  GLN  50           HG3      GLN  50   1.930   2.375   7.188
  394   HE21  GLN  50          HE21      GLN  50   0.842   0.924   8.541
  395   HE22  GLN  50          HE22      GLN  50   0.696  -0.791   8.171
  396    H    VAL  51           H        VAL  51   4.693   5.132   3.848
  397    HA   VAL  51           HA       VAL  51   3.920   4.896   1.088
  398    HB   VAL  51           HB       VAL  51   5.690   6.562   0.658
  399   HG11  VAL  51          HG11      VAL  51   4.745   8.381   1.951
  400   HG12  VAL  51          HG12      VAL  51   3.456   7.285   1.433
  401   HG13  VAL  51          HG13      VAL  51   4.030   7.251   3.115
  402   HG21  VAL  51          HG21      VAL  51   6.332   6.387   3.641
  403   HG22  VAL  51          HG22      VAL  51   7.397   5.839   2.324
  404   HG23  VAL  51          HG23      VAL  51   6.983   7.551   2.474
  405    H    ARG  52           H        ARG  52   6.086   2.959   2.794
  406    HA   ARG  52           HA       ARG  52   8.152   2.411   0.888
  407    HB2  ARG  52           HB2      ARG  52   8.091   1.895   3.367
  408    HB3  ARG  52           HB3      ARG  52   6.974   0.572   3.024
  409    HG2  ARG  52           HG2      ARG  52   8.733  -0.462   1.542
  410    HG3  ARG  52           HG3      ARG  52   9.841   0.842   1.995
  411    HD2  ARG  52           HD2      ARG  52   8.555  -1.177   3.884
  412    HD3  ARG  52           HD3      ARG  52  10.227  -1.224   3.303
  413    HE   ARG  52           HE       ARG  52   9.920   1.289   4.513
  414   HH11  ARG  52          HH11      ARG  52   9.799  -2.025   5.624
  415   HH12  ARG  52          HH12      ARG  52  10.214  -1.593   7.261
  416   HH21  ARG  52          HH21      ARG  52  10.417   1.783   6.625
  417   HH22  ARG  52          HH22      ARG  52  10.569   0.513   7.802
  418    H    ASN  53           H        ASN  53   8.074   1.350  -1.020
  419    HA   ASN  53           HA       ASN  53   5.609   0.001  -1.884
  420    HB2  ASN  53           HB2      ASN  53   8.264   0.607  -3.258
  421    HB3  ASN  53           HB3      ASN  53   6.977  -0.332  -4.009
  422   HD21  ASN  53          HD21      ASN  53   7.551   1.665  -5.500
  423   HD22  ASN  53          HD22      ASN  53   6.398   2.979  -5.321
  424    H    PHE  54           H        PHE  54   9.044  -1.110  -1.704
  425    HA   PHE  54           HA       PHE  54   8.314  -3.664  -0.552
  426    HB2  PHE  54           HB2      PHE  54   9.062  -5.105  -2.329
  427    HB3  PHE  54           HB3      PHE  54   7.749  -4.119  -2.916
  428    HD1  PHE  54           HD2      PHE  54   8.188  -2.260  -4.559
  429    HD2  PHE  54           HD1      PHE  54  11.262  -5.019  -3.334
  430    HE1  PHE  54           HE2      PHE  54   9.569  -1.589  -6.513
  431    HE2  PHE  54           HE1      PHE  54  12.634  -4.362  -5.293
  432    HZ   PHE  54           HZ       PHE  54  11.794  -2.641  -6.885
  433    H    SER  55           H        SER  55  10.221  -5.036  -0.151
  434    HA   SER  55           HA       SER  55  12.437  -3.552   0.934
  435    HB2  SER  55           HB2      SER  55  12.048  -6.550   0.585
  436    HB3  SER  55           HB3      SER  55  13.294  -5.771   1.578
  437    HG   SER  55           HG       SER  55  11.423  -6.338   2.826