*HEADER    ANTIMICROBIAL PROTEIN                   23-SEP-11   2LJT              
*TITLE     C9L,C14L-LEUA                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: BACTERIOCIN LEUCOCIN-A;                                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: LEUCOCIN A-UAL 187, LEU A;                                  
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: LEUCONOSTOC GELIDUM;                            
*SOURCE   3 ORGANISM_TAXID: 1244;                                                
*SOURCE   4 STRAIN: UAL 187;                                                     
*SOURCE   5 GENE: LCNA;                                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PMAL-C2X                                   
*KEYWDS    ANTIMICROBIAL PEPTIDE, ANTIMICROBIAL PROTEIN                          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    C.S.SIT, C.T.LOHANS, M.J.VAN BELKUM, C.D.CAMPBELL, M.MISKOLZIE,       
*AUTHOR   2 J.C.VEDERAS                                                          
*REVDAT   2   08-FEB-12 2LJT    1                                                
*REVDAT   1   11-JAN-12 2LJT    0                                                

 24 ALA  HN     24 ALA  HB1     3.13            #peak     1
 20 GLU  HB1    21 ALA  HN      4.32            #peak     3
 20 GLU  HB2    21 ALA  HN      4.32            #peak     4
 21 ALA  HN     21 ALA  HB1     3.24            #peak     5
  2 TYR  HA      3 TYR  HN      3.29            #peak     7 #SUP  0.70  #QF  0.70
 10 THR  HA     14 LEU  HN      4.54            #peak     9 #SUP  0.80  #QF  0.55
  3 TYR  HN      3 TYR  HB1     3.98            #peak    21 #SUP  0.97  #QF  0.97
 20 GLU  HN     20 GLU  HG1     4.22            #peak    23
  3 TYR  HN      3 TYR  HB2     3.98            #peak    24 #SUP  0.94  #QF  0.94
 20 GLU  HN     20 GLU  HG2     4.22            #peak    25
 20 GLU  HN     20 GLU  HB1     3.92            #peak    26
 20 GLU  HN     20 GLU  HB2     3.92            #peak    27
 16 VAL  HN     16 VAL  HB      3.59            #peak    28 #SUP  0.96  #QF  0.96
  7 VAL  HN      7 VAL  HB      3.71            #peak    29 #SUP  0.89  #QF  0.89
 14 LEU  HN     14 LEU  HB1     4.13            #peak    31 #SUP  0.93  #QF  0.93
 16 VAL  HN     16 VAL  HG11    3.90            #peak    32 #SUP  0.95  #QF  0.73
 16 VAL  HN     16 VAL  HG12    4.27            #peak    32 #SUP  0.95  #QF  0.73
 14 LEU  HN     14 LEU  HD21    4.46            #peak    34 #SUP  0.93  #QF  0.72
 14 LEU  HN     14 LEU  HD23    5.05            #peak    34 #SUP  0.93  #QF  0.72
 16 VAL  HN     16 VAL  HG21    5.20            #peak    35 #SUP  1.00  #QF  0.97
 16 VAL  HN     16 VAL  HG22    5.50            #peak    35 #SUP  1.00  #QF  0.97
 16 VAL  HN     16 VAL  HG23    5.50            #peak    35 #SUP  1.00  #QF  0.97
  7 VAL  HN      7 VAL  HG21    5.47            #peak    36 #SUP  1.00  #QF  0.96
  7 VAL  HN      7 VAL  HG22    5.50            #peak    36 #SUP  1.00  #QF  0.96
  7 VAL  HN      7 VAL  HG23    5.50            #peak    36 #SUP  1.00  #QF  0.96
 15 SER  HA     18 TRP  HN      4.42            #peak    41 #SUP  0.65  #QF  0.65
 10 THR  HB     11 LYS  HN      3.86            #peak    43 #SUP  0.88  #QF  0.88
 26 VAL  HA     29 LEU  HN      4.52            #peak    49
  8 HIS  HB1     9 LEU  HN      4.59            #peak    51 #SUP  0.95  #QF  0.76
  8 HIS  HB2     9 LEU  HN      4.59            #peak    51 #SUP  0.95  #QF  0.76
 22 PHE  HN     22 PHE  HB1     3.69            #peak    52
 17 ASN  HB1    18 TRP  HN      4.42            #peak    53
 22 PHE  HN     22 PHE  HB2     3.69            #peak    54
 17 ASN  HB2    18 TRP  HN      4.42            #peak    55
 11 LYS  HN     11 LYS  HB1     3.40            #peak    56 #SUP  0.89  #QF  0.89
  9 LEU  HN      9 LEU  HB1     3.57            #peak    57 #SUP  0.97  #QF  0.97
  9 LEU  HN      9 LEU  HB2     3.57            #peak    58 #SUP  0.89  #QF  0.89
 11 LYS  HN     14 LEU  HB2     4.73            #peak    60 #SUP  0.67  #QF  0.67
 11 LYS  HN     11 LYS  HD1     5.22            #peak    61 #SUP  0.95  #QF  0.64
 11 LYS  HN     11 LYS  HD2     5.22            #peak    61 #SUP  0.95  #QF  0.64
 29 LEU  HN     29 LEU  HB1     3.90            #peak    63
 29 LEU  HN     29 LEU  HB2     3.90            #peak    65 #SUP  0.99  #QF  0.99
 21 ALA  HB3    22 PHE  HN      3.75            #peak    66
 30 ALA  HN     30 ALA  HB1     3.29            #peak    67 #SUP  1.00  #QF  0.94
 11 LYS  HN     11 LYS  HG1     4.50            #peak    68 #SUP  0.93  #QF  0.93
 11 LYS  HN     11 LYS  HG2     4.50            #peak    69 #SUP  0.81  #QF  0.81
 10 THR  HG21   11 LYS  HN      4.81            #peak    70 #SUP  0.99  #QF  0.85
 10 THR  HG23   11 LYS  HN      5.44            #peak    70 #SUP  0.99  #QF  0.85
  9 LEU  HN      9 LEU  HD22    4.39            #peak    71 #SUP  0.75  #QF  0.75
 26 VAL  HN     26 VAL  HG11    4.87            #peak    72 #SUP  1.00  #QF  0.74
 26 VAL  HN     26 VAL  HG12    5.17            #peak    72 #SUP  1.00  #QF  0.74
 26 VAL  HN     26 VAL  HG21    3.44            #peak    73
 29 LEU  HN     29 LEU  HD12    5.48            #peak    74 #SUP  0.98  #QF  0.35
 17 ASN  HN     17 ASN  HB1     3.73            #peak    83 #SUP  0.95  #QF  0.95
 36 PHE  HB1    37 TRP  HN      4.71            #peak    84
 16 VAL  HB     17 ASN  HN      4.08            #peak    86 #SUP  0.95  #QF  0.95
 16 VAL  HG21   17 ASN  HN      4.79            #peak    88 #SUP  0.93  #QF  0.89
 16 VAL  HG23   17 ASN  HN      5.30            #peak    88 #SUP  0.93  #QF  0.89
  8 HIS  HN      8 HIS  HB1     4.10            #peak    94 #SUP  0.96  #QF  0.76
  8 HIS  HN      8 HIS  HB2     4.10            #peak    94 #SUP  0.96  #QF  0.76
  7 VAL  HB      8 HIS  HN      3.94            #peak    97 #SUP  0.68  #QF  0.68
  7 VAL  HG11    8 HIS  HN      5.50            #peak    98 #SUP  1.00  #QF  0.94
  7 VAL  HG12    8 HIS  HN      5.50            #peak    98 #SUP  1.00  #QF  0.94
  7 VAL  HG13    8 HIS  HN      5.50            #peak    98 #SUP  1.00  #QF  0.94
  7 VAL  HG21    8 HIS  HN      5.24            #peak    99 #SUP  0.94  #QF  0.53
  7 VAL  HG22    8 HIS  HN      5.50            #peak    99 #SUP  0.94  #QF  0.53
  7 VAL  HG23    8 HIS  HN      5.50            #peak    99 #SUP  0.94  #QF  0.53
 24 ALA  HA     27 HIS  HN      4.19            #peak   108 #SUP  0.32  #QF  0.32
 27 HIS  HN     27 HIS  HB1     4.16            #peak   109
 27 HIS  HN     27 HIS  HB2     4.16            #peak   109
 26 VAL  HB     27 HIS  HN      4.00            #peak   110
 26 VAL  HG21   27 HIS  HN      4.74            #peak   111 #SUP  0.90  #QF  0.79
 26 VAL  HG22   27 HIS  HN      5.27            #peak   111 #SUP  0.90  #QF  0.79
 26 VAL  HG12   27 HIS  HN      4.42            #peak   112
 10 THR  HN     10 THR  HB      3.85            #peak   120 #SUP  0.89  #QF  0.89
 15 SER  HN     15 SER  HB1     4.02            #peak   123 #SUP  0.93  #QF  0.93
 12 SER  HN     12 SER  HB1     3.82            #peak   125 #SUP  0.91  #QF  0.91
 12 SER  HN     12 SER  HB2     3.82            #peak   126 #SUP  0.95  #QF  0.95
 15 SER  HN     15 SER  HB2     4.02            #peak   127 #SUP  0.95  #QF  0.95
 31 ASN  HN     31 ASN  HB1     3.95            #peak   128
 31 ASN  HN     31 ASN  HB2     3.95            #peak   129
 11 LYS  HB1    12 SER  HN      3.82            #peak   130 #SUP  0.75  #QF  0.75
  9 LEU  HB1    10 THR  HN      4.66            #peak   131 #SUP  0.94  #QF  0.94
 14 LEU  HB2    15 SER  HN      4.17            #peak   132 #SUP  0.91  #QF  0.91
  9 LEU  HB2    10 THR  HN      4.66            #peak   133 #SUP  0.94  #QF  0.83
  9 LEU  HG     10 THR  HN      5.02            #peak   133 #SUP  0.94  #QF  0.83
 30 ALA  HB1    31 ASN  HN      3.76            #peak   134
  9 LEU  HD21   10 THR  HN      5.05            #peak   136 #SUP  0.98  #QF  0.92
  9 LEU  HD22   10 THR  HN      5.29            #peak   136 #SUP  0.98  #QF  0.92
 14 LEU  HD23   15 SER  HN      4.80            #peak   137 #SUP  0.96  #QF  0.21
 23 SER  HN     23 SER  HB1     3.76            #peak   139
 23 SER  HN     23 SER  HB2     3.76            #peak   140
 19 GLY  HA1    23 SER  HN      4.35            #peak   141
 22 PHE  HB1    23 SER  HN      4.33            #peak   142
 22 PHE  HB2    23 SER  HN      4.33            #peak   143
 10 THR  HA     13 GLY  HN      4.87            #peak   144 #SUP  0.75  #QF  0.24
 11 LYS  HA     13 GLY  HN      5.24            #peak   144 #SUP  0.75  #QF  0.24
 12 SER  HB1    13 GLY  HN      4.21            #peak   146 #SUP  0.90  #QF  0.90
 12 SER  HB2    13 GLY  HN      4.21            #peak   147 #SUP  1.00  #QF  0.64
  5 ASN  HB1     6 GLY  HN      5.43            #peak   149 #SUP  1.00  #QF  0.93
  5 ASN  HB2     6 GLY  HN      5.43            #peak   149 #SUP  1.00  #QF  0.93
 29 LEU  HA     33 GLY  HN      4.48            #peak   154
 24 ALA  HB1    25 GLY  HN      3.73            #peak   165
 14 LEU  HN     14 LEU  HB2     3.62            #peak   171 #SUP  0.91  #QF  0.73
  6 GLY  HN      7 VAL  HN      4.32            #peak   172 #SUP  0.64  #QF  0.64
  5 ASN  HN      6 GLY  HN      4.31            #peak   173 #SUP  0.97  #QF  0.97
  7 VAL  HN      8 HIS  HN      4.23            #peak   176 #SUP  0.97  #QF  0.97
  8 HIS  HN      9 LEU  HN      4.50            #peak   177 #SUP  0.95  #QF  0.95
  9 LEU  HN     10 THR  HN      4.12            #peak   179 #SUP  0.47  #QF  0.47
 11 LYS  HN     12 SER  HN      3.96            #peak   180 #SUP  0.82  #QF  0.82
 14 LEU  HN     15 SER  HN      4.21            #peak   181 #SUP  0.84  #QF  0.84
 16 VAL  HN     17 ASN  HN      3.85            #peak   188 #SUP  0.76  #QF  0.76
 17 ASN  HN     17 ASN  HB2     3.73            #peak   189 #SUP  0.94  #QF  0.94
 17 ASN  HN     18 TRP  HN      4.22            #peak   190 #SUP  0.89  #QF  0.89
 20 GLU  HN     21 ALA  HN      4.07            #peak   191
 22 PHE  HN     23 SER  HN      4.22            #peak   193
 21 ALA  HN     22 PHE  HN      4.13            #peak   194
 24 ALA  HN     25 GLY  HN      4.01            #peak   197
 23 SER  HN     24 ALA  HN      4.17            #peak   198
 26 VAL  HN     26 VAL  HB      3.60            #peak   203
 31 ASN  HN     32 GLY  HN      3.98            #peak   206
 33 GLY  HN     34 ASN  HN      4.10            #peak   207
 35 GLY  HN     36 PHE  HN      4.34            #peak   209
  3 TYR  HN      4 GLY  HN      4.05            #peak   210 #SUP  0.81  #QF  0.81
 17 ASN  HA     20 GLU  HN      4.52            #peak   212 #SUP  0.71  #QF  0.71
 36 PHE  HB2    37 TRP  HN      4.71            #peak   214
 21 ALA  HN     22 PHE  HB2     5.50            #peak   216 #SUP  0.98  #QF  0.82
 21 ALA  HN     22 PHE  HB1     5.50            #peak   217 #SUP  0.53  #QF  0.53
 30 ALA  HN     31 ASN  HN      4.08            #peak   218
 14 LEU  HB1    15 SER  HN      4.63            #peak   219 #SUP  0.98  #QF  0.98
  3 TYR  HB2     4 GLY  HN      4.79            #peak   220 #SUP  0.86  #QF  0.86
  3 TYR  HB1     4 GLY  HN      4.79            #peak   221 #SUP  0.81  #QF  0.81
  4 GLY  HN      5 ASN  HN      4.47            #peak   224 #SUP  0.88  #QF  0.88
 31 ASN  HB1    32 GLY  HN      4.72            #peak   227
 31 ASN  HB2    32 GLY  HN      4.72            #peak   228
 14 LEU  HA     17 ASN  HN      4.79            #peak   231 #SUP  0.79  #QF  0.79
 16 VAL  HG11   17 ASN  HN      5.09            #peak   232 #SUP  0.95  #QF  0.61
 16 VAL  HG12   17 ASN  HN      5.50            #peak   232 #SUP  0.95  #QF  0.61
 16 VAL  HG13   17 ASN  HN      5.50            #peak   232 #SUP  0.95  #QF  0.61
 12 SER  HN     13 GLY  HN      4.26            #peak   236 #SUP  0.89  #QF  0.89
 12 SER  HN     14 LEU  HB2     5.37            #peak   237 #SUP  0.87  #QF  0.87
 11 LYS  HN     14 LEU  HD21    5.27            #peak   238 #SUP  0.65  #QF  0.65
  7 VAL  HA     10 THR  HB      4.07            #peak     4 #SUP  0.97  #QF  0.97
 26 VAL  HA     29 LEU  HB2     4.16            #peak     8
 26 VAL  HA     29 LEU  HB1     4.16            #peak     9
  7 VAL  HA      7 VAL  HG11    4.04            #peak    11 #SUP  1.00  #QF  0.88
 10 THR  HA     10 THR  HG22    3.82            #peak    12 #SUP  0.88  #QF  0.42
 10 THR  HA     10 THR  HG23    3.49            #peak    12 #SUP  0.88  #QF  0.42
 16 VAL  HA     16 VAL  HG21    3.61            #peak    13 #SUP  0.92  #QF  0.73
 16 VAL  HA     16 VAL  HG22    3.94            #peak    13 #SUP  0.92  #QF  0.73
 26 VAL  HA     29 LEU  HD12    4.31            #peak    17
 23 SER  HA     26 VAL  HB      3.63            #peak    35
 27 HIS  HA     30 ALA  HB1     3.60            #peak    37
 23 SER  HA     26 VAL  HG21    4.02            #peak    38
 28 ARG  HA     31 ASN  HB2     4.79            #peak    44
 20 GLU  HA     20 GLU  HG2     4.15            #peak    46
 11 LYS  HA     14 LEU  HB2     4.77            #peak    52 #SUP  0.89  #QF  0.89
 28 ARG  HA     28 ARG  HG1     4.19            #peak    53 #SUP  0.75  #QF  0.75
 11 LYS  HA     11 LYS  HD1     5.10            #peak    54 #SUP  0.90  #QF  0.70
 11 LYS  HA     11 LYS  HD2     5.10            #peak    54 #SUP  0.90  #QF  0.70
 29 LEU  HA     29 LEU  HG      4.08            #peak    59
 11 LYS  HA     11 LYS  HG1     4.08            #peak    61 #SUP  0.48  #QF  0.48
 11 LYS  HA     11 LYS  HG2     4.08            #peak    62 #SUP  0.86  #QF  0.86
  9 LEU  HA      9 LEU  HD13    5.03            #peak    65 #SUP  1.00  #QF  0.40
 24 ALA  HA     24 ALA  HB1     2.92            #peak    72
 21 ALA  HA     21 ALA  HB2     2.92            #peak    73 #SUP  1.00  #QF  0.93
 19 GLY  HA1    22 PHE  HB1     4.60            #peak    75
  6 GLY  HA2     9 LEU  HD22    5.50            #peak    84 #SUP  0.43  #QF  0.21
 10 THR  HA     14 LEU  HB2     3.69            #peak    89 #SUP  0.99  #QF  0.52
 11 LYS  HB2    11 LYS  HE1     5.47            #peak   100 #SUP  1.00  #QF  0.80
 11 LYS  HB2    11 LYS  HE2     5.47            #peak   100 #SUP  1.00  #QF  0.80
 14 LEU  HB2    14 LEU  HD21    3.80            #peak   113 #SUP  1.00  #QF  0.46
 14 LEU  HB1    14 LEU  HD11    4.02            #peak   115 #SUP  1.00  #QF  0.77
 14 LEU  HA     17 ASN  HB1     4.42            #peak   130 #SUP  0.91  #QF  0.91
 14 LEU  HA     17 ASN  HB2     4.42            #peak   131 #SUP  0.88  #QF  0.88
 19 GLY  HA2    22 PHE  HB1     5.10            #peak   133 #SUP  0.98  #QF  0.98
  8 HIS  HA     11 LYS  HB1     4.07            #peak   137 #SUP  0.62  #QF  0.62
 20 GLU  HA     20 GLU  HG1     4.15            #peak   138 #SUP  0.93  #QF  0.93
 17 ASN  HA     20 GLU  HB1     4.34            #peak   167
 17 ASN  HA     20 GLU  HB2     4.34            #peak   168
 28 ARG  HA     28 ARG  HG2     4.19            #peak   174 #SUP  0.98  #QF  0.98
 10 THR  HA     14 LEU  HD21    4.74            #peak   194 #SUP  0.99  #QF  0.22
 29 LEU  HA     29 LEU  HD21    4.66            #peak   196 #SUP  0.99  #QF  0.81
 29 LEU  HA     29 LEU  HD22    5.22            #peak   196 #SUP  0.99  #QF  0.81
 29 LEU  HA     29 LEU  HD23    5.14            #peak   196 #SUP  0.99  #QF  0.81
  9 LEU  HD21   14 LEU  HA      3.33            #peak   197
  9 LEU  HD21   14 LEU  HB1     3.64            #peak   209
 10 THR  HG23   14 LEU  HD21    4.61            #peak   210 #SUP  0.88  #QF  0.31
 10 THR  HG23   14 LEU  HA      5.25            #peak   213 #SUP  0.32  #QF  0.32
 23 SER  HA     26 VAL  HG22    3.96            #peak   215
  7 VAL  HA      7 VAL  HG23    4.24            #peak   219 #SUP  1.00  #QF  0.79
 26 VAL  HA     26 VAL  HG21    3.21            #peak   220
 26 VAL  HA     26 VAL  HG11    3.50            #peak   221
 10 THR  HG23   14 LEU  HB2     4.61            #peak   225 #SUP  0.67  #QF  0.29
 26 VAL  HG12   30 ALA  HB1     4.16            #peak   228
 18 TRP  HA     21 ALA  HB1     3.54            #peak   229
 30 ALA  HA     30 ALA  HB1     2.83            #peak   230
 21 ALA  HA     21 ALA  HB1     2.94            #peak   232
 26 VAL  HG11   30 ALA  HB1     4.54            #peak   233 #SUP  1.00  #QF  0.66
  1 LYS  HA      1 LYS  HD1     5.42            #peak   241 #SUP  0.85  #QF  0.63
  1 LYS  HA      1 LYS  HD2     5.42            #peak   241 #SUP  0.85  #QF  0.63
  1 LYS  HA      1 LYS  HE1     5.50            #peak   242 #SUP  0.83  #QF  0.61
  1 LYS  HA      1 LYS  HE2     5.50            #peak   242 #SUP  0.83  #QF  0.61
  6 GLY  HA1     9 LEU  HD22    5.50            #peak   250 #SUP  0.82  #QF  0.27
  1 LYS  HA      2 TYR  HN      3.47            #peak   254 #SUP  0.81  #QF  0.81
  1 LYS  HB1     2 TYR  HN      5.50            #peak   255 #SUP  0.99  #QF  0.92
  1 LYS  HB2     2 TYR  HN      5.50            #peak   255 #SUP  0.99  #QF  0.92
  7 VAL  HN      7 VAL  HG11    4.14            #peak   263 #SUP  1.00  #QF  0.85
  7 VAL  HN      7 VAL  HG12    4.58            #peak   263 #SUP  1.00  #QF  0.85
  7 VAL  HN      7 VAL  HG13    4.71            #peak   263 #SUP  1.00  #QF  0.85
 10 THR  HN     10 THR  HG21    5.22            #peak   286 #SUP  1.00  #QF  0.98
 10 THR  HN     10 THR  HG22    5.50            #peak   286 #SUP  1.00  #QF  0.98
 10 THR  HN     10 THR  HG23    5.50            #peak   286 #SUP  1.00  #QF  0.98
 21 ALA  HN     21 ALA  HB3     4.18            #peak   299 #SUP  1.00  #QF  0.45
 21 ALA  HB1    22 PHE  HN      4.27            #peak   300 #SUP  1.00  #QF  0.93
 19 GLY  HA2    22 PHE  HB2     5.10            #peak   306
 19 GLY  HA1    22 PHE  HB2     4.60            #peak   307
 29 LEU  HN     29 LEU  HG      4.53            #peak   324 #SUP  0.82  #QF  0.82
  7 VAL  HA     10 THR  HG21    5.50            #peak   326 #SUP  0.93  #QF  0.39
  7 VAL  HA     10 THR  HG22    5.50            #peak   326 #SUP  0.93  #QF  0.39
 16 VAL  HA     18 TRP  HN      4.77            #peak   327 #SUP  0.60  #QF  0.60
 10 THR  HA     14 LEU  HG      5.50            #peak   329 #SUP  0.83  #QF  0.45
 10 THR  HA     14 LEU  HB1     3.88            #peak   335 #SUP  0.50  #QF  0.50
 23 SER  HA     26 VAL  HN      4.82            #peak   340 #SUP  0.92  #QF  0.92
 30 ALA  HB2    31 ASN  HN      4.56            #peak   343 #SUP  1.00
 24 ALA  HB1    25 GLY  HA1     5.50            #peak   344 #SUP  0.93  #QF  0.75
 24 ALA  HB2    25 GLY  HA1     5.50            #peak   344 #SUP  0.93  #QF  0.75
 24 ALA  HB1    25 GLY  HA2     5.50            #peak   345 #SUP  0.98  #QF  0.71
 24 ALA  HB2    25 GLY  HA2     5.50            #peak   345 #SUP  0.98  #QF  0.71
 26 VAL  HA     29 LEU  HG      4.77            #peak   346
 23 SER  HA     26 VAL  HG11    5.50            #peak   350 #SUP  1.00  #QF  0.93
 23 SER  HA     26 VAL  HG13    5.50            #peak   350 #SUP  1.00  #QF  0.93
 26 VAL  HG12   27 HIS  HA      5.50            #peak   351 #SUP  1.00  #QF  0.95
 26 VAL  HN     26 VAL  HG13    5.50            #peak   352 #SUP  1.00
 26 VAL  HG11   27 HIS  HA      4.51            #peak   355
 11 LYS  HA     14 LEU  HD21    4.13            #peak   357 #SUP  0.51  #QF  0.51
 29 LEU  HA     29 LEU  HD13    5.50            #peak   359 #SUP  0.96  #QF  0.44
  7 VAL  HA     10 THR  HN      5.12            #peak   377 #SUP  0.51  #QF  0.51
 28 ARG  HA     31 ASN  HB1     4.79            #peak   393 #SUP  0.83  #QF  0.83
  9 LEU  HG     14 LEU  HA      5.20            #peak   406 #SUP  0.64  #QF  0.64
 10 THR  HG21   11 LYS  HA      5.47            #peak   414 #SUP  0.89  #QF  0.58
 10 THR  HG23   11 LYS  HA      5.50            #peak   414 #SUP  0.89  #QF  0.58
  1 LYS  HA      1 LYS  QD      4.64            #peak   241
  2 TYR  HN      2 TYR  QB      3.52            #peak    20
  3 TYR  HN      3 TYR  QB      3.40            #peak    24
  4 GLY  QA      6 GLY  HN      4.67            #peak   234
  5 ASN  HN      5 ASN  QB      3.64            #peak   106
  6 GLY  QA      9 LEU  HN      4.20            #peak   211
  6 GLY  QA      9 LEU  QB      3.70            #peak    83
  6 GLY  QA      9 LEU  HG      5.03            #peak   398
  6 GLY  QA      9 LEU  HD11    5.34            #peak   250
  6 GLY  QA      9 LEU  HD13    4.75            #peak    84
  6 GLY  QA      9 LEU  HD22    4.67            #peak    84
  8 HIS  HN      8 HIS  QB      3.45            #peak    94
  8 HIS  QB      9 LEU  HN      3.95            #peak    51
  9 LEU  QB      9 LEU  HD11    3.67            #peak   114
  9 LEU  QB      9 LEU  HD22    3.38            #peak   204
  9 LEU  QB     10 THR  HN      3.92            #peak   131
  9 LEU  QB     10 THR  HA      5.31            #peak   329
  9 LEU  HD21   12 SER  QB      5.34            #peak   402
 11 LYS  HN     11 LYS  QG      3.92            #peak    68
 11 LYS  HN     11 LYS  QD      4.44            #peak    61
 11 LYS  HA     11 LYS  QG      3.52            #peak    62
 11 LYS  HA     11 LYS  QD      4.34            #peak    54
 11 LYS  HB2    11 LYS  QD      3.61            #peak   148
 11 LYS  QG     11 LYS  QE      3.32            #peak   106
 11 LYS  QG     14 LEU  HD21    5.34            #peak   407
 12 SER  QB     13 GLY  HN      3.34            #peak   147
 13 GLY  QA     16 VAL  HB      4.19            #peak    82
 13 GLY  QA     16 VAL  HG11    5.24            #peak   268
 13 GLY  QA     16 VAL  HG12    5.34            #peak   268
 13 GLY  QA     16 VAL  HG13    5.34            #peak   268
 14 LEU  HA     17 ASN  QB      3.87            #peak   131
 15 SER  HN     15 SER  QB      3.49            #peak   123
 15 SER  HA     18 TRP  QB      3.89            #peak   169
 15 SER  QB     16 VAL  HN      4.15            #peak    13
 16 VAL  HG21   20 GLU  QG      4.46            #peak   314
 17 ASN  HA     20 GLU  QB      3.82            #peak   167
 17 ASN  QB     18 TRP  HN      3.86            #peak    53
 18 TRP  HN     18 TRP  QB      3.27            #peak    50
 18 TRP  QB     19 GLY  HN      3.80            #peak   169
 18 TRP  QB     19 GLY  HA1     4.66            #peak   338
 18 TRP  QB     21 ALA  HB3     5.18            #peak   336
 19 GLY  HA1    22 PHE  QB      3.90            #peak    75
 19 GLY  HA2    22 PHE  QB      4.30            #peak   306
 20 GLU  HN     20 GLU  QB      3.40            #peak    26
 20 GLU  HN     20 GLU  QG      3.68            #peak    23
 20 GLU  HA     20 GLU  QG      3.46            #peak    46
 20 GLU  QB     21 ALA  HN      3.77            #peak     3
 20 GLU  QB     21 ALA  HB2     5.34            #peak   339
 20 GLU  QB     21 ALA  HB3     5.34            #peak   339
 20 GLU  QG     21 ALA  HN      5.28            #peak   216
 21 ALA  HN     22 PHE  QB      4.79            #peak   217
 22 PHE  QB     23 SER  HN      3.58            #peak   142
 23 SER  HN     23 SER  QB      3.14            #peak   139
 23 SER  QB     24 ALA  HN      3.33 
 24 ALA  HA     27 HIS  QB      3.64            #peak    69
 25 GLY  QA     28 ARG  QB      3.58            #peak   156
 26 VAL  HA     28 ARG  QB      5.11            #peak   347
 26 VAL  HA     29 LEU  QB      3.60            #peak     9
 27 HIS  HN     27 HIS  QB      3.48            #peak   109
 27 HIS  QB     28 ARG  HN      3.49            #peak   233
 28 ARG  HN     28 ARG  QB      3.18            #peak    85
 28 ARG  HN     28 ARG  QG      4.32            #peak    87
 28 ARG  HA     28 ARG  QG      3.68            #peak    53
 28 ARG  HA     28 ARG  QD      3.99            #peak    42
 28 ARG  HA     31 ASN  QB      4.01            #peak    44
 28 ARG  QB     28 ARG  QD      3.32            #peak   157
 28 ARG  QB     29 LEU  HN      4.16            #peak   321
 28 ARG  QG     29 LEU  HN      4.84            #peak    64
 29 LEU  HN     29 LEU  QB      3.32            #peak    63
 29 LEU  QB     29 LEU  HD21    3.68            #peak   206
 29 LEU  QB     30 ALA  HN      4.23            #peak    59
 31 ASN  HN     31 ASN  QB      3.38            #peak   129
 34 ASN  HN     34 ASN  QB      3.59            #peak   107
 36 PHE  HN     36 PHE  QB      3.58            #peak    96
 36 PHE  QB     37 TRP  HN      4.12            #peak    84
 37 TRP  HN     37 TRP  QB      3.68            #peak    81



   7 VAL   PHI     -81.0   -41.0
   7 VAL   PSI     -63.3   -11.9
   8 HIS   PHI     -84.0   -44.0
   8 HIS   PSI     -59.8   -14.4
   9 LEU   PHI     -77.7   -37.7
   9 LEU   PSI     -61.0   -21.0
  10 THR   PHI     -83.5   -43.5
  10 THR   PSI     -61.9   -21.9
  11 LYS   PHI     -82.9   -42.9
  11 LYS   PSI     -63.7   -23.7
  14 LEU   PHI     -83.0   -43.0
  14 LEU   PSI     -60.7   -16.8
  15 SER   PHI     -85.2   -45.2
  15 SER   PSI     -57.6   -17.6
  16 VAL   PHI     -85.6   -45.6
  16 VAL   PSI     -62.0   -22.0
  17 ASN   PHI     -83.6   -43.6
  17 ASN   PSI     -69.3   -18.7
  18 TRP   PHI     -86.5   -46.5
  18 TRP   PSI     -58.6   -18.6
  19 GLY   PHI     -80.9   -40.9
  19 GLY   PSI     -61.7   -21.7
  20 GLU   PHI     -84.4   -44.4
  20 GLU   PSI     -61.8   -21.8
  21 ALA   PHI     -86.1   -46.1
  21 ALA   PSI     -59.0   -19.0
  22 PHE   PHI     -85.0   -45.0
  22 PHE   PSI     -64.1   -24.1
  23 SER   PHI     -81.1   -41.1
  23 SER   PSI     -61.1   -21.1
  24 ALA   PHI     -84.6   -44.6
  24 ALA   PSI     -63.2   -23.2
  25 GLY   PHI     -84.7   -44.7
  25 GLY   PSI     -60.9   -20.9
  26 VAL   PHI     -81.8   -41.8
  26 VAL   PSI     -64.2   -24.2
  27 HIS   PHI     -81.4   -41.4
  27 HIS   PSI     -60.6   -20.6
  28 ARG   PHI     -80.1   -40.1
  28 ARG   PSI     -62.7   -22.7
  29 LEU   PHI     -83.7   -43.7
  29 LEU   PSI     -60.3   -20.3
28 ARG HN HA 5.1 0.5 1.00E+00 1.72 -1.38 6.98
3 TYR HN HA 7.6 0.5 1.00E+00 1.72 -1.38 6.98
29 LEU HN HA 4.9 0.5 1.00E+00 1.72 -1.38 6.98
27 HIS HN HA 5.2 0.5 1.00E+00 1.72 -1.38 6.98
14 LEU HN HA 3.2 0.5 1.00E+00 1.72 -1.38 6.98
17 ASN HN HA 5.5 0.5 1.00E+00 1.72 -1.38 6.98
36 PHE HN HA 8.3 0.5 1.00E+00 1.72 -1.38 6.98
5 ASN HN HA 6.0 0.5 1.00E+00 1.72 -1.38 6.98
16 VAL HN HA 6.0 0.5 1.00E+00 1.72 -1.38 6.98
24 ALA HN HA 3.9 0.5 1.00E+00 1.72 -1.38 6.98
37 TRP HN HA 8.2 0.5 1.00E+00 1.72 -1.38 6.98
15 SER HN HA 5.3 0.5 1.00E+00 1.72 -1.38 6.98
11 LYS HN HA 5.0 0.5 1.00E+00 1.72 -1.38 6.98
23 SER HN HA 3.7 0.7 1.00E+00 1.72 -1.38 6.98
12 SER HN HA 5.3 0.5 1.00E+00 1.72 -1.38 6.98
34 ASN HN HA 8.5 0.5 1.00E+00 1.72 -1.38 6.98
30 ALA HN HA 4.7 0.5 1.00E+00 1.72 -1.38 6.98
7 VAL HN HA 5.7 0.5 1.00E+00 1.72 -1.38 6.98
18 TRP HN HA 4.5 0.8 1.00E+00 1.72 -1.38 6.98
2 TYR HN HA 7.4 0.5 1.00E+00 1.72 -1.38 6.98
20 GLU HN HA 5.3 0.6 1.00E+00 1.72 -1.38 6.98
31 ASN HN HA 7.8 0.5 1.00E+00 1.72 -1.38 6.98
21 ALA HN HA 4.8 0.5 1.00E+00 1.72 -1.38 6.98
10 THR HN HA 5.9 0.5 1.00E+00 1.72 -1.38 6.98
26 VAL HN HA 4.1 0.5 1.00E+00 1.72 -1.38 6.98
22 PHE HN HA 4.5 0.9 1.00E+00 1.72 -1.38 6.98
9 LEU HN HA 5.1 0.5 1.00E+00 1.72 -1.38 6.98
8 HIS HN HA 5.3 0.5 1.00E+00 1.72 -1.38 6.98

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           HN       LYS   1   1.806   0.000   0.856
    2    HA   LYS   1           HA       LYS   1   1.414  -0.219  -2.050
    3    HB2  LYS   1           HB1      LYS   1   3.461   1.287  -2.262
    4    HB3  LYS   1           HB2      LYS   1   1.954   2.061  -1.791
    5    HG2  LYS   1           HG1      LYS   1   3.767   1.138   0.367
    6    HG3  LYS   1           HG2      LYS   1   4.236   2.564  -0.561
    7    HD2  LYS   1           HD1      LYS   1   2.570   3.833   0.298
    8    HD3  LYS   1           HD2      LYS   1   1.434   2.485   0.364
    9    HE2  LYS   1           HE1      LYS   1   1.769   2.705   2.590
   10    HE3  LYS   1           HE2      LYS   1   3.166   1.688   2.243
   11    HZ1  LYS   1           HZ1      LYS   1   4.554   3.322   2.779
   12    HZ2  LYS   1           HZ2      LYS   1   3.226   4.126   3.450
   13    HZ3  LYS   1           HZ3      LYS   1   3.713   4.472   1.867
   14    H    TYR   2           HN       TYR   2   1.817  -2.507  -1.487
   15    HA   TYR   2           HA       TYR   2   4.494  -3.210  -0.646
   16    HB2  TYR   2           HB1      TYR   2   2.048  -4.792  -1.399
   17    HB3  TYR   2           HB2      TYR   2   3.609  -5.576  -1.182
   18    HD1  TYR   2           HD2      TYR   2   4.833  -4.804   1.100
   19    HD2  TYR   2           HD1      TYR   2   0.633  -4.796   0.415
   20    HE1  TYR   2           HE2      TYR   2   4.442  -4.917   3.526
   21    HE2  TYR   2           HE1      TYR   2   0.232  -4.908   2.839
   22    HH   TYR   2           HH       TYR   2   2.932  -4.951   5.148
   23    H    TYR   3           HN       TYR   3   5.636  -2.169  -2.389
   24    HA   TYR   3           HA       TYR   3   5.300  -3.240  -5.064
   25    HB2  TYR   3           HB1      TYR   3   7.068  -1.116  -3.870
   26    HB3  TYR   3           HB2      TYR   3   7.309  -1.696  -5.514
   27    HD1  TYR   3           HD2      TYR   3   5.395  -1.466  -7.163
   28    HD2  TYR   3           HD1      TYR   3   5.422   0.493  -3.385
   29    HE1  TYR   3           HE2      TYR   3   3.682   0.103  -7.970
   30    HE2  TYR   3           HE1      TYR   3   3.708   2.066  -4.182
   31    HH   TYR   3           HH       TYR   3   1.765   1.656  -6.487
   32    H    GLY   4           HN       GLY   4   5.893  -5.343  -3.561
   33    HA2  GLY   4           HA1      GLY   4   7.419  -7.110  -4.216
   34    HA3  GLY   4           HA2      GLY   4   8.700  -5.909  -4.269
   35    H    ASN   5           HN       ASN   5   9.435  -7.982  -2.925
   36    HA   ASN   5           HA       ASN   5   8.622  -8.072  -0.199
   37    HB2  ASN   5           HB1      ASN   5  10.891  -9.264  -1.763
   38    HB3  ASN   5           HB2      ASN   5  10.872  -9.378  -0.005
   39   HD21  ASN   5          HD21      ASN   5   9.530 -10.504  -2.953
   40   HD22  ASN   5          HD22      ASN   5   8.493 -11.710  -2.278
   41    H    GLY   6           HN       GLY   6  11.174  -6.415  -1.957
   42    HA2  GLY   6           HA1      GLY   6  11.661  -4.202  -0.763
   43    HA3  GLY   6           HA2      GLY   6  12.123  -5.243   0.576
   44    H    VAL   7           HN       VAL   7  13.173  -7.200  -1.527
   45    HA   VAL   7           HA       VAL   7  15.878  -6.376  -1.405
   46    HB   VAL   7           HB       VAL   7  16.326  -8.303  -2.904
   47   HG11  VAL   7          HG11      VAL   7  16.200  -9.719  -1.166
   48   HG12  VAL   7          HG12      VAL   7  15.576  -8.320  -0.289
   49   HG13  VAL   7          HG13      VAL   7  14.460  -9.497  -0.983
   50   HG21  VAL   7          HG21      VAL   7  14.648  -8.686  -4.367
   51   HG22  VAL   7          HG22      VAL   7  14.063  -9.749  -3.088
   52   HG23  VAL   7          HG23      VAL   7  13.402  -8.123  -3.253
   53    H    HIS   8           HN       HIS   8  13.452  -6.313  -3.972
   54    HA   HIS   8           HA       HIS   8  15.245  -5.399  -5.994
   55    HB2  HIS   8           HB1      HIS   8  12.985  -6.588  -6.302
   56    HB3  HIS   8           HB2      HIS   8  12.259  -5.006  -6.033
   57    HD1  HIS   8           HD1      HIS   8  12.427  -3.293  -7.923
   58    HD2  HIS   8           HD2      HIS   8  14.395  -6.860  -8.736
   59    HE1  HIS   8           HE1      HIS   8  12.994  -3.204 -10.371
   60    H    LEU   9           HN       LEU   9  13.295  -3.862  -3.558
   61    HA   LEU   9           HA       LEU   9  13.277  -1.256  -4.683
   62    HB2  LEU   9           HB1      LEU   9  11.646  -1.619  -3.071
   63    HB3  LEU   9           HB2      LEU   9  12.780  -2.381  -1.958
   64    HG   LEU   9           HG       LEU   9  13.184   0.497  -2.563
   65   HD11  LEU   9          HD11      LEU   9  10.753  -0.619  -1.322
   66   HD12  LEU   9          HD12      LEU   9  11.011   0.924  -2.135
   67   HD13  LEU   9          HD13      LEU   9  11.526   0.712  -0.462
   68   HD21  LEU   9          HD21      LEU   9  14.650   0.120  -0.934
   69   HD22  LEU   9          HD22      LEU   9  13.956  -1.462  -0.581
   70   HD23  LEU   9          HD23      LEU   9  13.278  -0.015   0.166
   71    H    THR  10           HN       THR  10  15.569  -3.052  -2.784
   72    HA   THR  10           HA       THR  10  17.113  -0.857  -1.862
   73    HB   THR  10           HB       THR  10  18.370  -3.523  -2.371
   74    HG1  THR  10           HG1      THR  10  16.456  -2.973  -0.328
   75   HG21  THR  10          HG21      THR  10  19.907  -2.651  -1.015
   76   HG22  THR  10          HG22      THR  10  18.704  -2.550   0.271
   77   HG23  THR  10          HG23      THR  10  18.936  -1.192  -0.830
   78    H    LYS  11           HN       LYS  11  17.877  -3.253  -4.398
   79    HA   LYS  11           HA       LYS  11  20.059  -1.840  -5.454
   80    HB2  LYS  11           HB1      LYS  11  18.264  -3.979  -6.575
   81    HB3  LYS  11           HB2      LYS  11  19.563  -3.280  -7.533
   82    HG2  LYS  11           HG1      LYS  11  20.600  -5.120  -6.656
   83    HG3  LYS  11           HG2      LYS  11  21.029  -3.894  -5.460
   84    HD2  LYS  11           HD1      LYS  11  19.238  -4.639  -4.008
   85    HD3  LYS  11           HD2      LYS  11  18.702  -5.803  -5.222
   86    HE2  LYS  11           HE1      LYS  11  21.431  -5.825  -3.941
   87    HE3  LYS  11           HE2      LYS  11  20.066  -6.785  -3.373
   88    HZ1  LYS  11           HZ1      LYS  11  20.403  -8.280  -4.961
   89    HZ2  LYS  11           HZ2      LYS  11  21.881  -7.522  -5.278
   90    HZ3  LYS  11           HZ3      LYS  11  20.508  -7.106  -6.174
   91    H    SER  12           HN       SER  12  16.629  -1.611  -6.046
   92    HA   SER  12           HA       SER  12  16.713  -0.203  -8.485
   93    HB2  SER  12           HB1      SER  12  14.629  -1.156  -7.848
   94    HB3  SER  12           HB2      SER  12  14.651  -0.342  -6.284
   95    HG   SER  12           HG       SER  12  14.176   0.750  -8.842
   96    H    GLY  13           HN       GLY  13  15.879   1.147  -5.286
   97    HA2  GLY  13           HA1      GLY  13  17.687   3.364  -5.643
   98    HA3  GLY  13           HA2      GLY  13  15.996   3.804  -5.835
   99    H    LEU  14           HN       LEU  14  17.959   1.849  -3.585
  100    HA   LEU  14           HA       LEU  14  16.312   2.122  -1.367
  101    HB2  LEU  14           HB1      LEU  14  18.032   1.227  -0.116
  102    HB3  LEU  14           HB2      LEU  14  18.399   0.655  -1.743
  103    HG   LEU  14           HG       LEU  14  19.899   2.860  -1.743
  104   HD11  LEU  14          HD11      LEU  14  20.982   2.609   0.696
  105   HD12  LEU  14          HD12      LEU  14  19.291   2.302   1.091
  106   HD13  LEU  14          HD13      LEU  14  19.752   3.809   0.300
  107   HD21  LEU  14          HD21      LEU  14  20.487   0.381  -2.032
  108   HD22  LEU  14          HD22      LEU  14  20.905   0.418  -0.319
  109   HD23  LEU  14          HD23      LEU  14  21.751   1.468  -1.457
  110    H    SER  15           HN       SER  15  18.643   4.333  -2.719
  111    HA   SER  15           HA       SER  15  18.843   6.039  -0.446
  112    HB2  SER  15           HB1      SER  15  19.360   6.744  -3.343
  113    HB3  SER  15           HB2      SER  15  19.984   7.580  -1.922
  114    HG   SER  15           HG       SER  15  21.189   5.704  -3.191
  115    H    VAL  16           HN       VAL  16  17.038   6.279  -3.505
  116    HA   VAL  16           HA       VAL  16  15.689   8.677  -2.799
  117    HB   VAL  16           HB       VAL  16  15.973   7.968  -5.138
  118   HG11  VAL  16          HG11      VAL  16  14.390   6.220  -6.014
  119   HG12  VAL  16          HG12      VAL  16  15.705   5.610  -5.007
  120   HG13  VAL  16          HG13      VAL  16  14.081   5.768  -4.338
  121   HG21  VAL  16          HG21      VAL  16  14.031   9.429  -4.229
  122   HG22  VAL  16          HG22      VAL  16  13.968   8.849  -5.894
  123   HG23  VAL  16          HG23      VAL  16  13.024   8.041  -4.643
  124    H    ASN  17           HN       ASN  17  15.122   5.327  -2.144
  125    HA   ASN  17           HA       ASN  17  12.337   5.545  -1.560
  126    HB2  ASN  17           HB1      ASN  17  13.158   3.378  -2.120
  127    HB3  ASN  17           HB2      ASN  17  14.419   3.464  -0.894
  128   HD21  ASN  17          HD21      ASN  17  10.892   3.609  -1.205
  129   HD22  ASN  17          HD22      ASN  17  10.557   2.711   0.233
  130    H    TRP  18           HN       TRP  18  15.247   5.332   0.481
  131    HA   TRP  18           HA       TRP  18  13.905   5.614   2.940
  132    HB2  TRP  18           HB1      TRP  18  16.675   5.611   1.999
  133    HB3  TRP  18           HB2      TRP  18  16.419   6.666   3.387
  134    HD1  TRP  18           HD1      TRP  18  16.541   5.517   5.672
  135    HE1  TRP  18           HE1      TRP  18  16.432   3.089   6.520
  136    HE3  TRP  18           HE3      TRP  18  15.436   3.167   1.268
  137    HZ2  TRP  18           HZ2      TRP  18  15.943   0.518   5.463
  138    HZ3  TRP  18           HZ3      TRP  18  15.164   0.721   1.272
  139    HH2  TRP  18           HH2      TRP  18  15.413  -0.574   3.327
  140    H    GLY  19           HN       GLY  19  15.500   8.000   0.844
  141    HA2  GLY  19           HA1      GLY  19  15.137  10.238   2.496
  142    HA3  GLY  19           HA2      GLY  19  15.330  10.287   0.750
  143    H    GLU  20           HN       GLU  20  12.967   8.703   0.195
  144    HA   GLU  20           HA       GLU  20  11.055  10.812   0.156
  145    HB2  GLU  20           HB1      GLU  20  11.177   8.007  -0.814
  146    HB3  GLU  20           HB2      GLU  20   9.578   8.698  -0.581
  147    HG2  GLU  20           HG1      GLU  20  10.077  10.493  -2.102
  148    HG3  GLU  20           HG2      GLU  20  11.744   9.942  -2.259
  149    H    ALA  21           HN       ALA  21  11.411   7.845   2.033
  150    HA   ALA  21           HA       ALA  21   8.909   7.999   3.353
  151    HB1  ALA  21           HB1      ALA  21  11.105   6.700   4.811
  152    HB2  ALA  21           HB2      ALA  21   9.520   6.078   4.348
  153    HB3  ALA  21           HB3      ALA  21  10.834   6.105   3.172
  154    H    PHE  22           HN       PHE  22  12.078   9.347   4.014
  155    HA   PHE  22           HA       PHE  22  11.564  10.146   6.685
  156    HB2  PHE  22           HB1      PHE  22  13.830   9.938   5.491
  157    HB3  PHE  22           HB2      PHE  22  13.488  11.532   4.828
  158    HD1  PHE  22           HD1      PHE  22  13.482  13.495   6.241
  159    HD2  PHE  22           HD2      PHE  22  14.320   9.638   7.835
  160    HE1  PHE  22           HE1      PHE  22  14.372  14.537   8.284
  161    HE2  PHE  22           HE2      PHE  22  15.211  10.674   9.881
  162    HZ   PHE  22           HZ       PHE  22  15.237  13.126  10.108
  163    H    SER  23           HN       SER  23  11.318  11.821   3.572
  164    HA   SER  23           HA       SER  23  10.716  14.372   4.440
  165    HB2  SER  23           HB1      SER  23   9.667  12.876   2.029
  166    HB3  SER  23           HB2      SER  23   9.453  14.608   2.280
  167    HG   SER  23           HG       SER  23  11.450  13.525   1.101
  168    H    ALA  24           HN       ALA  24   8.368  11.811   3.630
  169    HA   ALA  24           HA       ALA  24   6.076  13.191   4.436
  170    HB1  ALA  24           HB1      ALA  24   6.729  10.553   3.558
  171    HB2  ALA  24           HB2      ALA  24   5.634  10.454   4.938
  172    HB3  ALA  24           HB3      ALA  24   5.176  11.387   3.513
  173    H    GLY  25           HN       GLY  25   8.367  11.251   6.270
  174    HA2  GLY  25           HA1      GLY  25   6.829  11.046   8.642
  175    HA3  GLY  25           HA2      GLY  25   8.570  10.839   8.522
  176    H    VAL  26           HN       VAL  26   9.045  13.492   7.441
  177    HA   VAL  26           HA       VAL  26   9.522  14.903   9.792
  178    HB   VAL  26           HB       VAL  26   9.213  16.046   7.012
  179   HG11  VAL  26          HG11      VAL  26   9.330  17.972   8.182
  180   HG12  VAL  26          HG12      VAL  26  10.031  17.193   9.602
  181   HG13  VAL  26          HG13      VAL  26  11.052  17.596   8.221
  182   HG21  VAL  26          HG21      VAL  26  11.301  14.439   8.294
  183   HG22  VAL  26          HG22      VAL  26  10.973  14.718   6.584
  184   HG23  VAL  26          HG23      VAL  26  11.887  15.907   7.511
  185    H    HIS  27           HN       HIS  27   6.771  14.996   7.601
  186    HA   HIS  27           HA       HIS  27   5.519  17.291   8.643
  187    HB2  HIS  27           HB1      HIS  27   5.015  15.812   6.506
  188    HB3  HIS  27           HB2      HIS  27   3.878  15.024   7.596
  189    HD1  HIS  27           HD1      HIS  27   2.778  17.442   9.104
  190    HD2  HIS  27           HD2      HIS  27   3.379  17.363   4.994
  191    HE1  HIS  27           HE1      HIS  27   1.237  19.194   8.166
  192    H    ARG  28           HN       ARG  28   5.326  13.881   9.538
  193    HA   ARG  28           HA       ARG  28   3.231  14.180  11.425
  194    HB2  ARG  28           HB1      ARG  28   4.098  12.029  10.311
  195    HB3  ARG  28           HB2      ARG  28   5.346  12.043  11.550
  196    HG2  ARG  28           HG1      ARG  28   2.507  12.272  12.400
  197    HG3  ARG  28           HG2      ARG  28   3.111  10.702  11.868
  198    HD2  ARG  28           HD1      ARG  28   5.096  11.319  13.503
  199    HD3  ARG  28           HD2      ARG  28   3.854  12.326  14.246
  200    HE   ARG  28           HE       ARG  28   4.080   9.500  14.420
  201   HH11  ARG  28          HH11      ARG  28   1.759  12.089  14.244
  202   HH12  ARG  28          HH12      ARG  28   0.520  11.210  15.077
  203   HH21  ARG  28          HH21      ARG  28   2.456   8.332  15.517
  204   HH22  ARG  28          HH22      ARG  28   0.918   9.074  15.801
  205    H    LEU  29           HN       LEU  29   6.740  14.355  11.640
  206    HA   LEU  29           HA       LEU  29   6.902  14.419  14.465
  207    HB2  LEU  29           HB1      LEU  29   8.719  15.121  12.213
  208    HB3  LEU  29           HB2      LEU  29   9.132  15.674  13.835
  209    HG   LEU  29           HG       LEU  29   8.568  12.779  13.289
  210   HD11  LEU  29          HD11      LEU  29  10.833  12.362  12.769
  211   HD12  LEU  29          HD12      LEU  29  11.301  14.022  13.135
  212   HD13  LEU  29          HD13      LEU  29  10.322  13.677  11.710
  213   HD21  LEU  29          HD21      LEU  29   8.653  13.556  15.613
  214   HD22  LEU  29          HD22      LEU  29  10.272  14.198  15.335
  215   HD23  LEU  29          HD23      LEU  29   9.983  12.460  15.239
  216    H    ALA  30           HN       ALA  30   6.862  16.990  12.014
  217    HA   ALA  30           HA       ALA  30   7.115  19.162  13.768
  218    HB1  ALA  30           HB1      ALA  30   7.261  19.090  11.196
  219    HB2  ALA  30           HB2      ALA  30   5.513  19.327  11.242
  220    HB3  ALA  30           HB3      ALA  30   6.585  20.527  11.963
  221    H    ASN  31           HN       ASN  31   4.198  17.636  12.414
  222    HA   ASN  31           HA       ASN  31   2.504  19.257  14.136
  223    HB2  ASN  31           HB1      ASN  31   1.962  17.288  11.923
  224    HB3  ASN  31           HB2      ASN  31   0.669  17.868  12.969
  225   HD21  ASN  31          HD21      ASN  31   2.993  18.732  10.531
  226   HD22  ASN  31          HD22      ASN  31   2.283  20.249  10.108
  227    H    GLY  32           HN       GLY  32   3.759  18.081  15.965
  228    HA2  GLY  32           HA1      GLY  32   1.931  16.142  17.076
  229    HA3  GLY  32           HA2      GLY  32   3.520  15.486  16.712
  230    H    GLY  33           HN       GLY  33   5.288  17.298  17.462
  231    HA2  GLY  33           HA1      GLY  33   5.392  17.090  20.242
  232    HA3  GLY  33           HA2      GLY  33   6.369  18.189  19.279
  233    H    ASN  34           HN       ASN  34   5.611  20.318  18.897
  234    HA   ASN  34           HA       ASN  34   3.877  21.278  21.038
  235    HB2  ASN  34           HB1      ASN  34   5.307  23.060  19.090
  236    HB3  ASN  34           HB2      ASN  34   4.870  23.376  20.766
  237   HD21  ASN  34          HD21      ASN  34   6.101  22.408  22.427
  238   HD22  ASN  34          HD22      ASN  34   7.723  21.886  22.140
  239    H    GLY  35           HN       GLY  35   2.408  23.161  20.460
  240    HA2  GLY  35           HA1      GLY  35   1.415  23.529  17.858
  241    HA3  GLY  35           HA2      GLY  35   0.449  22.291  18.646
  242    H    PHE  36           HN       PHE  36   0.225  25.324  17.834
  243    HA   PHE  36           HA       PHE  36  -0.712  26.382  20.391
  244    HB2  PHE  36           HB1      PHE  36  -0.976  28.515  19.132
  245    HB3  PHE  36           HB2      PHE  36   0.668  27.885  19.093
  246    HD1  PHE  36           HD2      PHE  36  -2.385  28.448  17.140
  247    HD2  PHE  36           HD1      PHE  36   1.663  27.136  17.050
  248    HE1  PHE  36           HE2      PHE  36  -2.409  28.553  14.683
  249    HE2  PHE  36           HE1      PHE  36   1.646  27.240  14.592
  250    HZ   PHE  36           HZ       PHE  36  -0.393  27.948  13.405
  251    H    TRP  37           HN       TRP  37  -2.097  24.232  18.871
  252    HA   TRP  37           HA       TRP  37  -4.752  25.393  19.011
  253    HB2  TRP  37           HB1      TRP  37  -5.443  24.711  16.806
  254    HB3  TRP  37           HB2      TRP  37  -4.010  25.723  16.645
  255    HD1  TRP  37           HD1      TRP  37  -1.748  24.532  15.834
  256    HE1  TRP  37           HE1      TRP  37  -1.330  22.314  14.596
  257    HE3  TRP  37           HE3      TRP  37  -6.298  22.321  16.572
  258    HZ2  TRP  37           HZ2      TRP  37  -2.743  19.942  14.010
  259    HZ3  TRP  37           HZ3      TRP  37  -6.684  20.077  15.640
  260    HH2  TRP  37           HH2      TRP  37  -4.942  18.914  14.385
  Start of MODEL    2
    1    H1   LYS   1           HN       LYS   1  11.112   3.512   7.912
    2    HA   LYS   1           HA       LYS   1  10.283   1.434   8.319
    3    HB2  LYS   1           HB1      LYS   1   8.952   2.756  10.691
    4    HB3  LYS   1           HB2      LYS   1   9.184   1.027  10.466
    5    HG2  LYS   1           HG1      LYS   1  11.595   2.747  10.381
    6    HG3  LYS   1           HG2      LYS   1  10.813   2.506  11.945
    7    HD2  LYS   1           HD1      LYS   1  12.195   0.701  11.980
    8    HD3  LYS   1           HD2      LYS   1  10.844  -0.028  11.110
    9    HE2  LYS   1           HE1      LYS   1  12.935  -0.541   9.996
   10    HE3  LYS   1           HE2      LYS   1  11.947   0.509   8.981
   11    HZ1  LYS   1           HZ1      LYS   1  14.549   0.931   9.676
   12    HZ2  LYS   1           HZ2      LYS   1  13.700   1.984  10.692
   13    HZ3  LYS   1           HZ3      LYS   1  13.499   2.081   9.015
   14    H    TYR   2           HN       TYR   2   8.872   3.110   6.522
   15    HA   TYR   2           HA       TYR   2   6.049   2.813   7.018
   16    HB2  TYR   2           HB1      TYR   2   7.221   4.674   5.660
   17    HB3  TYR   2           HB2      TYR   2   7.269   3.495   4.354
   18    HD1  TYR   2           HD2      TYR   2   4.859   5.044   6.750
   19    HD2  TYR   2           HD1      TYR   2   5.486   3.386   2.882
   20    HE1  TYR   2           HE2      TYR   2   2.561   5.655   6.122
   21    HE2  TYR   2           HE1      TYR   2   3.190   3.994   2.242
   22    HH   TYR   2           HH       TYR   2   1.434   5.463   2.865
   23    H    TYR   3           HN       TYR   3   4.607   1.517   5.821
   24    HA   TYR   3           HA       TYR   3   5.719  -1.045   5.070
   25    HB2  TYR   3           HB1      TYR   3   2.853  -0.083   5.168
   26    HB3  TYR   3           HB2      TYR   3   3.354  -1.744   4.870
   27    HD1  TYR   3           HD2      TYR   3   3.110   0.916   7.393
   28    HD2  TYR   3           HD1      TYR   3   4.127  -3.151   6.667
   29    HE1  TYR   3           HE2      TYR   3   3.119   0.492   9.816
   30    HE2  TYR   3           HE1      TYR   3   4.138  -3.587   9.088
   31    HH   TYR   3           HH       TYR   3   4.491  -2.161  11.213
   32    H    GLY   4           HN       GLY   4   6.877  -0.193   3.184
   33    HA2  GLY   4           HA1      GLY   4   5.109   0.309   0.877
   34    HA3  GLY   4           HA2      GLY   4   6.792   0.805   0.982
   35    H    ASN   5           HN       ASN   5   4.672  -1.491  -0.220
   36    HA   ASN   5           HA       ASN   5   6.442  -3.744  -0.248
   37    HB2  ASN   5           HB1      ASN   5   3.795  -3.100  -1.494
   38    HB3  ASN   5           HB2      ASN   5   4.713  -4.482  -2.087
   39   HD21  ASN   5          HD21      ASN   5   2.167  -4.080  -0.464
   40   HD22  ASN   5          HD22      ASN   5   2.356  -5.168   0.865
   41    H    GLY   6           HN       GLY   6   8.371  -2.978  -1.165
   42    HA2  GLY   6           HA1      GLY   6   8.248  -2.735  -4.094
   43    HA3  GLY   6           HA2      GLY   6   9.138  -1.534  -3.170
   44    H    VAL   7           HN       VAL   7   8.988  -4.956  -4.007
   45    HA   VAL   7           HA       VAL   7  11.434  -5.693  -2.788
   46    HB   VAL   7           HB       VAL   7   9.793  -7.380  -3.387
   47   HG11  VAL   7          HG11      VAL   7   9.335  -6.012  -5.633
   48   HG12  VAL   7          HG12      VAL   7  10.417  -7.247  -6.278
   49   HG13  VAL   7          HG13      VAL   7   8.929  -7.718  -5.457
   50   HG21  VAL   7          HG21      VAL   7  11.263  -9.030  -4.238
   51   HG22  VAL   7          HG22      VAL   7  12.227  -7.831  -5.100
   52   HG23  VAL   7          HG23      VAL   7  12.267  -7.893  -3.338
   53    H    HIS   8           HN       HIS   8  10.597  -4.583  -6.036
   54    HA   HIS   8           HA       HIS   8  13.215  -4.947  -7.110
   55    HB2  HIS   8           HB1      HIS   8  12.395  -3.748  -9.047
   56    HB3  HIS   8           HB2      HIS   8  11.155  -4.875  -8.502
   57    HD1  HIS   8           HD1      HIS   8  11.551  -1.489  -9.558
   58    HD2  HIS   8           HD2      HIS   8   9.164  -3.429  -6.764
   59    HE1  HIS   8           HE1      HIS   8   9.645   0.085  -9.093
   60    H    LEU   9           HN       LEU   9  11.560  -2.353  -5.457
   61    HA   LEU   9           HA       LEU   9  13.280  -0.236  -6.132
   62    HB2  LEU   9           HB1      LEU   9  11.269   0.396  -5.158
   63    HB3  LEU   9           HB2      LEU   9  11.423  -0.774  -3.850
   64    HG   LEU   9           HG       LEU   9  13.402   1.437  -3.950
   65   HD11  LEU   9          HD11      LEU   9  11.596   2.832  -4.305
   66   HD12  LEU   9          HD12      LEU   9  11.666   2.751  -2.545
   67   HD13  LEU   9          HD13      LEU   9  10.481   1.787  -3.425
   68   HD21  LEU   9          HD21      LEU   9  13.854   0.443  -2.011
   69   HD22  LEU   9          HD22      LEU   9  12.372  -0.512  -2.074
   70   HD23  LEU   9          HD23      LEU   9  12.342   1.121  -1.406
   71    H    THR  10           HN       THR  10  13.673  -2.918  -4.013
   72    HA   THR  10           HA       THR  10  15.628  -1.818  -2.276
   73    HB   THR  10           HB       THR  10  15.315  -4.729  -3.025
   74    HG1  THR  10           HG1      THR  10  13.354  -4.276  -2.236
   75   HG21  THR  10          HG21      THR  10  16.718  -5.212  -1.336
   76   HG22  THR  10          HG22      THR  10  16.021  -3.981  -0.283
   77   HG23  THR  10          HG23      THR  10  17.232  -3.532  -1.482
   78    H    LYS  11           HN       LYS  11  16.033  -4.180  -4.924
   79    HA   LYS  11           HA       LYS  11  18.854  -3.852  -5.026
   80    HB2  LYS  11           HB1      LYS  11  16.807  -5.248  -6.690
   81    HB3  LYS  11           HB2      LYS  11  18.404  -4.987  -7.378
   82    HG2  LYS  11           HG1      LYS  11  18.438  -6.082  -4.667
   83    HG3  LYS  11           HG2      LYS  11  17.674  -7.128  -5.866
   84    HD2  LYS  11           HD1      LYS  11  19.826  -6.455  -7.267
   85    HD3  LYS  11           HD2      LYS  11  20.495  -6.215  -5.651
   86    HE2  LYS  11           HE1      LYS  11  19.271  -8.609  -5.343
   87    HE3  LYS  11           HE2      LYS  11  19.728  -8.695  -7.043
   88    HZ1  LYS  11           HZ1      LYS  11  21.384  -9.520  -5.300
   89    HZ2  LYS  11           HZ2      LYS  11  21.685  -7.886  -4.987
   90    HZ3  LYS  11           HZ3      LYS  11  21.969  -8.517  -6.531
   91    H    SER  12           HN       SER  12  16.174  -2.275  -6.586
   92    HA   SER  12           HA       SER  12  17.545  -1.132  -8.764
   93    HB2  SER  12           HB1      SER  12  15.096  -1.202  -8.646
   94    HB3  SER  12           HB2      SER  12  15.121  -0.095  -7.273
   95    HG   SER  12           HG       SER  12  15.394   1.519  -8.594
   96    H    GLY  13           HN       GLY  13  17.453  -0.343  -5.397
   97    HA2  GLY  13           HA1      GLY  13  19.633   1.122  -5.088
   98    HA3  GLY  13           HA2      GLY  13  18.583   2.314  -5.841
   99    H    LEU  14           HN       LEU  14  18.325  -0.120  -3.242
  100    HA   LEU  14           HA       LEU  14  16.359   1.169  -1.765
  101    HB2  LEU  14           HB1      LEU  14  16.838  -0.309  -0.036
  102    HB3  LEU  14           HB2      LEU  14  17.332  -1.176  -1.488
  103    HG   LEU  14           HG       LEU  14  19.241   0.293   0.325
  104   HD11  LEU  14          HD11      LEU  14  17.854  -2.030   0.929
  105   HD12  LEU  14          HD12      LEU  14  19.337  -1.457   1.691
  106   HD13  LEU  14          HD13      LEU  14  19.421  -2.593   0.345
  107   HD21  LEU  14          HD21      LEU  14  19.481  -1.285  -2.169
  108   HD22  LEU  14          HD22      LEU  14  20.718  -1.533  -0.936
  109   HD23  LEU  14          HD23      LEU  14  20.437   0.080  -1.591
  110    H    SER  15           HN       SER  15  19.744   1.847  -2.033
  111    HA   SER  15           HA       SER  15  20.003   3.371   0.360
  112    HB2  SER  15           HB1      SER  15  21.898   2.334  -0.977
  113    HB3  SER  15           HB2      SER  15  21.694   3.654  -2.129
  114    HG   SER  15           HG       SER  15  23.011   4.657  -0.829
  115    H    VAL  16           HN       VAL  16  19.742   4.331  -3.065
  116    HA   VAL  16           HA       VAL  16  19.469   7.101  -2.492
  117    HB   VAL  16           HB       VAL  16  20.258   6.240  -4.676
  118   HG11  VAL  16          HG11      VAL  16  18.792   4.353  -4.962
  119   HG12  VAL  16          HG12      VAL  16  17.378   5.408  -5.007
  120   HG13  VAL  16          HG13      VAL  16  18.564   5.464  -6.312
  121   HG21  VAL  16          HG21      VAL  16  18.688   8.447  -4.161
  122   HG22  VAL  16          HG22      VAL  16  19.641   8.169  -5.620
  123   HG23  VAL  16          HG23      VAL  16  17.932   7.732  -5.585
  124    H    ASN  17           HN       ASN  17  17.236   4.448  -2.695
  125    HA   ASN  17           HA       ASN  17  14.875   6.016  -3.027
  126    HB2  ASN  17           HB1      ASN  17  15.426   3.164  -2.267
  127    HB3  ASN  17           HB2      ASN  17  13.799   3.822  -2.118
  128   HD21  ASN  17          HD21      ASN  17  13.105   5.078  -4.148
  129   HD22  ASN  17          HD22      ASN  17  13.410   4.282  -5.651
  130    H    TRP  18           HN       TRP  18  16.774   4.962  -0.305
  131    HA   TRP  18           HA       TRP  18  14.829   5.391   1.711
  132    HB2  TRP  18           HB1      TRP  18  17.100   4.124   1.824
  133    HB3  TRP  18           HB2      TRP  18  17.778   5.709   2.188
  134    HD1  TRP  18           HD1      TRP  18  17.929   6.214   4.684
  135    HE1  TRP  18           HE1      TRP  18  16.717   5.418   6.811
  136    HE3  TRP  18           HE3      TRP  18  14.469   3.121   2.538
  137    HZ2  TRP  18           HZ2      TRP  18  14.578   3.706   7.489
  138    HZ3  TRP  18           HZ3      TRP  18  12.877   1.941   3.997
  139    HH2  TRP  18           HH2      TRP  18  12.932   2.228   6.421
  140    H    GLY  19           HN       GLY  19  17.598   7.393   0.671
  141    HA2  GLY  19           HA1      GLY  19  17.112   9.590   2.303
  142    HA3  GLY  19           HA2      GLY  19  17.924   9.663   0.746
  143    H    GLU  20           HN       GLU  20  15.697   8.774  -0.822
  144    HA   GLU  20           HA       GLU  20  14.392  11.273  -1.196
  145    HB2  GLU  20           HB1      GLU  20  14.193   8.565  -2.449
  146    HB3  GLU  20           HB2      GLU  20  12.930   9.745  -2.767
  147    HG2  GLU  20           HG1      GLU  20  15.778  10.533  -3.126
  148    HG3  GLU  20           HG2      GLU  20  14.992   9.537  -4.350
  149    H    ALA  21           HN       ALA  21  13.346   8.138   0.083
  150    HA   ALA  21           HA       ALA  21  10.647   8.862   0.512
  151    HB1  ALA  21           HB1      ALA  21  11.697   6.874   2.369
  152    HB2  ALA  21           HB2      ALA  21  10.409   6.740   1.171
  153    HB3  ALA  21           HB3      ALA  21  12.091   6.538   0.683
  154    H    PHE  22           HN       PHE  22  13.551   9.162   2.463
  155    HA   PHE  22           HA       PHE  22  12.375   9.733   4.934
  156    HB2  PHE  22           HB1      PHE  22  14.890   9.374   4.218
  157    HB3  PHE  22           HB2      PHE  22  14.888  11.131   4.113
  158    HD1  PHE  22           HD2      PHE  22  13.993  12.394   6.198
  159    HD2  PHE  22           HD1      PHE  22  15.319   8.350   6.238
  160    HE1  PHE  22           HE2      PHE  22  14.352  12.539   8.628
  161    HE2  PHE  22           HE1      PHE  22  15.679   8.488   8.668
  162    HZ   PHE  22           HZ       PHE  22  15.196  10.585   9.866
  163    H    SER  23           HN       SER  23  13.483  11.969   2.394
  164    HA   SER  23           HA       SER  23  12.798  14.359   3.609
  165    HB2  SER  23           HB1      SER  23  12.654  13.677   0.662
  166    HB3  SER  23           HB2      SER  23  12.687  15.308   1.332
  167    HG   SER  23           HG       SER  23  14.752  14.093   0.610
  168    H    ALA  24           HN       ALA  24  10.785  12.179   1.685
  169    HA   ALA  24           HA       ALA  24   8.500  13.755   1.472
  170    HB1  ALA  24           HB1      ALA  24   9.211  11.197   0.737
  171    HB2  ALA  24           HB2      ALA  24   7.894  10.941   1.883
  172    HB3  ALA  24           HB3      ALA  24   7.644  11.959   0.464
  173    H    GLY  25           HN       GLY  25   9.130  11.193   3.885
  174    HA2  GLY  25           HA1      GLY  25   6.887  11.565   5.459
  175    HA3  GLY  25           HA2      GLY  25   8.429  10.976   6.062
  176    H    VAL  26           HN       VAL  26   9.913  13.370   5.493
  177    HA   VAL  26           HA       VAL  26   9.569  14.758   7.890
  178    HB   VAL  26           HB       VAL  26  10.913  15.727   5.363
  179   HG11  VAL  26          HG11      VAL  26  10.929  17.670   6.503
  180   HG12  VAL  26          HG12      VAL  26  10.613  16.886   8.052
  181   HG13  VAL  26          HG13      VAL  26  12.248  16.908   7.391
  182   HG21  VAL  26          HG21      VAL  26  11.575  13.568   6.963
  183   HG22  VAL  26          HG22      VAL  26  12.646  14.404   5.839
  184   HG23  VAL  26          HG23      VAL  26  12.623  14.863   7.541
  185    H    HIS  27           HN       HIS  27   8.193  15.289   4.717
  186    HA   HIS  27           HA       HIS  27   7.270  17.920   5.092
  187    HB2  HIS  27           HB1      HIS  27   7.391  16.664   2.905
  188    HB3  HIS  27           HB2      HIS  27   5.940  15.799   3.401
  189    HD1  HIS  27           HD1      HIS  27   3.821  17.468   3.936
  190    HD2  HIS  27           HD2      HIS  27   6.885  18.958   1.557
  191    HE1  HIS  27           HE1      HIS  27   2.838  19.446   2.733
  192    H    ARG  28           HN       ARG  28   5.765  14.781   5.738
  193    HA   ARG  28           HA       ARG  28   3.269  15.849   6.579
  194    HB2  ARG  28           HB1      ARG  28   3.690  13.486   5.798
  195    HB3  ARG  28           HB2      ARG  28   4.452  13.181   7.353
  196    HG2  ARG  28           HG1      ARG  28   2.287  12.386   7.623
  197    HG3  ARG  28           HG2      ARG  28   2.244  13.982   8.376
  198    HD2  ARG  28           HD1      ARG  28   0.278  13.715   7.026
  199    HD3  ARG  28           HD2      ARG  28   1.335  14.897   6.255
  200    HE   ARG  28           HE       ARG  28   1.462  13.511   4.452
  201   HH11  ARG  28          HH11      ARG  28   0.508  11.633   7.224
  202   HH12  ARG  28          HH12      ARG  28   0.268  10.176   6.318
  203   HH21  ARG  28          HH21      ARG  28   1.150  11.599   3.248
  204   HH22  ARG  28          HH22      ARG  28   0.634  10.158   4.057
  205    H    LEU  29           HN       LEU  29   6.242  14.961   8.247
  206    HA   LEU  29           HA       LEU  29   5.302  15.126  10.882
  207    HB2  LEU  29           HB1      LEU  29   7.957  15.307   9.564
  208    HB3  LEU  29           HB2      LEU  29   7.829  15.854  11.234
  209    HG   LEU  29           HG       LEU  29   7.146  13.090  10.232
  210   HD11  LEU  29          HD11      LEU  29   9.533  14.186  11.699
  211   HD12  LEU  29          HD12      LEU  29   9.500  13.344  10.150
  212   HD13  LEU  29          HD13      LEU  29   9.136  12.468  11.637
  213   HD21  LEU  29          HD21      LEU  29   5.871  13.086  12.081
  214   HD22  LEU  29          HD22      LEU  29   6.670  14.503  12.762
  215   HD23  LEU  29          HD23      LEU  29   7.410  12.910  12.924
  216    H    ALA  30           HN       ALA  30   6.490  17.593   8.669
  217    HA   ALA  30           HA       ALA  30   6.639  19.699  10.556
  218    HB1  ALA  30           HB1      ALA  30   7.278  19.366   7.874
  219    HB2  ALA  30           HB2      ALA  30   6.025  20.608   7.881
  220    HB3  ALA  30           HB3      ALA  30   7.490  20.827   8.838
  221    H    ASN  31           HN       ASN  31   4.015  18.243   8.839
  222    HA   ASN  31           HA       ASN  31   2.147  20.007  10.207
  223    HB2  ASN  31           HB1      ASN  31   2.790  20.513   7.558
  224    HB3  ASN  31           HB2      ASN  31   1.303  19.577   7.446
  225   HD21  ASN  31          HD21      ASN  31   2.160  22.525   7.156
  226   HD22  ASN  31          HD22      ASN  31   0.924  23.373   8.014
  227    H    GLY  32           HN       GLY  32   1.308  18.369  11.414
  228    HA2  GLY  32           HA1      GLY  32  -0.611  16.888  11.463
  229    HA3  GLY  32           HA2      GLY  32  -0.091  16.253   9.909
  230    H    GLY  33           HN       GLY  33   2.276  16.846  12.370
  231    HA2  GLY  33           HA1      GLY  33   2.634  13.934  12.628
  232    HA3  GLY  33           HA2      GLY  33   3.893  15.136  12.867
  233    H    ASN  34           HN       ASN  34   2.303  16.896  14.503
  234    HA   ASN  34           HA       ASN  34   2.573  15.457  17.011
  235    HB2  ASN  34           HB1      ASN  34   2.191  17.702  18.035
  236    HB3  ASN  34           HB2      ASN  34   3.554  17.662  16.920
  237   HD21  ASN  34          HD21      ASN  34   3.635  19.160  15.404
  238   HD22  ASN  34          HD22      ASN  34   2.323  20.169  14.909
  239    H    GLY  35           HN       GLY  35   0.884  15.910  18.736
  240    HA2  GLY  35           HA1      GLY  35  -1.828  16.190  17.686
  241    HA3  GLY  35           HA2      GLY  35  -1.422  14.652  18.433
  242    H    PHE  36           HN       PHE  36  -1.607  18.134  19.022
  243    HA   PHE  36           HA       PHE  36  -1.594  17.680  21.903
  244    HB2  PHE  36           HB1      PHE  36  -0.249  19.533  21.050
  245    HB3  PHE  36           HB2      PHE  36  -1.674  20.246  20.301
  246    HD1  PHE  36           HD2      PHE  36  -0.031  19.491  23.506
  247    HD2  PHE  36           HD1      PHE  36  -3.218  21.534  21.561
  248    HE1  PHE  36           HE2      PHE  36  -0.481  20.749  25.572
  249    HE2  PHE  36           HE1      PHE  36  -3.673  22.796  23.624
  250    HZ   PHE  36           HZ       PHE  36  -2.305  22.403  25.634
  251    H    TRP  37           HN       TRP  37  -3.737  18.744  19.328
  252    HA   TRP  37           HA       TRP  37  -5.912  19.187  21.221
  253    HB2  TRP  37           HB1      TRP  37  -5.384  20.694  19.193
  254    HB3  TRP  37           HB2      TRP  37  -6.127  19.421  18.228
  255    HD1  TRP  37           HD1      TRP  37  -8.736  18.718  19.356
  256    HE1  TRP  37           HE1      TRP  37 -10.606  20.398  19.908
  257    HE3  TRP  37           HE3      TRP  37  -5.923  22.971  19.731
  258    HZ2  TRP  37           HZ2      TRP  37 -10.856  23.160  20.433
  259    HZ3  TRP  37           HZ3      TRP  37  -7.055  25.090  20.261
  260    HH2  TRP  37           HH2      TRP  37  -9.471  25.181  20.604
  Start of MODEL    3
    1    H1   LYS   1           HN       LYS   1  -2.543  -1.449   4.492
    2    HA   LYS   1           HA       LYS   1  -1.730  -1.146   6.717
    3    HB2  LYS   1           HB1      LYS   1  -1.594  -3.545   7.589
    4    HB3  LYS   1           HB2      LYS   1  -3.075  -3.076   6.765
    5    HG2  LYS   1           HG1      LYS   1  -0.929  -4.322   5.141
    6    HG3  LYS   1           HG2      LYS   1  -1.835  -5.353   6.250
    7    HD2  LYS   1           HD1      LYS   1  -3.366  -3.501   4.499
    8    HD3  LYS   1           HD2      LYS   1  -2.636  -4.927   3.758
    9    HE2  LYS   1           HE1      LYS   1  -4.233  -5.207   6.268
   10    HE3  LYS   1           HE2      LYS   1  -5.060  -5.040   4.720
   11    HZ1  LYS   1           HZ1      LYS   1  -4.806  -7.237   4.582
   12    HZ2  LYS   1           HZ2      LYS   1  -3.636  -7.290   5.801
   13    HZ3  LYS   1           HZ3      LYS   1  -3.185  -6.923   4.212
   14    H    TYR   2           HN       TYR   2   0.452  -0.392   5.330
   15    HA   TYR   2           HA       TYR   2   2.595  -1.491   6.945
   16    HB2  TYR   2           HB1      TYR   2   2.392  -1.893   4.002
   17    HB3  TYR   2           HB2      TYR   2   3.978  -1.512   4.663
   18    HD1  TYR   2           HD1      TYR   2   4.227  -2.933   7.093
   19    HD2  TYR   2           HD2      TYR   2   2.196  -4.142   3.555
   20    HE1  TYR   2           HE1      TYR   2   4.530  -5.289   7.731
   21    HE2  TYR   2           HE2      TYR   2   2.492  -6.501   4.185
   22    HH   TYR   2           HH       TYR   2   3.823  -7.886   5.559
   23    H    TYR   3           HN       TYR   3   4.526  -0.173   6.903
   24    HA   TYR   3           HA       TYR   3   3.876   2.629   6.535
   25    HB2  TYR   3           HB1      TYR   3   5.986   3.053   7.714
   26    HB3  TYR   3           HB2      TYR   3   4.981   1.914   8.603
   27    HD1  TYR   3           HD2      TYR   3   8.013   2.274   6.545
   28    HD2  TYR   3           HD1      TYR   3   5.691  -0.349   8.960
   29    HE1  TYR   3           HE2      TYR   3   9.885   0.680   6.604
   30    HE2  TYR   3           HE1      TYR   3   7.557  -1.950   9.026
   31    HH   TYR   3           HH       TYR   3  10.587  -1.267   8.396
   32    H    GLY   4           HN       GLY   4   5.773   0.161   5.003
   33    HA2  GLY   4           HA1      GLY   4   6.674   2.161   3.029
   34    HA3  GLY   4           HA2      GLY   4   7.764   0.916   3.619
   35    H    ASN   5           HN       ASN   5   7.059   1.358   0.893
   36    HA   ASN   5           HA       ASN   5   6.304  -1.317   0.191
   37    HB2  ASN   5           HB1      ASN   5   4.070  -0.440   0.483
   38    HB3  ASN   5           HB2      ASN   5   4.451   0.972  -0.499
   39   HD21  ASN   5          HD21      ASN   5   4.394  -2.566  -0.662
   40   HD22  ASN   5          HD22      ASN   5   3.848  -2.653  -2.299
   41    H    GLY   6           HN       GLY   6   8.337  -1.304  -0.805
   42    HA2  GLY   6           HA1      GLY   6   8.341  -0.451  -3.519
   43    HA3  GLY   6           HA2      GLY   6   9.360   0.595  -2.542
   44    H    VAL   7           HN       VAL   7   8.853  -2.735  -3.585
   45    HA   VAL   7           HA       VAL   7  11.227  -3.791  -2.461
   46    HB   VAL   7           HB       VAL   7  10.911  -5.667  -4.054
   47   HG11  VAL   7          HG11      VAL   7   8.253  -4.977  -2.851
   48   HG12  VAL   7          HG12      VAL   7   9.040  -6.551  -2.977
   49   HG13  VAL   7          HG13      VAL   7   9.649  -5.348  -1.840
   50   HG21  VAL   7          HG21      VAL   7  10.018  -5.003  -6.021
   51   HG22  VAL   7          HG22      VAL   7   8.499  -5.379  -5.209
   52   HG23  VAL   7          HG23      VAL   7   9.071  -3.713  -5.280
   53    H    HIS   8           HN       HIS   8  10.467  -2.395  -5.617
   54    HA   HIS   8           HA       HIS   8  13.021  -2.952  -6.761
   55    HB2  HIS   8           HB1      HIS   8  10.962  -2.582  -8.105
   56    HB3  HIS   8           HB2      HIS   8  10.978  -0.891  -7.615
   57    HD1  HIS   8           HD1      HIS   8  11.716   0.441  -9.556
   58    HD2  HIS   8           HD2      HIS   8  13.887  -3.082  -9.192
   59    HE1  HIS   8           HE1      HIS   8  13.439   0.522 -11.385
   60    H    LEU   9           HN       LEU   9  11.659  -0.316  -4.918
   61    HA   LEU   9           HA       LEU   9  13.577   1.656  -5.490
   62    HB2  LEU   9           HB1      LEU   9  11.652   2.424  -4.442
   63    HB3  LEU   9           HB2      LEU   9  11.703   1.163  -3.212
   64    HG   LEU   9           HG       LEU   9  13.895   3.165  -3.212
   65   HD11  LEU   9          HD11      LEU   9  12.630   4.841  -2.121
   66   HD12  LEU   9          HD12      LEU   9  11.201   3.811  -2.040
   67   HD13  LEU   9          HD13      LEU   9  11.753   4.433  -3.596
   68   HD21  LEU   9          HD21      LEU   9  14.267   2.010  -1.347
   69   HD22  LEU   9          HD22      LEU   9  12.695   1.215  -1.441
   70   HD23  LEU   9          HD23      LEU   9  12.839   2.797  -0.673
   71    H    THR  10           HN       THR  10  13.721  -1.182  -3.552
   72    HA   THR  10           HA       THR  10  15.798  -0.399  -1.786
   73    HB   THR  10           HB       THR  10  15.249  -3.222  -2.702
   74    HG1  THR  10           HG1      THR  10  14.015  -1.969  -0.477
   75   HG21  THR  10          HG21      THR  10  16.443  -3.912  -0.900
   76   HG22  THR  10          HG22      THR  10  15.930  -2.549   0.096
   77   HG23  THR  10          HG23      THR  10  17.215  -2.339  -1.093
   78    H    LYS  11           HN       LYS  11  15.930  -2.615  -4.583
   79    HA   LYS  11           HA       LYS  11  18.768  -2.565  -4.716
   80    HB2  LYS  11           HB1      LYS  11  16.618  -3.537  -6.584
   81    HB3  LYS  11           HB2      LYS  11  18.317  -3.592  -7.034
   82    HG2  LYS  11           HG1      LYS  11  18.820  -5.202  -5.466
   83    HG3  LYS  11           HG2      LYS  11  17.435  -4.796  -4.451
   84    HD2  LYS  11           HD1      LYS  11  15.926  -5.751  -6.118
   85    HD3  LYS  11           HD2      LYS  11  17.303  -6.134  -7.154
   86    HE2  LYS  11           HE1      LYS  11  16.828  -7.230  -4.383
   87    HE3  LYS  11           HE2      LYS  11  16.521  -8.090  -5.891
   88    HZ1  LYS  11           HZ1      LYS  11  19.019  -7.597  -4.525
   89    HZ2  LYS  11           HZ2      LYS  11  19.077  -7.340  -6.195
   90    HZ3  LYS  11           HZ3      LYS  11  18.593  -8.843  -5.587
   91    H    SER  12           HN       SER  12  16.243  -0.634  -6.130
   92    HA   SER  12           HA       SER  12  17.700   0.506  -8.254
   93    HB2  SER  12           HB1      SER  12  15.259   1.322  -6.712
   94    HB3  SER  12           HB2      SER  12  15.982   2.443  -7.865
   95    HG   SER  12           HG       SER  12  14.994  -0.165  -8.381
   96    H    GLY  13           HN       GLY  13  17.717   1.084  -4.842
   97    HA2  GLY  13           HA1      GLY  13  20.036   2.305  -4.479
   98    HA3  GLY  13           HA2      GLY  13  19.101   3.639  -5.136
   99    H    LEU  14           HN       LEU  14  18.639   1.081  -2.691
  100    HA   LEU  14           HA       LEU  14  16.823   2.454  -1.102
  101    HB2  LEU  14           HB1      LEU  14  17.179   0.830   0.524
  102    HB3  LEU  14           HB2      LEU  14  17.568   0.014  -0.989
  103    HG   LEU  14           HG       LEU  14  19.634   1.174   0.875
  104   HD11  LEU  14          HD11      LEU  14  19.167  -1.751   0.600
  105   HD12  LEU  14          HD12      LEU  14  18.116  -0.820   1.666
  106   HD13  LEU  14          HD13      LEU  14  19.858  -0.836   1.940
  107   HD21  LEU  14          HD21      LEU  14  19.688  -0.270  -1.712
  108   HD22  LEU  14          HD22      LEU  14  20.916  -0.695  -0.520
  109   HD23  LEU  14          HD23      LEU  14  20.770   0.971  -1.081
  110    H    SER  15           HN       SER  15  20.253   2.824  -1.390
  111    HA   SER  15           HA       SER  15  20.689   4.157   1.089
  112    HB2  SER  15           HB1      SER  15  22.803   4.977  -0.175
  113    HB3  SER  15           HB2      SER  15  22.634   3.252   0.148
  114    HG   SER  15           HG       SER  15  22.560   4.626  -2.252
  115    H    VAL  16           HN       VAL  16  20.456   5.357  -2.260
  116    HA   VAL  16           HA       VAL  16  20.463   8.098  -1.510
  117    HB   VAL  16           HB       VAL  16  21.129   7.324  -3.759
  118   HG11  VAL  16          HG11      VAL  16  19.342   6.793  -5.399
  119   HG12  VAL  16          HG12      VAL  16  19.513   5.580  -4.129
  120   HG13  VAL  16          HG13      VAL  16  18.187   6.742  -4.068
  121   HG21  VAL  16          HG21      VAL  16  18.785   9.122  -4.182
  122   HG22  VAL  16          HG22      VAL  16  20.113   9.658  -3.152
  123   HG23  VAL  16          HG23      VAL  16  20.420   9.232  -4.836
  124    H    ASN  17           HN       ASN  17  17.975   5.690  -1.865
  125    HA   ASN  17           HA       ASN  17  15.778   7.506  -2.010
  126    HB2  ASN  17           HB1      ASN  17  16.022   4.559  -1.449
  127    HB3  ASN  17           HB2      ASN  17  14.474   5.388  -1.311
  128   HD21  ASN  17          HD21      ASN  17  14.038   6.856  -3.290
  129   HD22  ASN  17          HD22      ASN  17  14.296   6.106  -4.825
  130    H    TRP  18           HN       TRP  18  17.649   6.122   0.560
  131    HA   TRP  18           HA       TRP  18  15.888   6.316   2.702
  132    HB2  TRP  18           HB1      TRP  18  18.375   5.445   2.527
  133    HB3  TRP  18           HB2      TRP  18  18.755   7.071   3.087
  134    HD1  TRP  18           HD1      TRP  18  17.927   7.736   5.572
  135    HE1  TRP  18           HE1      TRP  18  17.370   6.274   7.616
  136    HE3  TRP  18           HE3      TRP  18  17.392   3.226   3.224
  137    HZ2  TRP  18           HZ2      TRP  18  16.783   3.568   8.162
  138    HZ3  TRP  18           HZ3      TRP  18  16.833   1.250   4.580
  139    HH2  TRP  18           HH2      TRP  18  16.535   1.419   6.997
  140    H    GLY  19           HN       GLY  19  18.154   8.768   1.458
  141    HA2  GLY  19           HA1      GLY  19  17.535  10.785   3.302
  142    HA3  GLY  19           HA2      GLY  19  18.188  11.050   1.692
  143    H    GLU  20           HN       GLU  20  16.040   9.983   0.197
  144    HA   GLU  20           HA       GLU  20  14.339  12.246   0.101
  145    HB2  GLU  20           HB1      GLU  20  14.230   9.552  -1.247
  146    HB3  GLU  20           HB2      GLU  20  13.026  10.800  -1.535
  147    HG2  GLU  20           HG1      GLU  20  14.528  12.188  -2.612
  148    HG3  GLU  20           HG2      GLU  20  15.929  11.404  -1.883
  149    H    ALA  21           HN       ALA  21  13.915   8.955   1.324
  150    HA   ALA  21           HA       ALA  21  11.169   9.192   1.954
  151    HB1  ALA  21           HB1      ALA  21  12.683   7.387   3.677
  152    HB2  ALA  21           HB2      ALA  21  11.347   7.052   2.575
  153    HB3  ALA  21           HB3      ALA  21  12.996   7.151   1.957
  154    H    PHE  22           HN       PHE  22  14.100  10.046   3.664
  155    HA   PHE  22           HA       PHE  22  12.988  10.357   6.237
  156    HB2  PHE  22           HB1      PHE  22  15.486  10.342   5.418
  157    HB3  PHE  22           HB2      PHE  22  15.247  12.083   5.297
  158    HD1  PHE  22           HD1      PHE  22  14.968   9.233   7.660
  159    HD2  PHE  22           HD2      PHE  22  15.460  13.433   7.176
  160    HE1  PHE  22           HE1      PHE  22  15.415   9.455  10.069
  161    HE2  PHE  22           HE2      PHE  22  15.908  13.662   9.584
  162    HZ   PHE  22           HZ       PHE  22  15.887  11.671  11.034
  163    H    SER  23           HN       SER  23  13.749  12.806   3.759
  164    HA   SER  23           HA       SER  23  12.639  14.991   5.101
  165    HB2  SER  23           HB1      SER  23  14.130  15.101   3.082
  166    HB3  SER  23           HB2      SER  23  12.746  14.622   2.099
  167    HG   SER  23           HG       SER  23  13.397  17.052   2.930
  168    H    ALA  24           HN       ALA  24  11.164  12.515   3.125
  169    HA   ALA  24           HA       ALA  24   8.704  13.749   2.596
  170    HB1  ALA  24           HB1      ALA  24   9.861  11.178   2.242
  171    HB2  ALA  24           HB2      ALA  24   8.264  10.973   2.963
  172    HB3  ALA  24           HB3      ALA  24   8.442  11.867   1.453
  173    H    GLY  25           HN       GLY  25   9.723  11.693   5.311
  174    HA2  GLY  25           HA1      GLY  25   7.246  11.575   6.625
  175    HA3  GLY  25           HA2      GLY  25   8.814  11.372   7.393
  176    H    VAL  26           HN       VAL  26   9.973  13.807   7.138
  177    HA   VAL  26           HA       VAL  26   8.863  15.284   9.221
  178    HB   VAL  26           HB       VAL  26  10.698  16.312   7.052
  179   HG11  VAL  26          HG11      VAL  26  10.220  18.257   8.093
  180   HG12  VAL  26          HG12      VAL  26   9.658  17.458   9.562
  181   HG13  VAL  26          HG13      VAL  26  11.386  17.664   9.274
  182   HG21  VAL  26          HG21      VAL  26  11.623  14.331   8.099
  183   HG22  VAL  26          HG22      VAL  26  12.511  15.761   8.627
  184   HG23  VAL  26          HG23      VAL  26  11.329  15.011   9.700
  185    H    HIS  27           HN       HIS  27   8.487  15.630   5.730
  186    HA   HIS  27           HA       HIS  27   7.115  18.090   5.748
  187    HB2  HIS  27           HB1      HIS  27   8.143  16.969   3.739
  188    HB3  HIS  27           HB2      HIS  27   6.770  15.866   3.731
  189    HD1  HIS  27           HD1      HIS  27   5.597  16.594   1.643
  190    HD2  HIS  27           HD2      HIS  27   6.497  19.781   4.152
  191    HE1  HIS  27           HE1      HIS  27   4.444  18.589   0.635
  192    H    ARG  28           HN       ARG  28   5.980  14.745   5.926
  193    HA   ARG  28           HA       ARG  28   3.218  15.342   5.802
  194    HB2  ARG  28           HB1      ARG  28   4.877  12.991   6.499
  195    HB3  ARG  28           HB2      ARG  28   3.253  13.015   7.172
  196    HG2  ARG  28           HG1      ARG  28   3.904  13.314   4.248
  197    HG3  ARG  28           HG2      ARG  28   3.400  11.813   5.028
  198    HD2  ARG  28           HD1      ARG  28   1.491  13.655   5.818
  199    HD3  ARG  28           HD2      ARG  28   1.812  14.073   4.136
  200    HE   ARG  28           HE       ARG  28   0.757  12.148   3.503
  201   HH11  ARG  28          HH11      ARG  28   1.602  11.914   6.872
  202   HH12  ARG  28          HH12      ARG  28   0.750  10.425   7.117
  203   HH21  ARG  28          HH21      ARG  28  -0.368  10.188   3.812
  204   HH22  ARG  28          HH22      ARG  28  -0.370   9.444   5.375
  205    H    LEU  29           HN       LEU  29   5.498  15.036   8.475
  206    HA   LEU  29           HA       LEU  29   3.643  15.110  10.582
  207    HB2  LEU  29           HB1      LEU  29   6.546  15.697  10.298
  208    HB3  LEU  29           HB2      LEU  29   5.728  16.207  11.773
  209    HG   LEU  29           HG       LEU  29   5.592  13.366  10.815
  210   HD11  LEU  29          HD11      LEU  29   7.623  14.328  12.796
  211   HD12  LEU  29          HD12      LEU  29   7.985  14.257  11.072
  212   HD13  LEU  29          HD13      LEU  29   7.545  12.787  11.942
  213   HD21  LEU  29          HD21      LEU  29   4.717  14.892  13.138
  214   HD22  LEU  29          HD22      LEU  29   5.633  13.445  13.563
  215   HD23  LEU  29          HD23      LEU  29   4.192  13.312  12.554
  216    H    ALA  30           HN       ALA  30   5.543  17.739   9.109
  217    HA   ALA  30           HA       ALA  30   4.487  19.827  10.646
  218    HB1  ALA  30           HB1      ALA  30   6.415  19.636   8.744
  219    HB2  ALA  30           HB2      ALA  30   5.159  20.518   7.875
  220    HB3  ALA  30           HB3      ALA  30   5.793  21.154   9.393
  221    H    ASN  31           HN       ASN  31   3.526  18.681   7.411
  222    HA   ASN  31           HA       ASN  31   1.157  20.368   7.489
  223    HB2  ASN  31           HB1      ASN  31   2.684  19.916   5.425
  224    HB3  ASN  31           HB2      ASN  31   1.772  18.415   5.294
  225   HD21  ASN  31          HD21      ASN  31   1.775  20.370   3.324
  226   HD22  ASN  31          HD22      ASN  31   0.191  21.053   3.216
  227    H    GLY  32           HN       GLY  32   0.124  19.274   9.265
  228    HA2  GLY  32           HA1      GLY  32  -1.988  17.717   8.754
  229    HA3  GLY  32           HA2      GLY  32  -0.707  16.517   8.857
  230    H    GLY  33           HN       GLY  33   0.787  17.041  10.901
  231    HA2  GLY  33           HA1      GLY  33  -1.084  17.037  13.167
  232    HA3  GLY  33           HA2      GLY  33   0.528  16.337  13.168
  233    H    ASN  34           HN       ASN  34  -1.339  19.260  13.497
  234    HA   ASN  34           HA       ASN  34   1.065  20.809  14.112
  235    HB2  ASN  34           HB1      ASN  34  -0.316  22.765  13.976
  236    HB3  ASN  34           HB2      ASN  34  -0.715  21.743  12.599
  237   HD21  ASN  34          HD21      ASN  34  -2.734  20.908  12.408
  238   HD22  ASN  34          HD22      ASN  34  -4.033  21.284  13.484
  239    H    GLY  35           HN       GLY  35   1.690  21.204  16.134
  240    HA2  GLY  35           HA1      GLY  35   1.403  21.761  18.400
  241    HA3  GLY  35           HA2      GLY  35  -0.276  21.256  18.289
  242    H    PHE  36           HN       PHE  36  -0.426  18.779  17.699
  243    HA   PHE  36           HA       PHE  36   0.965  17.418  19.849
  244    HB2  PHE  36           HB1      PHE  36  -1.501  17.137  19.402
  245    HB3  PHE  36           HB2      PHE  36  -1.068  16.268  17.932
  246    HD1  PHE  36           HD1      PHE  36   0.099  16.203  21.480
  247    HD2  PHE  36           HD2      PHE  36  -1.352  14.009  18.133
  248    HE1  PHE  36           HE1      PHE  36   0.281  14.117  22.772
  249    HE2  PHE  36           HE2      PHE  36  -1.174  11.920  19.421
  250    HZ   PHE  36           HZ       PHE  36  -0.357  11.972  21.743
  251    H    TRP  37           HN       TRP  37   3.080  17.232  19.117
  252    HA   TRP  37           HA       TRP  37   3.567  15.847  16.597
  253    HB2  TRP  37           HB1      TRP  37   5.893  16.423  16.916
  254    HB3  TRP  37           HB2      TRP  37   4.910  17.853  17.218
  255    HD1  TRP  37           HD1      TRP  37   4.938  18.868  19.655
  256    HE1  TRP  37           HE1      TRP  37   6.404  18.429  21.724
  257    HE3  TRP  37           HE3      TRP  37   7.149  14.504  18.170
  258    HZ2  TRP  37           HZ2      TRP  37   8.254  16.489  22.609
  259    HZ3  TRP  37           HZ3      TRP  37   8.755  13.421  19.686
  260    HH2  TRP  37           HH2      TRP  37   9.296  14.394  21.859
  Start of MODEL    4
    1    H1   LYS   1           HN       LYS   1   2.374  -3.673   7.596
    2    HA   LYS   1           HA       LYS   1  -0.257  -3.328   6.402
    3    HB2  LYS   1           HB1      LYS   1   0.642  -1.775   8.836
    4    HB3  LYS   1           HB2      LYS   1  -0.766  -1.379   7.860
    5    HG2  LYS   1           HG1      LYS   1  -0.356  -3.917   9.429
    6    HG3  LYS   1           HG2      LYS   1  -1.406  -2.570   9.875
    7    HD2  LYS   1           HD1      LYS   1  -2.458  -3.011   7.514
    8    HD3  LYS   1           HD2      LYS   1  -1.738  -4.610   7.720
    9    HE2  LYS   1           HE1      LYS   1  -3.867  -4.883   8.600
   10    HE3  LYS   1           HE2      LYS   1  -2.888  -4.574  10.033
   11    HZ1  LYS   1           HZ1      LYS   1  -4.213  -2.882  10.497
   12    HZ2  LYS   1           HZ2      LYS   1  -5.102  -3.129   9.080
   13    HZ3  LYS   1           HZ3      LYS   1  -3.751  -2.111   9.063
   14    H    TYR   2           HN       TYR   2   0.135  -2.323   4.551
   15    HA   TYR   2           HA       TYR   2   1.094  -1.000   2.964
   16    HB2  TYR   2           HB1      TYR   2   1.215   0.803   5.381
   17    HB3  TYR   2           HB2      TYR   2   1.653   1.345   3.765
   18    HD1  TYR   2           HD2      TYR   2  -0.126   1.153   1.931
   19    HD2  TYR   2           HD1      TYR   2  -1.017   0.832   6.079
   20    HE1  TYR   2           HE2      TYR   2  -2.486   1.657   1.457
   21    HE2  TYR   2           HE1      TYR   2  -3.380   1.333   5.616
   22    HH   TYR   2           HH       TYR   2  -4.506   1.986   2.309
   23    H    TYR   3           HN       TYR   3   2.837  -2.858   4.376
   24    HA   TYR   3           HA       TYR   3   5.372  -1.509   4.696
   25    HB2  TYR   3           HB1      TYR   3   4.764  -3.447   6.106
   26    HB3  TYR   3           HB2      TYR   3   4.740  -4.469   4.673
   27    HD1  TYR   3           HD2      TYR   3   7.101  -1.968   6.155
   28    HD2  TYR   3           HD1      TYR   3   6.571  -5.845   4.485
   29    HE1  TYR   3           HE2      TYR   3   9.503  -2.412   6.438
   30    HE2  TYR   3           HE1      TYR   3   8.971  -6.301   4.765
   31    HH   TYR   3           HH       TYR   3  11.219  -4.183   5.089
   32    H    GLY   4           HN       GLY   4   5.077  -0.675   2.384
   33    HA2  GLY   4           HA1      GLY   4   5.393  -2.380   0.167
   34    HA3  GLY   4           HA2      GLY   4   5.781  -0.666   0.200
   35    H    ASN   5           HN       ASN   5   7.021  -3.784  -0.033
   36    HA   ASN   5           HA       ASN   5   9.608  -3.367   1.071
   37    HB2  ASN   5           HB1      ASN   5  10.220  -5.435  -0.076
   38    HB3  ASN   5           HB2      ASN   5   8.656  -5.616   0.715
   39   HD21  ASN   5          HD21      ASN   5   6.816  -5.841  -0.516
   40   HD22  ASN   5          HD22      ASN   5   6.861  -6.153  -2.215
   41    H    GLY   6           HN       GLY   6   8.259  -3.081  -2.190
   42    HA2  GLY   6           HA1      GLY   6   9.069  -2.074  -4.086
   43    HA3  GLY   6           HA2      GLY   6   9.979  -1.038  -2.997
   44    H    VAL   7           HN       VAL   7  10.041  -4.099  -4.745
   45    HA   VAL   7           HA       VAL   7  12.730  -4.756  -4.150
   46    HB   VAL   7           HB       VAL   7  12.582  -6.279  -6.104
   47   HG11  VAL   7          HG11      VAL   7  11.727  -6.863  -3.822
   48   HG12  VAL   7          HG12      VAL   7  10.111  -6.436  -4.388
   49   HG13  VAL   7          HG13      VAL   7  10.988  -7.767  -5.143
   50   HG21  VAL   7          HG21      VAL   7  11.275  -5.461  -7.756
   51   HG22  VAL   7          HG22      VAL   7  10.014  -6.353  -6.905
   52   HG23  VAL   7          HG23      VAL   7  10.201  -4.620  -6.638
   53    H    HIS   8           HN       HIS   8  11.214  -2.962  -6.790
   54    HA   HIS   8           HA       HIS   8  13.621  -2.631  -8.286
   55    HB2  HIS   8           HB1      HIS   8  11.074  -1.003  -8.413
   56    HB3  HIS   8           HB2      HIS   8  12.338  -1.059  -9.637
   57    HD1  HIS   8           HD1      HIS   8  12.716  -3.634 -10.621
   58    HD2  HIS   8           HD2      HIS   8   9.040  -2.703  -8.924
   59    HE1  HIS   8           HE1      HIS   8  11.117  -5.370 -11.488
   60    H    LEU   9           HN       LEU   9  12.013  -0.834  -5.754
   61    HA   LEU   9           HA       LEU   9  13.370   1.612  -6.031
   62    HB2  LEU   9           HB1      LEU   9  11.498   1.673  -4.659
   63    HB3  LEU   9           HB2      LEU   9  11.986   0.233  -3.767
   64    HG   LEU   9           HG       LEU   9  13.689   2.651  -3.502
   65   HD11  LEU   9          HD11      LEU   9  11.578   3.710  -3.298
   66   HD12  LEU   9          HD12      LEU   9  12.174   3.443  -1.660
   67   HD13  LEU   9          HD13      LEU   9  10.931   2.386  -2.328
   68   HD21  LEU   9          HD21      LEU   9  14.555   1.262  -1.995
   69   HD22  LEU   9          HD22      LEU   9  13.193   0.150  -2.135
   70   HD23  LEU   9          HD23      LEU   9  13.100   1.525  -1.033
   71    H    THR  10           HN       THR  10  14.383  -1.445  -4.818
   72    HA   THR  10           HA       THR  10  16.482  -0.566  -3.124
   73    HB   THR  10           HB       THR  10  16.461  -3.193  -4.601
   74    HG1  THR  10           HG1      THR  10  14.674  -3.638  -3.574
   75   HG21  THR  10          HG21      THR  10  17.859  -3.970  -2.944
   76   HG22  THR  10          HG22      THR  10  17.280  -2.800  -1.758
   77   HG23  THR  10          HG23      THR  10  18.376  -2.288  -3.042
   78    H    LYS  11           HN       LYS  11  16.671  -2.078  -6.353
   79    HA   LYS  11           HA       LYS  11  19.386  -1.338  -6.740
   80    HB2  LYS  11           HB1      LYS  11  17.235  -2.438  -8.522
   81    HB3  LYS  11           HB2      LYS  11  18.774  -1.922  -9.199
   82    HG2  LYS  11           HG1      LYS  11  19.966  -3.526  -7.889
   83    HG3  LYS  11           HG2      LYS  11  18.507  -3.945  -6.987
   84    HD2  LYS  11           HD1      LYS  11  18.620  -5.667  -8.521
   85    HD3  LYS  11           HD2      LYS  11  17.554  -4.526  -9.345
   86    HE2  LYS  11           HE1      LYS  11  19.421  -3.691 -10.653
   87    HE3  LYS  11           HE2      LYS  11  20.530  -4.753  -9.786
   88    HZ1  LYS  11           HZ1      LYS  11  19.799  -6.580 -10.896
   89    HZ2  LYS  11           HZ2      LYS  11  19.521  -5.423 -12.098
   90    HZ3  LYS  11           HZ3      LYS  11  18.239  -5.972 -11.139
   91    H    SER  12           HN       SER  12  16.342   0.202  -7.403
   92    HA   SER  12           HA       SER  12  17.195   2.050  -9.350
   93    HB2  SER  12           HB1      SER  12  14.833   1.672  -8.977
   94    HB3  SER  12           HB2      SER  12  14.966   2.229  -7.309
   95    HG   SER  12           HG       SER  12  14.154   3.852  -8.717
   96    H    GLY  13           HN       GLY  13  17.627   1.915  -5.920
   97    HA2  GLY  13           HA1      GLY  13  19.680   3.531  -5.527
   98    HA3  GLY  13           HA2      GLY  13  18.413   4.725  -5.767
   99    H    LEU  14           HN       LEU  14  18.805   1.686  -3.936
  100    HA   LEU  14           HA       LEU  14  17.021   2.290  -1.897
  101    HB2  LEU  14           HB1      LEU  14  17.898   0.479  -0.737
  102    HB3  LEU  14           HB2      LEU  14  18.218   0.094  -2.427
  103    HG   LEU  14           HG       LEU  14  20.267   1.257  -0.545
  104   HD11  LEU  14          HD11      LEU  14  19.337  -1.086  -0.007
  105   HD12  LEU  14          HD12      LEU  14  21.084  -0.871  -0.112
  106   HD13  LEU  14          HD13      LEU  14  20.202  -1.593  -1.458
  107   HD21  LEU  14          HD21      LEU  14  20.226   0.465  -3.395
  108   HD22  LEU  14          HD22      LEU  14  21.659   0.027  -2.465
  109   HD23  LEU  14          HD23      LEU  14  21.161   1.716  -2.576
  110    H    SER  15           HN       SER  15  20.244   3.429  -2.442
  111    HA   SER  15           HA       SER  15  20.785   4.291   0.219
  112    HB2  SER  15           HB1      SER  15  21.981   5.152  -2.425
  113    HB3  SER  15           HB2      SER  15  22.607   5.620  -0.845
  114    HG   SER  15           HG       SER  15  23.402   3.671  -0.567
  115    H    VAL  16           HN       VAL  16  19.892   6.092  -2.728
  116    HA   VAL  16           HA       VAL  16  19.482   8.548  -1.359
  117    HB   VAL  16           HB       VAL  16  19.981   8.372  -3.796
  118   HG11  VAL  16          HG11      VAL  16  18.536   6.506  -4.355
  119   HG12  VAL  16          HG12      VAL  16  17.108   7.467  -3.964
  120   HG13  VAL  16          HG13      VAL  16  18.122   7.910  -5.338
  121   HG21  VAL  16          HG21      VAL  16  18.166  10.119  -2.465
  122   HG22  VAL  16          HG22      VAL  16  19.258  10.473  -3.804
  123   HG23  VAL  16          HG23      VAL  16  17.622   9.899  -4.128
  124    H    ASN  17           HN       ASN  17  17.499   5.773  -1.956
  125    HA   ASN  17           HA       ASN  17  14.970   7.027  -1.608
  126    HB2  ASN  17           HB1      ASN  17  15.954   4.197  -1.600
  127    HB3  ASN  17           HB2      ASN  17  14.325   4.547  -1.027
  128   HD21  ASN  17          HD21      ASN  17  13.120   6.104  -2.566
  129   HD22  ASN  17          HD22      ASN  17  13.199   5.684  -4.240
  130    H    TRP  18           HN       TRP  18  17.269   5.485   0.565
  131    HA   TRP  18           HA       TRP  18  15.626   5.360   2.845
  132    HB2  TRP  18           HB1      TRP  18  18.586   5.361   2.385
  133    HB3  TRP  18           HB2      TRP  18  17.968   5.510   4.028
  134    HD1  TRP  18           HD1      TRP  18  15.538   3.455   3.800
  135    HE1  TRP  18           HE1      TRP  18  16.034   0.933   3.655
  136    HE3  TRP  18           HE3      TRP  18  20.373   3.672   2.154
  137    HZ2  TRP  18           HZ2      TRP  18  18.190  -0.742   2.938
  138    HZ3  TRP  18           HZ3      TRP  18  21.582   1.565   1.764
  139    HH2  TRP  18           HH2      TRP  18  20.511  -0.595   2.148
  140    H    GLY  19           HN       GLY  19  18.026   7.810   1.863
  141    HA2  GLY  19           HA1      GLY  19  17.603   9.546   4.035
  142    HA3  GLY  19           HA2      GLY  19  18.284  10.005   2.481
  143    H    GLU  20           HN       GLU  20  16.010   9.322   0.893
  144    HA   GLU  20           HA       GLU  20  14.540  11.735   1.135
  145    HB2  GLU  20           HB1      GLU  20  14.419   9.333  -0.627
  146    HB3  GLU  20           HB2      GLU  20  13.019  10.395  -0.581
  147    HG2  GLU  20           HG1      GLU  20  14.260  12.231  -1.383
  148    HG3  GLU  20           HG2      GLU  20  15.794  11.405  -1.115
  149    H    ALA  21           HN       ALA  21  13.846   8.375   1.963
  150    HA   ALA  21           HA       ALA  21  11.129   8.768   2.660
  151    HB1  ALA  21           HB1      ALA  21  12.571   6.634   4.076
  152    HB2  ALA  21           HB2      ALA  21  11.110   6.561   3.091
  153    HB3  ALA  21           HB3      ALA  21  12.694   6.586   2.318
  154    H    PHE  22           HN       PHE  22  14.138   9.159   4.395
  155    HA   PHE  22           HA       PHE  22  13.045   9.256   7.007
  156    HB2  PHE  22           HB1      PHE  22  15.526   9.005   6.206
  157    HB3  PHE  22           HB2      PHE  22  15.523  10.765   6.254
  158    HD1  PHE  22           HD2      PHE  22  14.477  11.750   8.508
  159    HD2  PHE  22           HD1      PHE  22  16.249   7.904   8.076
  160    HE1  PHE  22           HE2      PHE  22  14.918  11.685  10.928
  161    HE2  PHE  22           HE1      PHE  22  16.693   7.833  10.495
  162    HZ   PHE  22           HZ       PHE  22  16.028   9.725  11.924
  163    H    SER  23           HN       SER  23  13.966  11.805   4.706
  164    HA   SER  23           HA       SER  23  13.360  14.023   6.247
  165    HB2  SER  23           HB1      SER  23  12.701  14.013   3.321
  166    HB3  SER  23           HB2      SER  23  13.471  15.272   4.286
  167    HG   SER  23           HG       SER  23  15.350  14.379   3.944
  168    H    ALA  24           HN       ALA  24  11.222  12.042   4.249
  169    HA   ALA  24           HA       ALA  24   8.914  13.611   4.426
  170    HB1  ALA  24           HB1      ALA  24   9.608  11.021   3.462
  171    HB2  ALA  24           HB2      ALA  24   8.126  10.897   4.412
  172    HB3  ALA  24           HB3      ALA  24   8.211  12.018   3.053
  173    H    GLY  25           HN       GLY  25  10.242  11.190   6.622
  174    HA2  GLY  25           HA1      GLY  25   8.011  10.934   8.318
  175    HA3  GLY  25           HA2      GLY  25   9.678  10.604   8.768
  176    H    VAL  26           HN       VAL  26  10.690  13.233   8.327
  177    HA   VAL  26           HA       VAL  26  10.174  14.391  10.837
  178    HB   VAL  26           HB       VAL  26  11.395  15.710   8.408
  179   HG11  VAL  26          HG11      VAL  26  11.211  17.524   9.727
  180   HG12  VAL  26          HG12      VAL  26  10.973  16.565  11.189
  181   HG13  VAL  26          HG13      VAL  26  12.600  16.826  10.559
  182   HG21  VAL  26          HG21      VAL  26  12.607  13.702   8.924
  183   HG22  VAL  26          HG22      VAL  26  13.552  15.083   9.481
  184   HG23  VAL  26          HG23      VAL  26  12.644  14.111  10.639
  185    H    HIS  27           HN       HIS  27   8.890  15.053   7.626
  186    HA   HIS  27           HA       HIS  27   7.570  17.465   8.231
  187    HB2  HIS  27           HB1      HIS  27   7.955  16.758   5.930
  188    HB3  HIS  27           HB2      HIS  27   6.907  15.361   6.160
  189    HD1  HIS  27           HD1      HIS  27   6.583  19.149   6.422
  190    HD2  HIS  27           HD2      HIS  27   4.400  15.808   5.269
  191    HE1  HIS  27           HE1      HIS  27   4.398  20.041   5.554
  192    H    ARG  28           HN       ARG  28   6.509  14.091   8.380
  193    HA   ARG  28           HA       ARG  28   3.824  14.629   9.069
  194    HB2  ARG  28           HB1      ARG  28   4.859  12.431   8.239
  195    HB3  ARG  28           HB2      ARG  28   5.336  12.165   9.910
  196    HG2  ARG  28           HG1      ARG  28   2.489  12.741   9.182
  197    HG3  ARG  28           HG2      ARG  28   3.156  11.110   9.086
  198    HD2  ARG  28           HD1      ARG  28   3.981  11.709  11.532
  199    HD3  ARG  28           HD2      ARG  28   2.604  12.808  11.461
  200    HE   ARG  28           HE       ARG  28   1.613  10.407  10.617
  201   HH11  ARG  28          HH11      ARG  28   3.285  11.524  13.459
  202   HH12  ARG  28          HH12      ARG  28   2.533  10.373  14.513
  203   HH21  ARG  28          HH21      ARG  28   0.617   8.886  11.994
  204   HH22  ARG  28          HH22      ARG  28   1.017   8.872  13.678
  205    H    LEU  29           HN       LEU  29   6.718  14.036  11.018
  206    HA   LEU  29           HA       LEU  29   5.422  14.005  13.526
  207    HB2  LEU  29           HB1      LEU  29   8.223  14.360  12.585
  208    HB3  LEU  29           HB2      LEU  29   7.838  14.777  14.254
  209    HG   LEU  29           HG       LEU  29   7.201  12.076  13.098
  210   HD11  LEU  29          HD11      LEU  29   9.517  12.103  14.806
  211   HD12  LEU  29          HD12      LEU  29   9.774  13.115  13.386
  212   HD13  LEU  29          HD13      LEU  29   9.319  11.423  13.191
  213   HD21  LEU  29          HD21      LEU  29   7.606  11.612  15.650
  214   HD22  LEU  29          HD22      LEU  29   6.059  12.238  15.079
  215   HD23  LEU  29          HD23      LEU  29   7.242  13.331  15.800
  216    H    ALA  30           HN       ALA  30   6.959  16.597  11.667
  217    HA   ALA  30           HA       ALA  30   6.756  18.629  13.582
  218    HB1  ALA  30           HB1      ALA  30   8.081  18.713  11.461
  219    HB2  ALA  30           HB2      ALA  30   6.570  19.011  10.601
  220    HB3  ALA  30           HB3      ALA  30   7.142  20.167  11.804
  221    H    ASN  31           HN       ASN  31   4.532  17.749  10.945
  222    HA   ASN  31           HA       ASN  31   2.559  19.660  11.843
  223    HB2  ASN  31           HB1      ASN  31   3.025  18.938   9.407
  224    HB3  ASN  31           HB2      ASN  31   2.081  17.504   9.798
  225   HD21  ASN  31          HD21      ASN  31   0.010  17.621   9.361
  226   HD22  ASN  31          HD22      ASN  31  -0.930  19.066   9.247
  227    H    GLY  32           HN       GLY  32   2.597  18.546  14.037
  228    HA2  GLY  32           HA1      GLY  32   0.174  17.146  14.392
  229    HA3  GLY  32           HA2      GLY  32   1.509  16.004  14.458
  230    H    GLY  33           HN       GLY  33   3.326  16.652  15.975
  231    HA2  GLY  33           HA1      GLY  33   2.170  17.129  18.561
  232    HA3  GLY  33           HA2      GLY  33   3.865  16.816  18.217
  233    H    ASN  34           HN       ASN  34   3.831  19.067  16.213
  234    HA   ASN  34           HA       ASN  34   4.422  21.165  18.140
  235    HB2  ASN  34           HB1      ASN  34   5.832  20.415  16.030
  236    HB3  ASN  34           HB2      ASN  34   4.765  21.541  15.195
  237   HD21  ASN  34          HD21      ASN  34   6.445  22.945  14.729
  238   HD22  ASN  34          HD22      ASN  34   7.180  23.938  15.937
  239    H    GLY  35           HN       GLY  35   2.541  20.848  15.123
  240    HA2  GLY  35           HA1      GLY  35   0.623  22.785  16.217
  241    HA3  GLY  35           HA2      GLY  35   1.332  23.099  14.640
  242    H    PHE  36           HN       PHE  36  -0.899  21.142  16.452
  243    HA   PHE  36           HA       PHE  36  -1.644  19.565  14.131
  244    HB2  PHE  36           HB1      PHE  36  -3.294  18.530  15.691
  245    HB3  PHE  36           HB2      PHE  36  -1.631  18.425  16.260
  246    HD1  PHE  36           HD1      PHE  36  -4.818  20.244  16.683
  247    HD2  PHE  36           HD2      PHE  36  -0.984  19.373  18.312
  248    HE1  PHE  36           HE1      PHE  36  -5.485  21.295  18.805
  249    HE2  PHE  36           HE2      PHE  36  -1.645  20.422  20.437
  250    HZ   PHE  36           HZ       PHE  36  -3.898  21.384  20.686
  251    H    TRP  37           HN       TRP  37  -3.736  19.562  13.206
  252    HA   TRP  37           HA       TRP  37  -4.941  22.198  13.131
  253    HB2  TRP  37           HB1      TRP  37  -5.426  19.673  11.545
  254    HB3  TRP  37           HB2      TRP  37  -6.371  21.143  11.326
  255    HD1  TRP  37           HD1      TRP  37  -2.619  20.126  11.214
  256    HE1  TRP  37           HE1      TRP  37  -1.493  21.484   9.340
  257    HE3  TRP  37           HE3      TRP  37  -6.616  22.957   9.749
  258    HZ2  TRP  37           HZ2      TRP  37  -2.205  23.491   7.487
  259    HZ3  TRP  37           HZ3      TRP  37  -6.310  24.573   7.919
  260    HH2  TRP  37           HH2      TRP  37  -4.149  24.833   6.813
  Start of MODEL    5
    1    H1   LYS   1           HN       LYS   1   7.596  -2.506   6.288
    2    HA   LYS   1           HA       LYS   1   5.009  -3.413   6.114
    3    HB2  LYS   1           HB1      LYS   1   5.717  -1.213   7.040
    4    HB3  LYS   1           HB2      LYS   1   5.937  -0.627   5.397
    5    HG2  LYS   1           HG1      LYS   1   3.850   0.176   5.880
    6    HG3  LYS   1           HG2      LYS   1   3.448  -1.360   5.110
    7    HD2  LYS   1           HD1      LYS   1   2.992  -2.394   7.178
    8    HD3  LYS   1           HD2      LYS   1   3.776  -1.101   8.088
    9    HE2  LYS   1           HE1      LYS   1   2.014   0.443   7.461
   10    HE3  LYS   1           HE2      LYS   1   1.257  -0.792   6.456
   11    HZ1  LYS   1           HZ1      LYS   1   1.108  -0.401   9.300
   12    HZ2  LYS   1           HZ2      LYS   1   1.447  -2.000   8.868
   13    HZ3  LYS   1           HZ3      LYS   1   0.061  -1.239   8.268
   14    H    TYR   2           HN       TYR   2   7.169  -2.572   3.540
   15    HA   TYR   2           HA       TYR   2   5.077  -2.420   1.545
   16    HB2  TYR   2           HB1      TYR   2   8.092  -2.366   1.335
   17    HB3  TYR   2           HB2      TYR   2   7.012  -2.228  -0.048
   18    HD1  TYR   2           HD2      TYR   2   5.504  -0.248  -0.236
   19    HD2  TYR   2           HD1      TYR   2   8.521  -0.507   2.753
   20    HE1  TYR   2           HE2      TYR   2   5.353   2.181   0.119
   21    HE2  TYR   2           HE1      TYR   2   8.377   1.921   3.116
   22    HH   TYR   2           HH       TYR   2   5.872   3.790   2.078
   23    H    TYR   3           HN       TYR   3   4.081  -4.404   1.470
   24    HA   TYR   3           HA       TYR   3   5.668  -6.812   1.131
   25    HB2  TYR   3           HB1      TYR   3   3.526  -7.991   1.207
   26    HB3  TYR   3           HB2      TYR   3   3.666  -6.871   2.558
   27    HD1  TYR   3           HD2      TYR   3   2.019  -7.468  -0.686
   28    HD2  TYR   3           HD1      TYR   3   2.164  -5.026   2.795
   29    HE1  TYR   3           HE2      TYR   3  -0.126  -6.446  -1.321
   30    HE2  TYR   3           HE1      TYR   3   0.019  -3.998   2.170
   31    HH   TYR   3           HH       TYR   3  -1.279  -3.634  -0.023
   32    H    GLY   4           HN       GLY   4   3.822  -4.578  -0.788
   33    HA2  GLY   4           HA1      GLY   4   3.453  -6.256  -3.058
   34    HA3  GLY   4           HA2      GLY   4   3.325  -4.503  -3.033
   35    H    ASN   5           HN       ASN   5   4.593  -3.680  -4.553
   36    HA   ASN   5           HA       ASN   5   6.946  -5.031  -5.480
   37    HB2  ASN   5           HB1      ASN   5   7.212  -2.981  -6.912
   38    HB3  ASN   5           HB2      ASN   5   5.664  -3.801  -7.093
   39   HD21  ASN   5          HD21      ASN   5   7.116  -0.873  -6.729
   40   HD22  ASN   5          HD22      ASN   5   5.773   0.042  -6.143
   41    H    GLY   6           HN       GLY   6   7.821  -4.996  -3.168
   42    HA2  GLY   6           HA1      GLY   6   9.299  -2.483  -2.695
   43    HA3  GLY   6           HA2      GLY   6   8.851  -3.622  -1.433
   44    H    VAL   7           HN       VAL   7   9.615  -5.833  -3.412
   45    HA   VAL   7           HA       VAL   7  12.230  -6.259  -2.413
   46    HB   VAL   7           HB       VAL   7  12.303  -8.179  -3.983
   47   HG11  VAL   7          HG11      VAL   7   9.632  -8.570  -2.915
   48   HG12  VAL   7          HG12      VAL   7  11.148  -9.368  -2.490
   49   HG13  VAL   7          HG13      VAL   7  10.721  -7.828  -1.743
   50   HG21  VAL   7          HG21      VAL   7  11.173  -7.787  -5.900
   51   HG22  VAL   7          HG22      VAL   7   9.835  -8.508  -5.006
   52   HG23  VAL   7          HG23      VAL   7   9.980  -6.754  -5.114
   53    H    HIS   8           HN       HIS   8  10.991  -5.141  -5.528
   54    HA   HIS   8           HA       HIS   8  13.542  -5.074  -6.805
   55    HB2  HIS   8           HB1      HIS   8  10.869  -3.852  -7.482
   56    HB3  HIS   8           HB2      HIS   8  12.296  -3.618  -8.487
   57    HD1  HIS   8           HD1      HIS   8   9.424  -5.625  -8.384
   58    HD2  HIS   8           HD2      HIS   8  13.442  -6.421  -9.083
   59    HE1  HIS   8           HE1      HIS   8   9.472  -7.819  -9.614
   60    H    LEU   9           HN       LEU   9  11.677  -2.828  -4.890
   61    HA   LEU   9           HA       LEU   9  13.013  -0.452  -5.572
   62    HB2  LEU   9           HB1      LEU   9  11.021  -0.168  -4.413
   63    HB3  LEU   9           HB2      LEU   9  11.451  -1.361  -3.189
   64    HG   LEU   9           HG       LEU   9  13.077   1.120  -3.314
   65   HD11  LEU   9          HD11      LEU   9  11.204   2.378  -3.317
   66   HD12  LEU   9          HD12      LEU   9  11.168   1.929  -1.612
   67   HD13  LEU   9          HD13      LEU   9  10.177   1.051  -2.776
   68   HD21  LEU   9          HD21      LEU   9  13.827   0.120  -1.474
   69   HD22  LEU   9          HD22      LEU   9  12.501  -1.043  -1.481
   70   HD23  LEU   9          HD23      LEU   9  12.288   0.534  -0.719
   71    H    THR  10           HN       THR  10  13.961  -3.139  -3.643
   72    HA   THR  10           HA       THR  10  15.879  -1.842  -2.003
   73    HB   THR  10           HB       THR  10  15.969  -4.729  -2.882
   74    HG1  THR  10           HG1      THR  10  14.643  -3.771  -0.566
   75   HG21  THR  10          HG21      THR  10  17.466  -5.066  -1.227
   76   HG22  THR  10          HG22      THR  10  16.665  -3.937  -0.135
   77   HG23  THR  10          HG23      THR  10  17.753  -3.334  -1.384
   78    H    LYS  11           HN       LYS  11  16.392  -4.002  -4.800
   79    HA   LYS  11           HA       LYS  11  19.118  -3.261  -5.100
   80    HB2  LYS  11           HB1      LYS  11  17.182  -4.720  -6.894
   81    HB3  LYS  11           HB2      LYS  11  18.855  -4.428  -7.350
   82    HG2  LYS  11           HG1      LYS  11  19.387  -5.555  -5.064
   83    HG3  LYS  11           HG2      LYS  11  17.754  -6.206  -5.225
   84    HD2  LYS  11           HD1      LYS  11  19.000  -7.854  -6.245
   85    HD3  LYS  11           HD2      LYS  11  18.562  -6.847  -7.628
   86    HE2  LYS  11           HE1      LYS  11  21.086  -6.260  -6.155
   87    HE3  LYS  11           HE2      LYS  11  21.042  -7.640  -7.251
   88    HZ1  LYS  11           HZ1      LYS  11  21.204  -4.866  -7.859
   89    HZ2  LYS  11           HZ2      LYS  11  19.888  -5.578  -8.646
   90    HZ3  LYS  11           HZ3      LYS  11  21.445  -6.200  -8.871
   91    H    SER  12           HN       SER  12  16.122  -2.016  -6.346
   92    HA   SER  12           HA       SER  12  17.122  -0.595  -8.564
   93    HB2  SER  12           HB1      SER  12  14.727  -1.011  -8.256
   94    HB3  SER  12           HB2      SER  12  14.721   0.012  -6.820
   95    HG   SER  12           HG       SER  12  15.681   1.100  -9.207
   96    H    GLY  13           HN       GLY  13  17.228   0.023  -5.162
   97    HA2  GLY  13           HA1      GLY  13  19.205   1.763  -4.948
   98    HA3  GLY  13           HA2      GLY  13  17.944   2.829  -5.550
   99    H    LEU  14           HN       LEU  14  18.225   0.270  -3.079
  100    HA   LEU  14           HA       LEU  14  16.244   1.221  -1.382
  101    HB2  LEU  14           HB1      LEU  14  17.048  -0.262   0.216
  102    HB3  LEU  14           HB2      LEU  14  17.531  -0.987  -1.316
  103    HG   LEU  14           HG       LEU  14  19.373   0.635   0.436
  104   HD11  LEU  14          HD11      LEU  14  18.470  -1.543   1.425
  105   HD12  LEU  14          HD12      LEU  14  20.220  -1.339   1.353
  106   HD13  LEU  14          HD13      LEU  14  19.400  -2.352   0.164
  107   HD21  LEU  14          HD21      LEU  14  19.612  -0.754  -2.166
  108   HD22  LEU  14          HD22      LEU  14  20.963  -0.920  -1.044
  109   HD23  LEU  14          HD23      LEU  14  20.439   0.683  -1.563
  110    H    SER  15           HN       SER  15  19.480   2.349  -1.877
  111    HA   SER  15           HA       SER  15  19.748   3.781   0.571
  112    HB2  SER  15           HB1      SER  15  21.774   3.274  -0.538
  113    HB3  SER  15           HB2      SER  15  21.186   3.904  -2.077
  114    HG   SER  15           HG       SER  15  22.653   5.324  -0.968
  115    H    VAL  16           HN       VAL  16  18.991   4.811  -2.754
  116    HA   VAL  16           HA       VAL  16  18.473   7.513  -2.046
  117    HB   VAL  16           HB       VAL  16  19.077   6.854  -4.336
  118   HG11  VAL  16          HG11      VAL  16  16.392   5.495  -4.283
  119   HG12  VAL  16          HG12      VAL  16  17.251   5.881  -5.775
  120   HG13  VAL  16          HG13      VAL  16  17.969   4.774  -4.604
  121   HG21  VAL  16          HG21      VAL  16  17.440   8.842  -3.610
  122   HG22  VAL  16          HG22      VAL  16  17.928   8.565  -5.282
  123   HG23  VAL  16          HG23      VAL  16  16.367   7.977  -4.711
  124    H    ASN  17           HN       ASN  17  16.574   4.617  -2.016
  125    HA   ASN  17           HA       ASN  17  14.000   5.776  -2.119
  126    HB2  ASN  17           HB1      ASN  17  14.066   3.461  -2.505
  127    HB3  ASN  17           HB2      ASN  17  15.065   3.160  -1.086
  128   HD21  ASN  17          HD21      ASN  17  14.028   2.187   0.480
  129   HD22  ASN  17          HD22      ASN  17  12.354   2.367   0.868
  130    H    TRP  18           HN       TRP  18  15.870   4.592   0.680
  131    HA   TRP  18           HA       TRP  18  14.076   5.642   2.604
  132    HB2  TRP  18           HB1      TRP  18  15.946   3.808   2.811
  133    HB3  TRP  18           HB2      TRP  18  16.968   5.180   3.231
  134    HD1  TRP  18           HD1      TRP  18  13.404   4.093   4.367
  135    HE1  TRP  18           HE1      TRP  18  13.323   4.244   6.936
  136    HE3  TRP  18           HE3      TRP  18  18.194   5.654   5.240
  137    HZ2  TRP  18           HZ2      TRP  18  15.060   4.934   9.051
  138    HZ3  TRP  18           HZ3      TRP  18  18.904   6.037   7.564
  139    HH2  TRP  18           HH2      TRP  18  17.368   5.685   9.429
  140    H    GLY  19           HN       GLY  19  17.128   6.831   1.246
  141    HA2  GLY  19           HA1      GLY  19  17.552   9.040   2.855
  142    HA3  GLY  19           HA2      GLY  19  18.003   8.953   1.158
  143    H    GLU  20           HN       GLU  20  15.679   8.948  -0.178
  144    HA   GLU  20           HA       GLU  20  14.873  11.644  -0.075
  145    HB2  GLU  20           HB1      GLU  20  14.632   9.583  -1.889
  146    HB3  GLU  20           HB2      GLU  20  12.971   9.835  -1.371
  147    HG2  GLU  20           HG1      GLU  20  14.489  12.269  -2.031
  148    HG3  GLU  20           HG2      GLU  20  14.142  11.183  -3.376
  149    H    ALA  21           HN       ALA  21  13.310   8.667   1.038
  150    HA   ALA  21           HA       ALA  21  10.877   9.808   1.850
  151    HB1  ALA  21           HB1      ALA  21  11.627   7.620   3.557
  152    HB2  ALA  21           HB2      ALA  21  10.381   7.694   2.311
  153    HB3  ALA  21           HB3      ALA  21  12.036   7.264   1.879
  154    H    PHE  22           HN       PHE  22  13.999   9.605   3.417
  155    HA   PHE  22           HA       PHE  22  13.144  10.276   6.031
  156    HB2  PHE  22           HB1      PHE  22  15.354   9.250   5.462
  157    HB3  PHE  22           HB2      PHE  22  15.851  10.800   4.791
  158    HD1  PHE  22           HD1      PHE  22  16.080  12.769   6.285
  159    HD2  PHE  22           HD2      PHE  22  15.389   8.847   7.788
  160    HE1  PHE  22           HE1      PHE  22  16.835  13.493   8.513
  161    HE2  PHE  22           HE2      PHE  22  16.142   9.565  10.017
  162    HZ   PHE  22           HZ       PHE  22  16.865  11.891  10.382
  163    H    SER  23           HN       SER  23  14.716  12.266   3.523
  164    HA   SER  23           HA       SER  23  14.628  14.704   4.815
  165    HB2  SER  23           HB1      SER  23  15.858  14.610   2.801
  166    HB3  SER  23           HB2      SER  23  14.482  13.987   1.891
  167    HG   SER  23           HG       SER  23  14.850  16.213   1.491
  168    H    ALA  24           HN       ALA  24  12.165  13.270   2.691
  169    HA   ALA  24           HA       ALA  24  10.327  15.358   2.724
  170    HB1  ALA  24           HB1      ALA  24  10.415  12.771   1.704
  171    HB2  ALA  24           HB2      ALA  24   9.001  12.794   2.759
  172    HB3  ALA  24           HB3      ALA  24   9.145  13.970   1.452
  173    H    GLY  25           HN       GLY  25  10.917  12.811   5.077
  174    HA2  GLY  25           HA1      GLY  25   8.576  13.259   6.629
  175    HA3  GLY  25           HA2      GLY  25  10.019  12.405   7.155
  176    H    VAL  26           HN       VAL  26  11.741  14.736   6.576
  177    HA   VAL  26           HA       VAL  26  11.770  15.903   9.114
  178    HB   VAL  26           HB       VAL  26  12.939  17.002   6.554
  179   HG11  VAL  26          HG11      VAL  26  13.251  18.813   7.859
  180   HG12  VAL  26          HG12      VAL  26  13.020  17.906   9.355
  181   HG13  VAL  26          HG13      VAL  26  14.576  17.857   8.524
  182   HG21  VAL  26          HG21      VAL  26  13.554  14.647   7.880
  183   HG22  VAL  26          HG22      VAL  26  14.571  15.491   6.712
  184   HG23  VAL  26          HG23      VAL  26  14.777  15.789   8.438
  185    H    HIS  27           HN       HIS  27  10.210  16.911   6.134
  186    HA   HIS  27           HA       HIS  27   9.543  19.536   6.899
  187    HB2  HIS  27           HB1      HIS  27   9.395  18.881   4.583
  188    HB3  HIS  27           HB2      HIS  27   8.205  17.638   4.963
  189    HD1  HIS  27           HD1      HIS  27   5.774  18.406   5.361
  190    HD2  HIS  27           HD2      HIS  27   8.393  21.493   4.430
  191    HE1  HIS  27           HE1      HIS  27   4.318  20.390   4.843
  192    H    ARG  28           HN       ARG  28   7.841  16.459   7.283
  193    HA   ARG  28           HA       ARG  28   5.469  17.553   8.372
  194    HB2  ARG  28           HB1      ARG  28   5.676  15.262   7.402
  195    HB3  ARG  28           HB2      ARG  28   6.605  14.789   8.817
  196    HG2  ARG  28           HG1      ARG  28   3.925  15.994   9.242
  197    HG3  ARG  28           HG2      ARG  28   4.018  14.337   8.641
  198    HD2  ARG  28           HD1      ARG  28   5.733  14.045  10.595
  199    HD3  ARG  28           HD2      ARG  28   4.924  15.469  11.250
  200    HE   ARG  28           HE       ARG  28   2.910  13.727  10.580
  201   HH11  ARG  28          HH11      ARG  28   5.699  13.659  12.661
  202   HH12  ARG  28          HH12      ARG  28   4.986  12.564  13.799
  203   HH21  ARG  28          HH21      ARG  28   1.960  12.284  12.070
  204   HH22  ARG  28          HH22      ARG  28   2.860  11.782  13.461
  205    H    LEU  29           HN       LEU  29   8.491  16.446   9.795
  206    HA   LEU  29           HA       LEU  29   7.637  16.537  12.495
  207    HB2  LEU  29           HB1      LEU  29  10.292  16.498  11.124
  208    HB3  LEU  29           HB2      LEU  29  10.203  16.798  12.858
  209    HG   LEU  29           HG       LEU  29   8.964  14.361  11.614
  210   HD11  LEU  29          HD11      LEU  29  11.782  14.986  11.888
  211   HD12  LEU  29          HD12      LEU  29  10.996  13.640  11.064
  212   HD13  LEU  29          HD13      LEU  29  11.323  13.545  12.794
  213   HD21  LEU  29          HD21      LEU  29   9.771  13.645  14.062
  214   HD22  LEU  29          HD22      LEU  29   8.195  14.371  13.744
  215   HD23  LEU  29          HD23      LEU  29   9.524  15.369  14.337
  216    H    ALA  30           HN       ALA  30   9.086  18.902  10.328
  217    HA   ALA  30           HA       ALA  30   9.707  20.882  12.210
  218    HB1  ALA  30           HB1      ALA  30   9.990  20.620   9.507
  219    HB2  ALA  30           HB2      ALA  30   8.777  21.896   9.629
  220    HB3  ALA  30           HB3      ALA  30  10.338  22.083  10.429
  221    H    ASN  31           HN       ASN  31   6.683  19.959  10.740
  222    HA   ASN  31           HA       ASN  31   5.315  22.334  11.706
  223    HB2  ASN  31           HB1      ASN  31   4.824  21.125   9.488
  224    HB3  ASN  31           HB2      ASN  31   3.997  19.922  10.474
  225   HD21  ASN  31          HD21      ASN  31   3.997  23.227   9.381
  226   HD22  ASN  31          HD22      ASN  31   2.359  23.576   9.807
  227    H    GLY  32           HN       GLY  32   5.489  18.877  12.408
  228    HA2  GLY  32           HA1      GLY  32   5.226  17.958  14.565
  229    HA3  GLY  32           HA2      GLY  32   4.379  19.417  15.058
  230    H    GLY  33           HN       GLY  33   3.971  16.223  14.508
  231    HA2  GLY  33           HA1      GLY  33   1.336  16.386  13.281
  232    HA3  GLY  33           HA2      GLY  33   2.182  14.917  13.743
  233    H    ASN  34           HN       ASN  34   0.342  17.659  14.989
  234    HA   ASN  34           HA       ASN  34  -0.766  15.922  17.049
  235    HB2  ASN  34           HB1      ASN  34   0.344  18.633  17.787
  236    HB3  ASN  34           HB2      ASN  34  -0.287  17.396  18.871
  237   HD21  ASN  34          HD21      ASN  34   1.024  15.790  19.561
  238   HD22  ASN  34          HD22      ASN  34   2.700  15.670  19.160
  239    H    GLY  35           HN       GLY  35  -2.789  16.598  17.840
  240    HA2  GLY  35           HA1      GLY  35  -4.145  18.487  16.056
  241    HA3  GLY  35           HA2      GLY  35  -4.925  17.292  17.081
  242    H    PHE  36           HN       PHE  36  -3.541  20.480  16.922
  243    HA   PHE  36           HA       PHE  36  -4.073  21.025  19.721
  244    HB2  PHE  36           HB1      PHE  36  -2.082  22.006  18.719
  245    HB3  PHE  36           HB2      PHE  36  -3.064  22.809  17.497
  246    HD1  PHE  36           HD1      PHE  36  -2.310  22.693  21.113
  247    HD2  PHE  36           HD2      PHE  36  -4.071  24.890  17.920
  248    HE1  PHE  36           HE1      PHE  36  -2.530  24.651  22.586
  249    HE2  PHE  36           HE2      PHE  36  -4.293  26.851  19.388
  250    HZ   PHE  36           HZ       PHE  36  -3.522  26.734  21.724
  251    H    TRP  37           HN       TRP  37  -5.985  21.662  20.440
  252    HA   TRP  37           HA       TRP  37  -8.038  22.506  18.578
  253    HB2  TRP  37           HB1      TRP  37  -8.299  20.923  20.635
  254    HB3  TRP  37           HB2      TRP  37  -8.398  22.421  21.557
  255    HD1  TRP  37           HD1      TRP  37 -10.240  24.201  19.862
  256    HE1  TRP  37           HE1      TRP  37 -12.696  23.573  19.420
  257    HE3  TRP  37           HE3      TRP  37  -9.958  19.169  20.720
  258    HZ2  TRP  37           HZ2      TRP  37 -14.302  21.252  19.434
  259    HZ3  TRP  37           HZ3      TRP  37 -11.999  17.817  20.485
  260    HH2  TRP  37           HH2      TRP  37 -14.126  18.838  19.856
  Start of MODEL    6
    1    H1   LYS   1           HN       LYS   1   8.410   5.339   2.671
    2    HA   LYS   1           HA       LYS   1   6.131   3.997   3.826
    3    HB2  LYS   1           HB1      LYS   1   5.451   6.406   3.101
    4    HB3  LYS   1           HB2      LYS   1   5.541   5.758   1.468
    5    HG2  LYS   1           HG1      LYS   1   3.294   5.563   2.078
    6    HG3  LYS   1           HG2      LYS   1   3.957   3.938   2.269
    7    HD2  LYS   1           HD1      LYS   1   2.798   4.150   4.238
    8    HD3  LYS   1           HD2      LYS   1   4.381   4.753   4.733
    9    HE2  LYS   1           HE1      LYS   1   2.690   6.246   5.559
   10    HE3  LYS   1           HE2      LYS   1   3.587   7.059   4.278
   11    HZ1  LYS   1           HZ1      LYS   1   1.809   6.635   2.752
   12    HZ2  LYS   1           HZ2      LYS   1   1.161   7.373   4.129
   13    HZ3  LYS   1           HZ3      LYS   1   0.971   5.708   3.893
   14    H    TYR   2           HN       TYR   2   6.359   2.006   3.069
   15    HA   TYR   2           HA       TYR   2   7.683   1.512   0.544
   16    HB2  TYR   2           HB1      TYR   2   7.374  -0.892   1.171
   17    HB3  TYR   2           HB2      TYR   2   8.252   0.052   2.368
   18    HD1  TYR   2           HD2      TYR   2   5.015  -1.546   1.599
   19    HD2  TYR   2           HD1      TYR   2   7.394   0.354   4.572
   20    HE1  TYR   2           HE2      TYR   2   3.424  -2.272   3.329
   21    HE2  TYR   2           HE1      TYR   2   5.810  -0.368   6.309
   22    HH   TYR   2           HH       TYR   2   2.876  -2.188   5.478
   23    H    TYR   3           HN       TYR   3   6.731  -0.082  -0.997
   24    HA   TYR   3           HA       TYR   3   4.011   0.726  -1.624
   25    HB2  TYR   3           HB1      TYR   3   6.232  -0.600  -3.120
   26    HB3  TYR   3           HB2      TYR   3   4.581  -0.822  -3.689
   27    HD1  TYR   3           HD1      TYR   3   3.278   1.675  -3.424
   28    HD2  TYR   3           HD2      TYR   3   7.350   0.941  -4.414
   29    HE1  TYR   3           HE1      TYR   3   3.381   3.844  -4.581
   30    HE2  TYR   3           HE2      TYR   3   7.465   3.108  -5.572
   31    HH   TYR   3           HH       TYR   3   5.224   5.517  -5.192
   32    H    GLY   4           HN       GLY   4   5.786  -2.366  -1.405
   33    HA2  GLY   4           HA1      GLY   4   3.397  -3.591  -0.240
   34    HA3  GLY   4           HA2      GLY   4   4.015  -4.282  -1.733
   35    H    ASN   5           HN       ASN   5   6.149  -5.208  -1.725
   36    HA   ASN   5           HA       ASN   5   6.647  -6.749   0.607
   37    HB2  ASN   5           HB1      ASN   5   8.098  -6.394  -2.006
   38    HB3  ASN   5           HB2      ASN   5   8.779  -7.376  -0.712
   39   HD21  ASN   5          HD21      ASN   5   7.910  -9.349  -0.260
   40   HD22  ASN   5          HD22      ASN   5   6.685 -10.093  -1.225
   41    H    GLY   6           HN       GLY   6   8.872  -4.518  -1.075
   42    HA2  GLY   6           HA1      GLY   6   9.940  -2.682   0.059
   43    HA3  GLY   6           HA2      GLY   6   9.775  -3.572   1.564
   44    H    VAL   7           HN       VAL   7  10.658  -6.047  -0.005
   45    HA   VAL   7           HA       VAL   7  13.386  -5.938   0.737
   46    HB   VAL   7           HB       VAL   7  12.188  -8.052   0.718
   47   HG11  VAL   7          HG11      VAL   7  10.753  -7.517  -1.245
   48   HG12  VAL   7          HG12      VAL   7  12.138  -7.844  -2.289
   49   HG13  VAL   7          HG13      VAL   7  11.458  -9.132  -1.294
   50   HG21  VAL   7          HG21      VAL   7  14.690  -7.896   0.271
   51   HG22  VAL   7          HG22      VAL   7  13.896  -9.411  -0.160
   52   HG23  VAL   7          HG23      VAL   7  14.298  -8.238  -1.414
   53    H    HIS   8           HN       HIS   8  11.723  -5.649  -2.366
   54    HA   HIS   8           HA       HIS   8  14.111  -5.554  -3.926
   55    HB2  HIS   8           HB1      HIS   8  11.636  -6.085  -4.629
   56    HB3  HIS   8           HB2      HIS   8  11.535  -4.342  -4.858
   57    HD1  HIS   8           HD1      HIS   8  11.140  -5.125  -7.423
   58    HD2  HIS   8           HD2      HIS   8  14.963  -5.640  -5.881
   59    HE1  HIS   8           HE1      HIS   8  12.637  -5.422  -9.422
   60    H    LEU   9           HN       LEU   9  12.112  -3.181  -2.311
   61    HA   LEU   9           HA       LEU   9  13.069  -0.869  -3.589
   62    HB2  LEU   9           HB1      LEU   9  11.151  -0.562  -2.324
   63    HB3  LEU   9           HB2      LEU   9  11.809  -1.426  -0.937
   64    HG   LEU   9           HG       LEU   9  13.101   1.138  -1.694
   65   HD11  LEU   9          HD11      LEU   9  11.382   2.488  -1.267
   66   HD12  LEU   9          HD12      LEU   9  10.864   1.527   0.118
   67   HD13  LEU   9          HD13      LEU   9  10.353   1.076  -1.509
   68   HD21  LEU   9          HD21      LEU   9  14.093   0.648   0.234
   69   HD22  LEU   9          HD22      LEU   9  12.955  -0.660   0.558
   70   HD23  LEU   9          HD23      LEU   9  12.559   0.992   1.033
   71    H    THR  10           HN       THR  10  14.505  -2.959  -1.264
   72    HA   THR  10           HA       THR  10  16.346  -1.133  -0.114
   73    HB   THR  10           HB       THR  10  16.829  -4.093  -0.405
   74    HG1  THR  10           HG1      THR  10  15.382  -4.468   1.154
   75   HG21  THR  10          HG21      THR  10  18.232  -3.894   1.419
   76   HG22  THR  10          HG22      THR  10  17.432  -2.436   2.007
   77   HG23  THR  10          HG23      THR  10  18.502  -2.352   0.608
   78    H    LYS  11           HN       LYS  11  16.940  -3.757  -2.461
   79    HA   LYS  11           HA       LYS  11  19.512  -2.782  -3.172
   80    HB2  LYS  11           HB1      LYS  11  17.675  -4.782  -4.492
   81    HB3  LYS  11           HB2      LYS  11  19.300  -4.432  -5.069
   82    HG2  LYS  11           HG1      LYS  11  20.019  -5.016  -2.651
   83    HG3  LYS  11           HG2      LYS  11  18.441  -5.801  -2.557
   84    HD2  LYS  11           HD1      LYS  11  19.855  -7.514  -3.255
   85    HD3  LYS  11           HD2      LYS  11  19.125  -6.951  -4.760
   86    HE2  LYS  11           HE1      LYS  11  21.152  -5.464  -5.033
   87    HE3  LYS  11           HE2      LYS  11  21.876  -6.354  -3.694
   88    HZ1  LYS  11           HZ1      LYS  11  21.212  -7.300  -6.401
   89    HZ2  LYS  11           HZ2      LYS  11  21.291  -8.404  -5.122
   90    HZ3  LYS  11           HZ3      LYS  11  22.650  -7.482  -5.529
   91    H    SER  12           HN       SER  12  16.291  -2.206  -4.352
   92    HA   SER  12           HA       SER  12  16.933  -1.171  -6.892
   93    HB2  SER  12           HB1      SER  12  14.656  -1.761  -6.436
   94    HB3  SER  12           HB2      SER  12  14.586  -0.668  -5.054
   95    HG   SER  12           HG       SER  12  14.049  -0.148  -7.616
   96    H    GLY  13           HN       GLY  13  17.180   0.156  -3.708
   97    HA2  GLY  13           HA1      GLY  13  18.899   2.137  -4.036
   98    HA3  GLY  13           HA2      GLY  13  17.460   2.886  -4.713
   99    H    LEU  14           HN       LEU  14  18.298   0.973  -1.818
  100    HA   LEU  14           HA       LEU  14  16.315   1.986  -0.158
  101    HB2  LEU  14           HB1      LEU  14  17.460   1.017   1.625
  102    HB3  LEU  14           HB2      LEU  14  17.908   0.036   0.231
  103    HG   LEU  14           HG       LEU  14  19.648   2.228   1.349
  104   HD11  LEU  14          HD11      LEU  14  20.535  -0.498   1.800
  105   HD12  LEU  14          HD12      LEU  14  19.028  -0.132   2.638
  106   HD13  LEU  14          HD13      LEU  14  20.455   0.866   2.914
  107   HD21  LEU  14          HD21      LEU  14  20.170  -0.045  -0.564
  108   HD22  LEU  14          HD22      LEU  14  21.399   1.046   0.077
  109   HD23  LEU  14          HD23      LEU  14  20.116   1.674  -0.958
  110    H    SER  15           HN       SER  15  19.286   3.417  -1.203
  111    HA   SER  15           HA       SER  15  19.512   5.357   0.870
  112    HB2  SER  15           HB1      SER  15  21.172   6.420  -0.565
  113    HB3  SER  15           HB2      SER  15  21.419   4.674  -0.563
  114    HG   SER  15           HG       SER  15  21.443   5.801  -2.673
  115    H    VAL  16           HN       VAL  16  18.346   5.540  -2.490
  116    HA   VAL  16           HA       VAL  16  17.471   8.235  -2.286
  117    HB   VAL  16           HB       VAL  16  17.984   7.192  -4.450
  118   HG11  VAL  16          HG11      VAL  16  16.212   5.691  -5.448
  119   HG12  VAL  16          HG12      VAL  16  17.215   4.970  -4.188
  120   HG13  VAL  16          HG13      VAL  16  15.576   5.505  -3.814
  121   HG21  VAL  16          HG21      VAL  16  16.136   9.050  -3.976
  122   HG22  VAL  16          HG22      VAL  16  16.484   8.457  -5.600
  123   HG23  VAL  16          HG23      VAL  16  15.100   7.824  -4.708
  124    H    ASN  17           HN       ASN  17  16.060   5.187  -1.451
  125    HA   ASN  17           HA       ASN  17  13.335   5.927  -1.505
  126    HB2  ASN  17           HB1      ASN  17  13.728   3.618  -1.403
  127    HB3  ASN  17           HB2      ASN  17  14.883   3.778  -0.083
  128   HD21  ASN  17          HD21      ASN  17  11.564   4.930  -0.575
  129   HD22  ASN  17          HD22      ASN  17  10.928   4.233   0.872
  130    H    TRP  18           HN       TRP  18  15.805   6.082   1.020
  131    HA   TRP  18           HA       TRP  18  14.197   6.819   3.168
  132    HB2  TRP  18           HB1      TRP  18  16.689   6.234   3.160
  133    HB3  TRP  18           HB2      TRP  18  16.970   7.916   2.719
  134    HD1  TRP  18           HD1      TRP  18  17.047   9.635   4.648
  135    HE1  TRP  18           HE1      TRP  18  16.638   9.533   7.187
  136    HE3  TRP  18           HE3      TRP  18  15.114   4.913   4.969
  137    HZ2  TRP  18           HZ2      TRP  18  15.629   7.693   9.076
  138    HZ3  TRP  18           HZ3      TRP  18  14.452   4.057   7.179
  139    HH2  TRP  18           HH2      TRP  18  14.706   5.420   9.189
  140    H    GLY  19           HN       GLY  19  15.972   8.946   0.916
  141    HA2  GLY  19           HA1      GLY  19  15.146  11.391   1.931
  142    HA3  GLY  19           HA2      GLY  19  15.559  11.103   0.248
  143    H    GLU  20           HN       GLU  20  13.457   9.227  -0.282
  144    HA   GLU  20           HA       GLU  20  11.377  11.064  -0.918
  145    HB2  GLU  20           HB1      GLU  20  11.738   8.103  -1.248
  146    HB3  GLU  20           HB2      GLU  20  10.185   8.853  -1.589
  147    HG2  GLU  20           HG1      GLU  20  11.668  10.469  -3.045
  148    HG3  GLU  20           HG2      GLU  20  12.768   9.092  -3.032
  149    H    ALA  21           HN       ALA  21  11.703   8.436   1.428
  150    HA   ALA  21           HA       ALA  21   9.049   8.566   2.407
  151    HB1  ALA  21           HB1      ALA  21  11.053   7.673   4.335
  152    HB2  ALA  21           HB2      ALA  21   9.654   6.825   3.674
  153    HB3  ALA  21           HB3      ALA  21  11.166   6.871   2.768
  154    H    PHE  22           HN       PHE  22  12.074  10.089   3.427
  155    HA   PHE  22           HA       PHE  22  11.244  11.222   5.817
  156    HB2  PHE  22           HB1      PHE  22  13.569  11.230   4.549
  157    HB3  PHE  22           HB2      PHE  22  13.013  12.812   4.011
  158    HD1  PHE  22           HD1      PHE  22  13.614  10.781   7.058
  159    HD2  PHE  22           HD2      PHE  22  13.251  14.676   5.380
  160    HE1  PHE  22           HE1      PHE  22  14.372  11.764   9.183
  161    HE2  PHE  22           HE2      PHE  22  14.010  15.664   7.501
  162    HZ   PHE  22           HZ       PHE  22  14.572  14.208   9.406
  163    H    SER  23           HN       SER  23  11.421  12.937   2.692
  164    HA   SER  23           HA       SER  23  10.066  15.224   3.446
  165    HB2  SER  23           HB1      SER  23   9.848  13.961   0.708
  166    HB3  SER  23           HB2      SER  23   9.747  15.674   1.113
  167    HG   SER  23           HG       SER  23  11.930  15.628   1.669
  168    H    ALA  24           HN       ALA  24   8.779  12.127   2.380
  169    HA   ALA  24           HA       ALA  24   6.113  12.843   1.985
  170    HB1  ALA  24           HB1      ALA  24   7.617  10.442   2.117
  171    HB2  ALA  24           HB2      ALA  24   6.188  10.247   3.132
  172    HB3  ALA  24           HB3      ALA  24   6.010  10.698   1.436
  173    H    GLY  25           HN       GLY  25   7.904  12.238   4.932
  174    HA2  GLY  25           HA1      GLY  25   5.562  12.095   6.604
  175    HA3  GLY  25           HA2      GLY  25   7.231  12.184   7.147
  176    H    VAL  26           HN       VAL  26   7.993  14.561   5.860
  177    HA   VAL  26           HA       VAL  26   7.225  16.484   7.724
  178    HB   VAL  26           HB       VAL  26   8.303  16.954   4.940
  179   HG11  VAL  26          HG11      VAL  26   7.792  19.085   5.462
  180   HG12  VAL  26          HG12      VAL  26   7.669  18.743   7.189
  181   HG13  VAL  26          HG13      VAL  26   9.251  18.986   6.447
  182   HG21  VAL  26          HG21      VAL  26   9.487  15.707   7.176
  183   HG22  VAL  26          HG22      VAL  26  10.256  16.181   5.662
  184   HG23  VAL  26          HG23      VAL  26  10.226  17.302   7.023
  185    H    HIS  27           HN       HIS  27   5.873  15.684   4.583
  186    HA   HIS  27           HA       HIS  27   4.235  17.951   4.265
  187    HB2  HIS  27           HB1      HIS  27   4.735  16.397   2.428
  188    HB3  HIS  27           HB2      HIS  27   3.808  15.137   3.237
  189    HD1  HIS  27           HD1      HIS  27   2.804  18.754   2.662
  190    HD2  HIS  27           HD2      HIS  27   1.639  14.905   1.617
  191    HE1  HIS  27           HE1      HIS  27   0.645  19.024   1.402
  192    H    ARG  28           HN       ARG  28   3.692  14.843   5.852
  193    HA   ARG  28           HA       ARG  28   0.943  15.287   6.418
  194    HB2  ARG  28           HB1      ARG  28   2.299  13.072   6.418
  195    HB3  ARG  28           HB2      ARG  28   2.713  13.511   8.070
  196    HG2  ARG  28           HG1      ARG  28  -0.152  13.548   7.287
  197    HG3  ARG  28           HG2      ARG  28   0.639  11.987   7.517
  198    HD2  ARG  28           HD1      ARG  28   1.022  14.080   9.593
  199    HD3  ARG  28           HD2      ARG  28  -0.540  13.266   9.512
  200    HE   ARG  28           HE       ARG  28   1.383  11.280   9.471
  201   HH11  ARG  28          HH11      ARG  28   0.363  13.814  11.629
  202   HH12  ARG  28          HH12      ARG  28   0.833  12.962  13.062
  203   HH21  ARG  28          HH21      ARG  28   2.006  10.147  11.350
  204   HH22  ARG  28          HH22      ARG  28   1.768  10.876  12.902
  205    H    LEU  29           HN       LEU  29   3.922  15.753   8.277
  206    HA   LEU  29           HA       LEU  29   2.738  16.508  10.702
  207    HB2  LEU  29           HB1      LEU  29   5.399  17.013   9.438
  208    HB3  LEU  29           HB2      LEU  29   4.976  17.812  10.950
  209    HG   LEU  29           HG       LEU  29   4.987  14.821  10.569
  210   HD11  LEU  29          HD11      LEU  29   7.226  16.164  10.380
  211   HD12  LEU  29          HD12      LEU  29   7.137  14.699  11.356
  212   HD13  LEU  29          HD13      LEU  29   7.061  16.281  12.132
  213   HD21  LEU  29          HD21      LEU  29   4.080  16.590  12.659
  214   HD22  LEU  29          HD22      LEU  29   5.356  15.520  13.242
  215   HD23  LEU  29          HD23      LEU  29   3.901  14.842  12.509
  216    H    ALA  30           HN       ALA  30   3.280  18.263   7.749
  217    HA   ALA  30           HA       ALA  30   3.043  20.888   8.761
  218    HB1  ALA  30           HB1      ALA  30   3.897  20.189   6.483
  219    HB2  ALA  30           HB2      ALA  30   2.207  20.021   6.006
  220    HB3  ALA  30           HB3      ALA  30   2.827  21.591   6.519
  221    H    ASN  31           HN       ASN  31   0.654  18.599   7.494
  222    HA   ASN  31           HA       ASN  31  -1.521  20.459   7.931
  223    HB2  ASN  31           HB1      ASN  31  -1.518  18.890   6.002
  224    HB3  ASN  31           HB2      ASN  31  -1.624  17.543   7.131
  225   HD21  ASN  31          HD21      ASN  31  -3.281  20.337   5.843
  226   HD22  ASN  31          HD22      ASN  31  -4.873  19.843   6.298
  227    H    GLY  32           HN       GLY  32  -1.083  20.690  10.251
  228    HA2  GLY  32           HA1      GLY  32  -1.791  20.332  12.411
  229    HA3  GLY  32           HA2      GLY  32  -2.853  19.078  11.787
  230    H    GLY  33           HN       GLY  33   0.632  19.636  12.328
  231    HA2  GLY  33           HA1      GLY  33   0.750  16.938  13.516
  232    HA3  GLY  33           HA2      GLY  33   1.949  17.453  12.339
  233    H    ASN  34           HN       ASN  34   0.474  18.946  15.223
  234    HA   ASN  34           HA       ASN  34   3.119  19.875  16.033
  235    HB2  ASN  34           HB1      ASN  34   0.522  20.477  17.439
  236    HB3  ASN  34           HB2      ASN  34   2.019  21.405  17.466
  237   HD21  ASN  34          HD21      ASN  34   2.286  22.996  16.040
  238   HD22  ASN  34          HD22      ASN  34   1.213  23.347  14.732
  239    H    GLY  35           HN       GLY  35   4.158  19.242  17.874
  240    HA2  GLY  35           HA1      GLY  35   4.147  18.268  20.084
  241    HA3  GLY  35           HA2      GLY  35   2.798  17.260  19.581
  242    H    PHE  36           HN       PHE  36   5.330  16.465  20.785
  243    HA   PHE  36           HA       PHE  36   6.036  14.422  18.843
  244    HB2  PHE  36           HB1      PHE  36   8.158  16.183  20.088
  245    HB3  PHE  36           HB2      PHE  36   8.436  14.816  19.013
  246    HD1  PHE  36           HD1      PHE  36   7.569  14.962  16.641
  247    HD2  PHE  36           HD2      PHE  36   7.797  18.326  19.238
  248    HE1  PHE  36           HE1      PHE  36   7.456  16.466  14.697
  249    HE2  PHE  36           HE2      PHE  36   7.684  19.835  17.299
  250    HZ   PHE  36           HZ       PHE  36   7.512  18.906  15.025
  251    H    TRP  37           HN       TRP  37   6.997  12.575  19.766
  252    HA   TRP  37           HA       TRP  37   7.348  12.523  22.661
  253    HB2  TRP  37           HB1      TRP  37   5.387  10.753  21.187
  254    HB3  TRP  37           HB2      TRP  37   5.913  10.484  22.847
  255    HD1  TRP  37           HD1      TRP  37   3.278  12.182  20.907
  256    HE1  TRP  37           HE1      TRP  37   1.920  13.768  22.411
  257    HE3  TRP  37           HE3      TRP  37   6.363  12.274  24.983
  258    HZ2  TRP  37           HZ2      TRP  37   2.129  14.908  24.985
  259    HZ3  TRP  37           HZ3      TRP  37   5.711  13.637  26.924
  260    HH2  TRP  37           HH2      TRP  37   3.638  14.927  26.923
  Start of MODEL    7
    1    H1   LYS   1           HN       LYS   1   3.499   2.461  -5.569
    2    HA   LYS   1           HA       LYS   1   3.127  -0.060  -6.997
    3    HB2  LYS   1           HB1      LYS   1   4.096   1.980  -8.122
    4    HB3  LYS   1           HB2      LYS   1   5.508   1.796  -7.089
    5    HG2  LYS   1           HG1      LYS   1   5.960  -0.383  -8.052
    6    HG3  LYS   1           HG2      LYS   1   4.508  -0.263  -9.047
    7    HD2  LYS   1           HD1      LYS   1   5.522   1.853 -10.015
    8    HD3  LYS   1           HD2      LYS   1   7.024   1.381  -9.217
    9    HE2  LYS   1           HE1      LYS   1   7.290  -0.499 -10.554
   10    HE3  LYS   1           HE2      LYS   1   5.583  -0.548 -10.995
   11    HZ1  LYS   1           HZ1      LYS   1   6.078   0.576 -12.817
   12    HZ2  LYS   1           HZ2      LYS   1   7.704   0.678 -12.364
   13    HZ3  LYS   1           HZ3      LYS   1   6.616   1.882 -11.886
   14    H    TYR   2           HN       TYR   2   4.793   1.278  -4.269
   15    HA   TYR   2           HA       TYR   2   6.622  -0.946  -4.010
   16    HB2  TYR   2           HB1      TYR   2   6.035   1.206  -1.974
   17    HB3  TYR   2           HB2      TYR   2   7.461   0.179  -2.064
   18    HD1  TYR   2           HD2      TYR   2   9.059   0.488  -3.989
   19    HD2  TYR   2           HD1      TYR   2   5.924   3.243  -3.163
   20    HE1  TYR   2           HE2      TYR   2  10.203   2.188  -5.348
   21    HE2  TYR   2           HE1      TYR   2   7.059   4.951  -4.521
   22    HH   TYR   2           HH       TYR   2   9.209   5.490  -5.381
   23    H    TYR   3           HN       TYR   3   5.005  -2.631  -3.944
   24    HA   TYR   3           HA       TYR   3   3.278  -2.740  -1.610
   25    HB2  TYR   3           HB1      TYR   3   2.705  -3.552  -4.010
   26    HB3  TYR   3           HB2      TYR   3   3.636  -4.982  -3.578
   27    HD1  TYR   3           HD2      TYR   3   2.833  -6.510  -1.842
   28    HD2  TYR   3           HD1      TYR   3   0.546  -3.122  -3.021
   29    HE1  TYR   3           HE2      TYR   3   0.856  -7.467  -0.735
   30    HE2  TYR   3           HE1      TYR   3  -1.438  -4.069  -1.916
   31    HH   TYR   3           HH       TYR   3  -1.239  -6.908   0.096
   32    H    GLY   4           HN       GLY   4   5.313  -2.676  -0.244
   33    HA2  GLY   4           HA1      GLY   4   5.986  -5.434   0.468
   34    HA3  GLY   4           HA2      GLY   4   7.315  -4.344   0.104
   35    H    ASN   5           HN       ASN   5   7.169  -5.566   2.552
   36    HA   ASN   5           HA       ASN   5   5.856  -3.962   4.506
   37    HB2  ASN   5           HB1      ASN   5   6.651  -6.411   4.703
   38    HB3  ASN   5           HB2      ASN   5   8.230  -5.723   5.072
   39   HD21  ASN   5          HD21      ASN   5   8.073  -6.724   7.129
   40   HD22  ASN   5          HD22      ASN   5   7.128  -6.008   8.386
   41    H    GLY   6           HN       GLY   6   9.132  -4.073   3.191
   42    HA2  GLY   6           HA1      GLY   6   9.826  -1.487   3.314
   43    HA3  GLY   6           HA2      GLY   6  10.044  -1.981   4.986
   44    H    VAL   7           HN       VAL   7  10.786  -4.741   3.905
   45    HA   VAL   7           HA       VAL   7  13.590  -4.373   3.980
   46    HB   VAL   7           HB       VAL   7  13.725  -6.774   3.373
   47   HG11  VAL   7          HG11      VAL   7  12.874  -5.651   5.706
   48   HG12  VAL   7          HG12      VAL   7  11.605  -6.837   5.391
   49   HG13  VAL   7          HG13      VAL   7  13.289  -7.352   5.495
   50   HG21  VAL   7          HG21      VAL   7  11.908  -7.017   1.855
   51   HG22  VAL   7          HG22      VAL   7  11.551  -8.028   3.255
   52   HG23  VAL   7          HG23      VAL   7  10.744  -6.472   3.064
   53    H    HIS   8           HN       HIS   8  11.305  -4.924   1.344
   54    HA   HIS   8           HA       HIS   8  13.304  -5.164  -0.679
   55    HB2  HIS   8           HB1      HIS   8  10.996  -6.095  -0.876
   56    HB3  HIS   8           HB2      HIS   8  10.383  -4.449  -1.007
   57    HD1  HIS   8           HD1      HIS   8   9.483  -4.886  -3.387
   58    HD2  HIS   8           HD2      HIS   8  13.589  -5.396  -3.007
   59    HE1  HIS   8           HE1      HIS   8  10.366  -5.010  -5.739
   60    H    LEU   9           HN       LEU   9  11.520  -2.514   0.733
   61    HA   LEU   9           HA       LEU   9  11.977  -0.573  -1.246
   62    HB2  LEU   9           HB1      LEU   9  10.369  -0.005   0.325
   63    HB3  LEU   9           HB2      LEU   9  11.388  -0.478   1.683
   64    HG   LEU   9           HG       LEU   9  12.266   1.845   0.056
   65   HD11  LEU   9          HD11      LEU   9   9.722   1.716   1.538
   66   HD12  LEU   9          HD12      LEU   9  10.219   2.775   0.219
   67   HD13  LEU   9          HD13      LEU   9  10.744   3.114   1.868
   68   HD21  LEU   9          HD21      LEU   9  13.691   1.899   1.759
   69   HD22  LEU   9          HD22      LEU   9  12.787   0.659   2.628
   70   HD23  LEU   9          HD23      LEU   9  12.343   2.358   2.800
   71    H    THR  10           HN       THR  10  14.059  -1.978   1.105
   72    HA   THR  10           HA       THR  10  15.954   0.122   1.320
   73    HB   THR  10           HB       THR  10  16.537  -2.821   1.658
   74    HG1  THR  10           HG1      THR  10  15.280  -0.971   3.414
   75   HG21  THR  10          HG21      THR  10  18.464  -2.202   2.647
   76   HG22  THR  10          HG22      THR  10  17.716  -0.829   3.465
   77   HG23  THR  10          HG23      THR  10  18.225  -0.684   1.783
   78    H    LYS  11           HN       LYS  11  16.223  -2.994  -0.405
   79    HA   LYS  11           HA       LYS  11  18.486  -2.168  -1.912
   80    HB2  LYS  11           HB1      LYS  11  16.580  -4.488  -2.171
   81    HB3  LYS  11           HB2      LYS  11  17.920  -4.246  -3.283
   82    HG2  LYS  11           HG1      LYS  11  18.744  -5.753  -1.717
   83    HG3  LYS  11           HG2      LYS  11  19.401  -4.199  -1.198
   84    HD2  LYS  11           HD1      LYS  11  17.981  -4.062   0.625
   85    HD3  LYS  11           HD2      LYS  11  16.799  -5.164  -0.084
   86    HE2  LYS  11           HE1      LYS  11  19.522  -6.195   0.540
   87    HE3  LYS  11           HE2      LYS  11  18.395  -5.931   1.870
   88    HZ1  LYS  11           HZ1      LYS  11  17.323  -7.780   1.346
   89    HZ2  LYS  11           HZ2      LYS  11  18.515  -8.121   0.196
   90    HZ3  LYS  11           HZ3      LYS  11  17.114  -7.288  -0.259
   91    H    SER  12           HN       SER  12  15.048  -1.978  -2.402
   92    HA   SER  12           HA       SER  12  15.022  -1.602  -5.194
   93    HB2  SER  12           HB1      SER  12  13.120  -0.791  -2.999
   94    HB3  SER  12           HB2      SER  12  12.806  -0.404  -4.690
   95    HG   SER  12           HG       SER  12  12.501  -2.483  -5.133
   96    H    GLY  13           HN       GLY  13  15.881   0.484  -2.575
   97    HA2  GLY  13           HA1      GLY  13  17.316   2.356  -3.759
   98    HA3  GLY  13           HA2      GLY  13  15.710   2.879  -4.242
   99    H    LEU  14           HN       LEU  14  17.308   1.775  -1.248
  100    HA   LEU  14           HA       LEU  14  15.668   3.136   0.532
  101    HB2  LEU  14           HB1      LEU  14  17.246   2.668   2.180
  102    HB3  LEU  14           HB2      LEU  14  17.453   1.378   0.997
  103    HG   LEU  14           HG       LEU  14  19.220   3.815   1.124
  104   HD11  LEU  14          HD11      LEU  14  19.107   2.036   3.127
  105   HD12  LEU  14          HD12      LEU  14  20.598   2.826   2.612
  106   HD13  LEU  14          HD13      LEU  14  20.222   1.198   2.047
  107   HD21  LEU  14          HD21      LEU  14  19.490   1.144  -0.251
  108   HD22  LEU  14          HD22      LEU  14  20.736   2.391  -0.198
  109   HD23  LEU  14          HD23      LEU  14  19.210   2.703  -1.026
  110    H    SER  15           HN       SER  15  18.219   4.313  -1.486
  111    HA   SER  15           HA       SER  15  18.745   6.718  -0.052
  112    HB2  SER  15           HB1      SER  15  19.632   7.400  -2.436
  113    HB3  SER  15           HB2      SER  15  20.485   6.183  -1.486
  114    HG   SER  15           HG       SER  15  20.230   5.088  -3.286
  115    H    VAL  16           HN       VAL  16  16.863   6.027  -2.997
  116    HA   VAL  16           HA       VAL  16  15.850   8.669  -3.249
  117    HB   VAL  16           HB       VAL  16  15.960   7.126  -5.157
  118   HG11  VAL  16          HG11      VAL  16  13.875   5.610  -3.605
  119   HG12  VAL  16          HG12      VAL  16  14.138   5.387  -5.336
  120   HG13  VAL  16          HG13      VAL  16  15.433   5.028  -4.192
  121   HG21  VAL  16          HG21      VAL  16  13.055   7.707  -4.773
  122   HG22  VAL  16          HG22      VAL  16  14.212   9.036  -4.847
  123   HG23  VAL  16          HG23      VAL  16  14.062   7.921  -6.205
  124    H    ASN  17           HN       ASN  17  14.889   5.897  -1.411
  125    HA   ASN  17           HA       ASN  17  12.171   6.548  -1.012
  126    HB2  ASN  17           HB1      ASN  17  12.752   4.344  -0.458
  127    HB3  ASN  17           HB2      ASN  17  14.148   4.851   0.487
  128   HD21  ASN  17          HD21      ASN  17  10.742   5.832   0.518
  129   HD22  ASN  17          HD22      ASN  17  10.479   5.481   2.189
  130    H    TRP  18           HN       TRP  18  15.123   7.444   0.692
  131    HA   TRP  18           HA       TRP  18  14.027   8.609   2.964
  132    HB2  TRP  18           HB1      TRP  18  16.440   8.233   2.650
  133    HB3  TRP  18           HB2      TRP  18  16.478   9.501   1.428
  134    HD1  TRP  18           HD1      TRP  18  15.299   9.305   5.136
  135    HE1  TRP  18           HE1      TRP  18  16.121  11.432   6.330
  136    HE3  TRP  18           HE3      TRP  18  17.624  11.598   1.202
  137    HZ2  TRP  18           HZ2      TRP  18  17.563  13.772   5.689
  138    HZ3  TRP  18           HZ3      TRP  18  18.700  13.779   1.577
  139    HH2  TRP  18           HH2      TRP  18  18.668  14.842   3.774
  140    H    GLY  19           HN       GLY  19  14.884  10.205  -0.112
  141    HA2  GLY  19           HA1      GLY  19  14.032  12.768   0.494
  142    HA3  GLY  19           HA2      GLY  19  14.016  12.077  -1.122
  143    H    GLU  20           HN       GLU  20  12.113  10.000  -0.538
  144    HA   GLU  20           HA       GLU  20   9.716  11.485  -0.959
  145    HB2  GLU  20           HB1      GLU  20  10.367   8.568  -0.695
  146    HB3  GLU  20           HB2      GLU  20   8.693   9.103  -0.716
  147    HG2  GLU  20           HG1      GLU  20  10.750   9.503  -2.872
  148    HG3  GLU  20           HG2      GLU  20   9.336   8.451  -2.926
  149    H    ALA  21           HN       ALA  21  10.878   9.418   1.689
  150    HA   ALA  21           HA       ALA  21   8.624   9.711   3.346
  151    HB1  ALA  21           HB1      ALA  21  11.177   9.390   4.744
  152    HB2  ALA  21           HB2      ALA  21   9.736   8.371   4.757
  153    HB3  ALA  21           HB3      ALA  21  10.907   8.227   3.445
  154    H    PHE  22           HN       PHE  22  11.553  11.631   2.985
  155    HA   PHE  22           HA       PHE  22  11.381  13.236   5.238
  156    HB2  PHE  22           HB1      PHE  22  13.251  13.184   3.540
  157    HB3  PHE  22           HB2      PHE  22  12.249  14.203   2.512
  158    HD1  PHE  22           HD1      PHE  22  11.604  16.482   3.312
  159    HD2  PHE  22           HD2      PHE  22  14.500  14.089   5.312
  160    HE1  PHE  22           HE1      PHE  22  12.459  18.483   4.461
  161    HE2  PHE  22           HE2      PHE  22  15.359  16.085   6.465
  162    HZ   PHE  22           HZ       PHE  22  14.338  18.286   6.040
  163    H    SER  23           HN       SER  23  10.142  14.019   1.984
  164    HA   SER  23           HA       SER  23   8.837  16.370   2.605
  165    HB2  SER  23           HB1      SER  23   9.164  15.088   0.323
  166    HB3  SER  23           HB2      SER  23   7.549  14.476   0.678
  167    HG   SER  23           HG       SER  23   8.389  17.095   0.139
  168    H    ALA  24           HN       ALA  24   7.725  13.050   2.991
  169    HA   ALA  24           HA       ALA  24   5.042  13.575   3.610
  170    HB1  ALA  24           HB1      ALA  24   6.811  11.319   3.664
  171    HB2  ALA  24           HB2      ALA  24   5.812  11.339   5.118
  172    HB3  ALA  24           HB3      ALA  24   5.053  11.358   3.526
  173    H    GLY  25           HN       GLY  25   7.907  13.361   5.694
  174    HA2  GLY  25           HA1      GLY  25   6.641  13.573   8.171
  175    HA3  GLY  25           HA2      GLY  25   8.280  14.108   7.832
  176    H    VAL  26           HN       VAL  26   7.973  16.187   6.149
  177    HA   VAL  26           HA       VAL  26   7.322  18.315   7.821
  178    HB   VAL  26           HB       VAL  26   7.387  18.320   4.800
  179   HG11  VAL  26          HG11      VAL  26   6.550  20.386   5.126
  180   HG12  VAL  26          HG12      VAL  26   7.038  20.431   6.822
  181   HG13  VAL  26          HG13      VAL  26   8.215  20.776   5.554
  182   HG21  VAL  26          HG21      VAL  26   9.457  17.465   5.751
  183   HG22  VAL  26          HG22      VAL  26   9.709  19.069   5.064
  184   HG23  VAL  26          HG23      VAL  26   9.568  18.871   6.810
  185    H    HIS  27           HN       HIS  27   5.379  16.644   5.400
  186    HA   HIS  27           HA       HIS  27   3.199  18.431   5.379
  187    HB2  HIS  27           HB1      HIS  27   3.427  15.497   4.715
  188    HB3  HIS  27           HB2      HIS  27   1.920  16.391   4.539
  189    HD1  HIS  27           HD1      HIS  27   3.229  19.017   3.380
  190    HD2  HIS  27           HD2      HIS  27   3.931  15.151   2.031
  191    HE1  HIS  27           HE1      HIS  27   4.016  19.266   1.005
  192    H    ARG  28           HN       ARG  28   3.904  15.571   7.337
  193    HA   ARG  28           HA       ARG  28   1.419  15.495   8.687
  194    HB2  ARG  28           HB1      ARG  28   3.023  13.597   8.577
  195    HB3  ARG  28           HB2      ARG  28   4.099  14.482   9.651
  196    HG2  ARG  28           HG1      ARG  28   2.907  12.886  10.951
  197    HG3  ARG  28           HG2      ARG  28   2.281  14.486  11.355
  198    HD2  ARG  28           HD1      ARG  28   0.372  14.126   9.888
  199    HD3  ARG  28           HD2      ARG  28   1.010  12.549   9.423
  200    HE   ARG  28           HE       ARG  28   0.624  12.825  12.252
  201   HH11  ARG  28          HH11      ARG  28  -0.919  12.049   9.229
  202   HH12  ARG  28          HH12      ARG  28  -2.159  11.085   9.960
  203   HH21  ARG  28          HH21      ARG  28  -1.004  11.558  13.226
  204   HH22  ARG  28          HH22      ARG  28  -2.207  10.807  12.233
  205    H    LEU  29           HN       LEU  29   4.557  16.921   9.536
  206    HA   LEU  29           HA       LEU  29   3.769  17.894  12.067
  207    HB2  LEU  29           HB1      LEU  29   6.024  18.372  10.201
  208    HB3  LEU  29           HB2      LEU  29   5.740  19.576  11.455
  209    HG   LEU  29           HG       LEU  29   6.197  16.643  11.988
  210   HD11  LEU  29          HD11      LEU  29   8.268  18.503  12.824
  211   HD12  LEU  29          HD12      LEU  29   8.072  18.437  11.073
  212   HD13  LEU  29          HD13      LEU  29   8.402  16.961  11.979
  213   HD21  LEU  29          HD21      LEU  29   6.838  17.959  14.253
  214   HD22  LEU  29          HD22      LEU  29   5.244  17.277  13.929
  215   HD23  LEU  29          HD23      LEU  29   5.545  18.992  13.642
  216    H    ALA  30           HN       ALA  30   3.425  19.132   8.830
  217    HA   ALA  30           HA       ALA  30   2.936  21.835   9.425
  218    HB1  ALA  30           HB1      ALA  30   3.336  20.696   7.149
  219    HB2  ALA  30           HB2      ALA  30   1.594  20.418   7.153
  220    HB3  ALA  30           HB3      ALA  30   2.224  22.063   7.224
  221    H    ASN  31           HN       ASN  31   0.830  19.013   9.384
  222    HA   ASN  31           HA       ASN  31  -1.540  20.600   9.886
  223    HB2  ASN  31           HB1      ASN  31  -1.873  18.668   8.522
  224    HB3  ASN  31           HB2      ASN  31  -1.054  17.627   9.682
  225   HD21  ASN  31          HD21      ASN  31  -3.709  19.986   9.744
  226   HD22  ASN  31          HD22      ASN  31  -4.807  18.978  10.618
  227    H    GLY  32           HN       GLY  32   0.051  17.916  11.630
  228    HA2  GLY  32           HA1      GLY  32   0.390  19.057  14.081
  229    HA3  GLY  32           HA2      GLY  32  -1.304  18.587  14.079
  230    H    GLY  33           HN       GLY  33   2.001  17.389  13.818
  231    HA2  GLY  33           HA1      GLY  33   1.011  14.670  14.373
  232    HA3  GLY  33           HA2      GLY  33   2.577  15.053  13.673
  233    H    ASN  34           HN       ASN  34   0.768  14.628  16.573
  234    HA   ASN  34           HA       ASN  34   2.935  15.564  18.273
  235    HB2  ASN  34           HB1      ASN  34   0.221  14.392  18.908
  236    HB3  ASN  34           HB2      ASN  34   1.388  14.882  20.132
  237   HD21  ASN  34          HD21      ASN  34   2.302  17.192  19.579
  238   HD22  ASN  34          HD22      ASN  34   1.079  18.379  19.295
  239    H    GLY  35           HN       GLY  35   4.584  14.087  17.778
  240    HA2  GLY  35           HA1      GLY  35   4.302  11.533  19.166
  241    HA3  GLY  35           HA2      GLY  35   4.719  11.463  17.461
  242    H    PHE  36           HN       PHE  36   6.652  10.355  18.239
  243    HA   PHE  36           HA       PHE  36   8.605  12.001  19.632
  244    HB2  PHE  36           HB1      PHE  36   8.515   9.118  18.784
  245    HB3  PHE  36           HB2      PHE  36  10.027   9.861  19.294
  246    HD1  PHE  36           HD1      PHE  36  10.296  10.666  21.600
  247    HD2  PHE  36           HD2      PHE  36   6.810   8.568  20.350
  248    HE1  PHE  36           HE1      PHE  36   9.710  10.243  23.953
  249    HE2  PHE  36           HE2      PHE  36   6.218   8.143  22.700
  250    HZ   PHE  36           HZ       PHE  36   7.668   8.982  24.505
  251    H    TRP  37           HN       TRP  37  10.944  11.735  18.713
  252    HA   TRP  37           HA       TRP  37  10.861  12.828  16.020
  253    HB2  TRP  37           HB1      TRP  37  12.187  13.912  17.849
  254    HB3  TRP  37           HB2      TRP  37  13.245  12.504  17.851
  255    HD1  TRP  37           HD1      TRP  37  14.658  12.081  15.509
  256    HE1  TRP  37           HE1      TRP  37  15.616  13.804  13.854
  257    HE3  TRP  37           HE3      TRP  37  11.849  16.138  16.845
  258    HZ2  TRP  37           HZ2      TRP  37  15.231  16.523  13.202
  259    HZ3  TRP  37           HZ3      TRP  37  12.206  18.263  15.657
  260    HH2  TRP  37           HH2      TRP  37  13.863  18.450  13.874
  Start of MODEL    8
    1    H1   LYS   1           HN       LYS   1   0.964   3.743  -0.599
    2    HA   LYS   1           HA       LYS   1  -0.066   1.178   0.398
    3    HB2  LYS   1           HB1      LYS   1   2.177   1.962  -1.373
    4    HB3  LYS   1           HB2      LYS   1   2.477   0.608  -0.292
    5    HG2  LYS   1           HG1      LYS   1   1.700  -0.416  -2.212
    6    HG3  LYS   1           HG2      LYS   1   0.255  -0.326  -1.203
    7    HD2  LYS   1           HD1      LYS   1   0.808   1.945  -3.037
    8    HD3  LYS   1           HD2      LYS   1   0.252   0.429  -3.751
    9    HE2  LYS   1           HE1      LYS   1  -1.209   1.451  -1.379
   10    HE3  LYS   1           HE2      LYS   1  -1.427   2.311  -2.902
   11    HZ1  LYS   1           HZ1      LYS   1  -2.855   0.752  -3.505
   12    HZ2  LYS   1           HZ2      LYS   1  -2.578  -0.119  -2.082
   13    HZ3  LYS   1           HZ3      LYS   1  -1.626  -0.409  -3.449
   14    H    TYR   2           HN       TYR   2   1.238   0.007   1.974
   15    HA   TYR   2           HA       TYR   2   3.141   1.531   3.539
   16    HB2  TYR   2           HB1      TYR   2   0.421   0.766   4.577
   17    HB3  TYR   2           HB2      TYR   2   1.789   0.988   5.662
   18    HD1  TYR   2           HD1      TYR   2   2.935   3.237   5.721
   19    HD2  TYR   2           HD2      TYR   2  -0.782   2.615   3.745
   20    HE1  TYR   2           HE1      TYR   2   2.515   5.660   5.761
   21    HE2  TYR   2           HE2      TYR   2  -1.211   5.037   3.779
   22    HH   TYR   2           HH       TYR   2   0.436   7.197   3.900
   23    H    TYR   3           HN       TYR   3   4.696   0.219   4.227
   24    HA   TYR   3           HA       TYR   3   5.884  -1.670   4.669
   25    HB2  TYR   3           HB1      TYR   3   3.282  -2.866   5.620
   26    HB3  TYR   3           HB2      TYR   3   4.911  -3.252   6.163
   27    HD1  TYR   3           HD1      TYR   3   6.151  -0.784   6.814
   28    HD2  TYR   3           HD2      TYR   3   2.073  -1.887   7.318
   29    HE1  TYR   3           HE1      TYR   3   5.937   0.860   8.631
   30    HE2  TYR   3           HE2      TYR   3   1.847  -0.246   9.136
   31    HH   TYR   3           HH       TYR   3   2.965   1.851   9.873
   32    H    GLY   4           HN       GLY   4   5.014  -1.431   2.037
   33    HA2  GLY   4           HA1      GLY   4   3.746  -3.774   1.060
   34    HA3  GLY   4           HA2      GLY   4   4.683  -2.633   0.107
   35    H    ASN   5           HN       ASN   5   5.904  -4.003  -1.088
   36    HA   ASN   5           HA       ASN   5   7.113  -6.356  -0.059
   37    HB2  ASN   5           HB1      ASN   5   7.310  -4.799  -2.602
   38    HB3  ASN   5           HB2      ASN   5   8.545  -6.005  -2.255
   39   HD21  ASN   5          HD21      ASN   5   6.066  -5.677  -4.101
   40   HD22  ASN   5          HD22      ASN   5   5.317  -7.231  -4.003
   41    H    GLY   6           HN       GLY   6   8.857  -3.598  -1.481
   42    HA2  GLY   6           HA1      GLY   6  10.555  -2.320  -0.467
   43    HA3  GLY   6           HA2      GLY   6  10.580  -3.457   0.873
   44    H    VAL   7           HN       VAL   7  10.634  -5.662  -1.263
   45    HA   VAL   7           HA       VAL   7  13.435  -6.071  -1.217
   46    HB   VAL   7           HB       VAL   7  12.981  -7.985  -2.729
   47   HG11  VAL   7          HG11      VAL   7  11.199  -7.672  -0.320
   48   HG12  VAL   7          HG12      VAL   7  11.475  -9.204  -1.150
   49   HG13  VAL   7          HG13      VAL   7  12.819  -8.365  -0.375
   50   HG21  VAL   7          HG21      VAL   7  10.405  -6.572  -2.996
   51   HG22  VAL   7          HG22      VAL   7  11.266  -7.592  -4.149
   52   HG23  VAL   7          HG23      VAL   7  10.316  -8.328  -2.858
   53    H    HIS   8           HN       HIS   8  11.203  -4.947  -3.714
   54    HA   HIS   8           HA       HIS   8  13.165  -4.856  -5.785
   55    HB2  HIS   8           HB1      HIS   8  10.671  -5.009  -6.134
   56    HB3  HIS   8           HB2      HIS   8  10.568  -3.315  -5.664
   57    HD1  HIS   8           HD1      HIS   8  11.640  -1.571  -7.310
   58    HD2  HIS   8           HD2      HIS   8  11.520  -5.475  -8.724
   59    HE1  HIS   8           HE1      HIS   8  12.078  -1.405  -9.781
   60    H    LEU   9           HN       LEU   9  11.964  -2.577  -3.402
   61    HA   LEU   9           HA       LEU   9  13.062  -0.229  -4.485
   62    HB2  LEU   9           HB1      LEU   9  11.497   0.115  -2.812
   63    HB3  LEU   9           HB2      LEU   9  12.228  -1.083  -1.745
   64    HG   LEU   9           HG       LEU   9  13.805   1.360  -2.346
   65   HD11  LEU   9          HD11      LEU   9  12.040   2.665  -1.832
   66   HD12  LEU   9          HD12      LEU   9  12.463   2.212  -0.181
   67   HD13  LEU   9          HD13      LEU   9  11.169   1.361  -1.025
   68   HD21  LEU   9          HD21      LEU   9  15.021   0.387  -0.762
   69   HD22  LEU   9          HD22      LEU   9  13.752  -0.792  -0.430
   70   HD23  LEU   9          HD23      LEU   9  13.734   0.775   0.380
   71    H    THR  10           HN       THR  10  14.508  -2.894  -2.859
   72    HA   THR  10           HA       THR  10  16.824  -1.593  -1.862
   73    HB   THR  10           HB       THR  10  16.870  -4.469  -2.703
   74    HG1  THR  10           HG1      THR  10  15.403  -3.349  -0.534
   75   HG21  THR  10          HG21      THR  10  18.585  -4.620  -1.267
   76   HG22  THR  10          HG22      THR  10  17.727  -3.719  -0.017
   77   HG23  THR  10          HG23      THR  10  18.597  -2.857  -1.286
   78    H    LYS  11           HN       LYS  11  16.499  -3.800  -4.651
   79    HA   LYS  11           HA       LYS  11  19.029  -3.092  -5.734
   80    HB2  LYS  11           HB1      LYS  11  16.660  -4.483  -6.995
   81    HB3  LYS  11           HB2      LYS  11  18.249  -4.351  -7.738
   82    HG2  LYS  11           HG1      LYS  11  19.193  -5.565  -5.782
   83    HG3  LYS  11           HG2      LYS  11  17.543  -5.813  -5.205
   84    HD2  LYS  11           HD1      LYS  11  17.005  -6.996  -7.287
   85    HD3  LYS  11           HD2      LYS  11  18.664  -6.763  -7.842
   86    HE2  LYS  11           HE1      LYS  11  18.457  -8.981  -6.952
   87    HE3  LYS  11           HE2      LYS  11  19.447  -8.024  -5.852
   88    HZ1  LYS  11           HZ1      LYS  11  16.568  -8.658  -5.495
   89    HZ2  LYS  11           HZ2      LYS  11  17.495  -7.707  -4.448
   90    HZ3  LYS  11           HZ3      LYS  11  17.851  -9.350  -4.637
   91    H    SER  12           HN       SER  12  15.802  -1.846  -6.103
   92    HA   SER  12           HA       SER  12  16.140  -0.465  -8.534
   93    HB2  SER  12           HB1      SER  12  13.926  -0.853  -7.582
   94    HB3  SER  12           HB2      SER  12  14.323   0.157  -6.192
   95    HG   SER  12           HG       SER  12  13.101   1.233  -7.865
   96    H    GLY  13           HN       GLY  13  17.225   0.191  -5.321
   97    HA2  GLY  13           HA1      GLY  13  19.174   1.928  -5.697
   98    HA3  GLY  13           HA2      GLY  13  17.796   2.992  -5.937
   99    H    LEU  14           HN       LEU  14  18.782   0.479  -3.602
  100    HA   LEU  14           HA       LEU  14  17.352   1.456  -1.431
  101    HB2  LEU  14           HB1      LEU  14  18.603   0.017  -0.094
  102    HB3  LEU  14           HB2      LEU  14  18.607  -0.747  -1.682
  103    HG   LEU  14           HG       LEU  14  20.888   0.919  -0.633
  104   HD11  LEU  14          HD11      LEU  14  21.822  -0.867   0.373
  105   HD12  LEU  14          HD12      LEU  14  21.156  -2.011  -0.792
  106   HD13  LEU  14          HD13      LEU  14  20.146  -1.398   0.517
  107   HD21  LEU  14          HD21      LEU  14  20.639  -1.019  -2.931
  108   HD22  LEU  14          HD22      LEU  14  22.138  -0.253  -2.405
  109   HD23  LEU  14          HD23      LEU  14  20.821   0.731  -3.045
  110    H    SER  15           HN       SER  15  20.295   2.594  -2.848
  111    HA   SER  15           HA       SER  15  21.243   4.067  -0.602
  112    HB2  SER  15           HB1      SER  15  22.919   3.644  -2.162
  113    HB3  SER  15           HB2      SER  15  21.880   4.030  -3.533
  114    HG   SER  15           HG       SER  15  23.613   5.609  -2.424
  115    H    VAL  16           HN       VAL  16  19.544   5.036  -3.579
  116    HA   VAL  16           HA       VAL  16  19.225   7.746  -2.792
  117    HB   VAL  16           HB       VAL  16  19.145   7.053  -5.148
  118   HG11  VAL  16          HG11      VAL  16  18.036   4.962  -5.064
  119   HG12  VAL  16          HG12      VAL  16  16.614   5.668  -4.292
  120   HG13  VAL  16          HG13      VAL  16  16.984   6.045  -5.975
  121   HG21  VAL  16          HG21      VAL  16  17.539   8.932  -3.879
  122   HG22  VAL  16          HG22      VAL  16  17.942   8.874  -5.595
  123   HG23  VAL  16          HG23      VAL  16  16.459   8.118  -5.011
  124    H    ASN  17           HN       ASN  17  17.452   4.841  -2.160
  125    HA   ASN  17           HA       ASN  17  14.945   5.977  -1.532
  126    HB2  ASN  17           HB1      ASN  17  14.921   3.657  -1.872
  127    HB3  ASN  17           HB2      ASN  17  16.301   3.393  -0.809
  128   HD21  ASN  17          HD21      ASN  17  13.244   5.140  -0.390
  129   HD22  ASN  17          HD22      ASN  17  12.745   4.272   1.019
  130    H    TRP  18           HN       TRP  18  17.793   5.244   0.438
  131    HA   TRP  18           HA       TRP  18  16.757   5.819   2.951
  132    HB2  TRP  18           HB1      TRP  18  19.031   4.840   2.399
  133    HB3  TRP  18           HB2      TRP  18  19.570   6.486   2.079
  134    HD1  TRP  18           HD1      TRP  18  19.620   8.182   4.221
  135    HE1  TRP  18           HE1      TRP  18  19.961   7.687   6.723
  136    HE3  TRP  18           HE3      TRP  18  18.600   3.172   4.204
  137    HZ2  TRP  18           HZ2      TRP  18  19.817   5.467   8.460
  138    HZ3  TRP  18           HZ3      TRP  18  18.725   1.936   6.328
  139    HH2  TRP  18           HH2      TRP  18  19.321   3.061   8.411
  140    H    GLY  19           HN       GLY  19  18.488   8.022   0.740
  141    HA2  GLY  19           HA1      GLY  19  18.247  10.328   2.313
  142    HA3  GLY  19           HA2      GLY  19  18.469  10.310   0.569
  143    H    GLU  20           HN       GLU  20  16.114   9.077  -0.235
  144    HA   GLU  20           HA       GLU  20  14.328  11.252  -0.246
  145    HB2  GLU  20           HB1      GLU  20  14.225   8.422  -1.185
  146    HB3  GLU  20           HB2      GLU  20  12.717   9.320  -1.087
  147    HG2  GLU  20           HG1      GLU  20  15.153  10.092  -2.677
  148    HG3  GLU  20           HG2      GLU  20  13.642   9.448  -3.316
  149    H    ALA  21           HN       ALA  21  14.283   8.181   1.525
  150    HA   ALA  21           HA       ALA  21  11.792   8.546   2.783
  151    HB1  ALA  21           HB1      ALA  21  13.771   7.063   4.344
  152    HB2  ALA  21           HB2      ALA  21  12.203   6.553   3.718
  153    HB3  ALA  21           HB3      ALA  21  13.622   6.525   2.671
  154    H    PHE  22           HN       PHE  22  15.009   9.683   3.554
  155    HA   PHE  22           HA       PHE  22  14.581  10.414   6.232
  156    HB2  PHE  22           HB1      PHE  22  16.814  10.292   5.176
  157    HB3  PHE  22           HB2      PHE  22  16.422  11.713   4.214
  158    HD1  PHE  22           HD1      PHE  22  16.626  10.586   7.757
  159    HD2  PHE  22           HD2      PHE  22  17.013  13.800   4.994
  160    HE1  PHE  22           HE1      PHE  22  17.468  12.031   9.561
  161    HE2  PHE  22           HE2      PHE  22  17.856  15.250   6.793
  162    HZ   PHE  22           HZ       PHE  22  18.086  14.366   9.080
  163    H    SER  23           HN       SER  23  14.684  12.575   3.394
  164    HA   SER  23           HA       SER  23  13.643  14.819   4.690
  165    HB2  SER  23           HB1      SER  23  13.550  14.039   1.768
  166    HB3  SER  23           HB2      SER  23  13.099  15.630   2.379
  167    HG   SER  23           HG       SER  23  15.153  16.070   2.813
  168    H    ALA  24           HN       ALA  24  12.065  12.049   3.291
  169    HA   ALA  24           HA       ALA  24   9.482  13.027   2.941
  170    HB1  ALA  24           HB1      ALA  24  10.756  10.499   2.911
  171    HB2  ALA  24           HB2      ALA  24   9.317  10.364   3.923
  172    HB3  ALA  24           HB3      ALA  24   9.176  10.939   2.262
  173    H    GLY  25           HN       GLY  25  10.942  11.531   5.825
  174    HA2  GLY  25           HA1      GLY  25   8.651  11.700   7.457
  175    HA3  GLY  25           HA2      GLY  25  10.306  11.557   8.030
  176    H    VAL  26           HN       VAL  26  11.360  13.939   7.001
  177    HA   VAL  26           HA       VAL  26  10.753  15.756   9.018
  178    HB   VAL  26           HB       VAL  26  11.940  16.363   6.307
  179   HG11  VAL  26          HG11      VAL  26  11.586  18.472   7.053
  180   HG12  VAL  26          HG12      VAL  26  11.508  17.979   8.745
  181   HG13  VAL  26          HG13      VAL  26  13.072  18.149   7.946
  182   HG21  VAL  26          HG21      VAL  26  12.947  14.905   8.575
  183   HG22  VAL  26          HG22      VAL  26  13.682  15.160   6.993
  184   HG23  VAL  26          HG23      VAL  26  13.924  16.343   8.278
  185    H    HIS  27           HN       HIS  27   9.567  15.597   5.684
  186    HA   HIS  27           HA       HIS  27   8.088  17.991   5.726
  187    HB2  HIS  27           HB1      HIS  27   8.735  16.467   3.728
  188    HB3  HIS  27           HB2      HIS  27   7.255  15.594   4.115
  189    HD1  HIS  27           HD1      HIS  27   7.332  16.874   1.427
  190    HD2  HIS  27           HD2      HIS  27   6.044  18.912   4.810
  191    HE1  HIS  27           HE1      HIS  27   5.885  18.745   0.574
  192    H    ARG  28           HN       ARG  28   7.249  14.678   6.606
  193    HA   ARG  28           HA       ARG  28   4.486  15.165   7.025
  194    HB2  ARG  28           HB1      ARG  28   5.452  12.911   6.665
  195    HB3  ARG  28           HB2      ARG  28   6.231  13.015   8.238
  196    HG2  ARG  28           HG1      ARG  28   4.342  11.754   8.668
  197    HG3  ARG  28           HG2      ARG  28   3.849  13.379   9.148
  198    HD2  ARG  28           HD1      ARG  28   2.857  13.647   6.858
  199    HD3  ARG  28           HD2      ARG  28   3.182  11.936   6.589
  200    HE   ARG  28           HE       ARG  28   1.676  12.418   8.975
  201   HH11  ARG  28          HH11      ARG  28   1.467  12.048   5.520
  202   HH12  ARG  28          HH12      ARG  28  -0.184  11.524   5.545
  203   HH21  ARG  28          HH21      ARG  28  -0.498  11.729   9.022
  204   HH22  ARG  28          HH22      ARG  28  -1.301  11.344   7.538
  205    H    LEU  29           HN       LEU  29   7.322  15.282   9.116
  206    HA   LEU  29           HA       LEU  29   5.969  15.581  11.566
  207    HB2  LEU  29           HB1      LEU  29   8.715  16.163  10.577
  208    HB3  LEU  29           HB2      LEU  29   8.219  16.839  12.127
  209    HG   LEU  29           HG       LEU  29   7.922  13.907  11.611
  210   HD11  LEU  29          HD11      LEU  29  10.163  13.545  12.514
  211   HD12  LEU  29          HD12      LEU  29  10.450  15.285  12.507
  212   HD13  LEU  29          HD13      LEU  29  10.218  14.424  10.985
  213   HD21  LEU  29          HD21      LEU  29   8.351  13.862  14.069
  214   HD22  LEU  29          HD22      LEU  29   6.890  14.733  13.603
  215   HD23  LEU  29          HD23      LEU  29   8.344  15.625  14.050
  216    H    ALA  30           HN       ALA  30   7.284  17.989   9.309
  217    HA   ALA  30           HA       ALA  30   6.571  20.265  10.799
  218    HB1  ALA  30           HB1      ALA  30   7.865  19.758   8.384
  219    HB2  ALA  30           HB2      ALA  30   6.473  20.756   7.960
  220    HB3  ALA  30           HB3      ALA  30   7.633  21.325   9.160
  221    H    ASN  31           HN       ASN  31   4.903  18.670   8.084
  222    HA   ASN  31           HA       ASN  31   2.574  20.355   8.434
  223    HB2  ASN  31           HB1      ASN  31   3.361  19.642   6.178
  224    HB3  ASN  31           HB2      ASN  31   2.950  17.981   6.596
  225   HD21  ASN  31          HD21      ASN  31   1.578  18.119   4.706
  226   HD22  ASN  31          HD22      ASN  31  -0.000  18.805   4.856
  227    H    GLY  32           HN       GLY  32   2.243  19.612  10.684
  228    HA2  GLY  32           HA1      GLY  32   0.044  18.176  11.151
  229    HA3  GLY  32           HA2      GLY  32   1.241  16.898  11.002
  230    H    GLY  33           HN       GLY  33   3.327  18.694  12.184
  231    HA2  GLY  33           HA1      GLY  33   2.646  18.120  14.969
  232    HA3  GLY  33           HA2      GLY  33   4.248  18.485  14.346
  233    H    ASN  34           HN       ASN  34   1.072  19.966  14.925
  234    HA   ASN  34           HA       ASN  34   2.348  22.591  15.119
  235    HB2  ASN  34           HB1      ASN  34  -0.515  21.685  14.896
  236    HB3  ASN  34           HB2      ASN  34  -0.111  23.333  15.370
  237   HD21  ASN  34          HD21      ASN  34  -0.536  24.570  13.686
  238   HD22  ASN  34          HD22      ASN  34  -0.005  24.288  12.066
  239    H    GLY  35           HN       GLY  35  -0.001  20.658  16.992
  240    HA2  GLY  35           HA1      GLY  35   1.283  21.622  19.450
  241    HA3  GLY  35           HA2      GLY  35  -0.444  21.884  19.250
  242    H    PHE  36           HN       PHE  36  -1.671  20.438  20.234
  243    HA   PHE  36           HA       PHE  36  -0.909  17.623  20.186
  244    HB2  PHE  36           HB1      PHE  36  -1.517  17.477  22.662
  245    HB3  PHE  36           HB2      PHE  36   0.036  18.209  22.273
  246    HD1  PHE  36           HD2      PHE  36  -3.413  18.890  23.360
  247    HD2  PHE  36           HD1      PHE  36   0.491  20.483  22.780
  248    HE1  PHE  36           HE2      PHE  36  -4.045  20.894  24.639
  249    HE2  PHE  36           HE1      PHE  36  -0.134  22.490  24.059
  250    HZ   PHE  36           HZ       PHE  36  -2.405  22.698  24.990
  251    H    TRP  37           HN       TRP  37  -2.736  16.290  21.271
  252    HA   TRP  37           HA       TRP  37  -5.234  17.213  20.081
  253    HB2  TRP  37           HB1      TRP  37  -4.496  14.964  19.504
  254    HB3  TRP  37           HB2      TRP  37  -4.436  14.520  21.207
  255    HD1  TRP  37           HD1      TRP  37  -7.284  16.197  19.158
  256    HE1  TRP  37           HE1      TRP  37  -9.429  14.823  19.526
  257    HE3  TRP  37           HE3      TRP  37  -5.377  12.495  22.124
  258    HZ2  TRP  37           HZ2      TRP  37 -10.210  12.480  20.893
  259    HZ3  TRP  37           HZ3      TRP  37  -6.890  10.725  22.920
  260    HH2  TRP  37           HH2      TRP  37  -9.256  10.720  22.317
  Start of MODEL    9
    1    H1   LYS   1           HN       LYS   1   6.509   0.286  -9.640
    2    HA   LYS   1           HA       LYS   1   7.271  -1.798  -9.128
    3    HB2  LYS   1           HB1      LYS   1   9.772  -0.235  -8.497
    4    HB3  LYS   1           HB2      LYS   1   9.683  -1.984  -8.335
    5    HG2  LYS   1           HG1      LYS   1   8.937  -0.672 -10.914
    6    HG3  LYS   1           HG2      LYS   1  10.632  -0.950 -10.505
    7    HD2  LYS   1           HD1      LYS   1  10.418  -3.239 -10.600
    8    HD3  LYS   1           HD2      LYS   1   8.693  -3.199 -10.231
    9    HE2  LYS   1           HE1      LYS   1   9.850  -2.178 -12.815
   10    HE3  LYS   1           HE2      LYS   1   9.306  -3.840 -12.596
   11    HZ1  LYS   1           HZ1      LYS   1   7.699  -1.362 -12.552
   12    HZ2  LYS   1           HZ2      LYS   1   7.123  -2.793 -11.860
   13    HZ3  LYS   1           HZ3      LYS   1   7.488  -2.739 -13.511
   14    H    TYR   2           HN       TYR   2   5.668  -0.517  -7.286
   15    HA   TYR   2           HA       TYR   2   6.817  -0.797  -4.649
   16    HB2  TYR   2           HB1      TYR   2   5.197   0.975  -5.038
   17    HB3  TYR   2           HB2      TYR   2   3.990  -0.201  -5.546
   18    HD1  TYR   2           HD1      TYR   2   6.216   0.428  -2.603
   19    HD2  TYR   2           HD2      TYR   2   2.376  -0.756  -4.001
   20    HE1  TYR   2           HE1      TYR   2   5.436   0.236  -0.279
   21    HE2  TYR   2           HE2      TYR   2   1.585  -0.949  -1.680
   22    HH   TYR   2           HH       TYR   2   2.347   0.184   0.625
   23    H    TYR   3           HN       TYR   3   7.361  -2.971  -4.475
   24    HA   TYR   3           HA       TYR   3   5.169  -4.708  -3.752
   25    HB2  TYR   3           HB1      TYR   3   6.804  -5.142  -6.216
   26    HB3  TYR   3           HB2      TYR   3   6.304  -6.544  -5.276
   27    HD1  TYR   3           HD2      TYR   3   3.696  -6.427  -4.574
   28    HD2  TYR   3           HD1      TYR   3   5.438  -4.539  -7.966
   29    HE1  TYR   3           HE2      TYR   3   1.496  -6.384  -5.672
   30    HE2  TYR   3           HE1      TYR   3   3.242  -4.489  -9.073
   31    HH   TYR   3           HH       TYR   3   0.657  -4.513  -8.034
   32    H    GLY   4           HN       GLY   4   5.847  -5.285  -1.790
   33    HA2  GLY   4           HA1      GLY   4   7.661  -7.120  -1.122
   34    HA3  GLY   4           HA2      GLY   4   8.682  -5.697  -1.269
   35    H    ASN   5           HN       ASN   5   8.277  -7.225   1.105
   36    HA   ASN   5           HA       ASN   5   6.413  -5.938   2.825
   37    HB2  ASN   5           HB1      ASN   5   7.248  -8.213   3.255
   38    HB3  ASN   5           HB2      ASN   5   8.866  -7.570   3.517
   39   HD21  ASN   5          HD21      ASN   5   9.338  -7.634   5.584
   40   HD22  ASN   5          HD22      ASN   5   8.283  -7.212   6.885
   41    H    GLY   6           HN       GLY   6   9.666  -5.253   1.835
   42    HA2  GLY   6           HA1      GLY   6   9.942  -2.690   2.327
   43    HA3  GLY   6           HA2      GLY   6  10.015  -3.287   3.978
   44    H    VAL   7           HN       VAL   7  11.360  -5.784   2.816
   45    HA   VAL   7           HA       VAL   7  14.023  -4.979   3.340
   46    HB   VAL   7           HB       VAL   7  14.651  -7.259   2.587
   47   HG11  VAL   7          HG11      VAL   7  13.892  -8.259   4.499
   48   HG12  VAL   7          HG12      VAL   7  13.539  -6.572   4.879
   49   HG13  VAL   7          HG13      VAL   7  12.253  -7.635   4.307
   50   HG21  VAL   7          HG21      VAL   7  13.319  -8.034   0.934
   51   HG22  VAL   7          HG22      VAL   7  12.386  -8.683   2.284
   52   HG23  VAL   7          HG23      VAL   7  11.900  -7.168   1.523
   53    H    HIS   8           HN       HIS   8  12.248  -5.645   0.358
   54    HA   HIS   8           HA       HIS   8  14.514  -5.362  -1.353
   55    HB2  HIS   8           HB1      HIS   8  11.540  -5.368  -1.855
   56    HB3  HIS   8           HB2      HIS   8  12.713  -5.149  -3.150
   57    HD1  HIS   8           HD1      HIS   8  14.223  -7.205  -3.735
   58    HD2  HIS   8           HD2      HIS   8  11.247  -7.967  -0.938
   59    HE1  HIS   8           HE1      HIS   8  14.072  -9.710  -3.580
   60    H    LEU   9           HN       LEU   9  12.112  -3.185  -0.049
   61    HA   LEU   9           HA       LEU   9  12.494  -1.018  -1.796
   62    HB2  LEU   9           HB1      LEU   9  10.605  -0.880  -0.454
   63    HB3  LEU   9           HB2      LEU   9  11.496  -1.292   1.010
   64    HG   LEU   9           HG       LEU   9  12.153   1.282  -0.318
   65   HD11  LEU   9          HD11      LEU   9   9.498   0.592   0.764
   66   HD12  LEU   9          HD12      LEU   9   9.966   1.825  -0.406
   67   HD13  LEU   9          HD13      LEU   9  10.196   2.114   1.318
   68   HD21  LEU   9          HD21      LEU   9  13.313   1.399   1.575
   69   HD22  LEU   9          HD22      LEU   9  12.498  -0.019   2.238
   70   HD23  LEU   9          HD23      LEU   9  11.776   1.580   2.422
   71    H    THR  10           HN       THR  10  14.432  -2.272   0.757
   72    HA   THR  10           HA       THR  10  15.881   0.081   1.398
   73    HB   THR  10           HB       THR  10  16.820  -2.782   1.655
   74    HG1  THR  10           HG1      THR  10  15.605  -2.912   3.404
   75   HG21  THR  10          HG21      THR  10  18.612  -2.005   2.751
   76   HG22  THR  10          HG22      THR  10  17.646  -0.854   3.675
   77   HG23  THR  10          HG23      THR  10  18.214  -0.433   2.060
   78    H    LYS  11           HN       LYS  11  16.933  -2.783  -0.457
   79    HA   LYS  11           HA       LYS  11  19.212  -1.472  -1.535
   80    HB2  LYS  11           HB1      LYS  11  17.800  -3.995  -2.420
   81    HB3  LYS  11           HB2      LYS  11  19.370  -3.464  -3.008
   82    HG2  LYS  11           HG1      LYS  11  19.056  -3.720  -0.079
   83    HG3  LYS  11           HG2      LYS  11  19.080  -5.212  -1.022
   84    HD2  LYS  11           HD1      LYS  11  21.317  -5.004  -0.738
   85    HD3  LYS  11           HD2      LYS  11  21.165  -3.941  -2.140
   86    HE2  LYS  11           HE1      LYS  11  22.333  -2.561  -0.752
   87    HE3  LYS  11           HE2      LYS  11  20.693  -2.138  -0.262
   88    HZ1  LYS  11           HZ1      LYS  11  20.937  -3.847   1.525
   89    HZ2  LYS  11           HZ2      LYS  11  21.941  -2.497   1.697
   90    HZ3  LYS  11           HZ3      LYS  11  22.578  -3.957   1.127
   91    H    SER  12           HN       SER  12  15.896  -1.757  -2.525
   92    HA   SER  12           HA       SER  12  16.193  -1.166  -5.263
   93    HB2  SER  12           HB1      SER  12  14.107  -2.067  -4.383
   94    HB3  SER  12           HB2      SER  12  13.869  -0.624  -3.398
   95    HG   SER  12           HG       SER  12  12.727  -0.114  -5.131
   96    H    GLY  13           HN       GLY  13  16.370   0.802  -2.431
   97    HA2  GLY  13           HA1      GLY  13  17.640   2.951  -3.265
   98    HA3  GLY  13           HA2      GLY  13  16.063   3.273  -3.969
   99    H    LEU  14           HN       LEU  14  17.314   2.152  -0.820
  100    HA   LEU  14           HA       LEU  14  15.239   3.152   0.734
  101    HB2  LEU  14           HB1      LEU  14  16.569   2.729   2.591
  102    HB3  LEU  14           HB2      LEU  14  17.162   1.595   1.379
  103    HG   LEU  14           HG       LEU  14  18.503   4.223   1.991
  104   HD11  LEU  14          HD11      LEU  14  19.668   1.661   2.904
  105   HD12  LEU  14          HD12      LEU  14  18.317   2.310   3.833
  106   HD13  LEU  14          HD13      LEU  14  19.776   3.275   3.608
  107   HD21  LEU  14          HD21      LEU  14  19.420   1.750   0.527
  108   HD22  LEU  14          HD22      LEU  14  20.406   3.174   0.856
  109   HD23  LEU  14          HD23      LEU  14  19.001   3.300  -0.203
  110    H    SER  15           HN       SER  15  17.890   4.794  -0.758
  111    HA   SER  15           HA       SER  15  17.866   7.117   0.890
  112    HB2  SER  15           HB1      SER  15  18.905   6.681  -1.919
  113    HB3  SER  15           HB2      SER  15  19.179   8.143  -0.972
  114    HG   SER  15           HG       SER  15  19.832   5.689   0.188
  115    H    VAL  16           HN       VAL  16  16.564   6.451  -2.358
  116    HA   VAL  16           HA       VAL  16  15.256   8.960  -2.603
  117    HB   VAL  16           HB       VAL  16  15.863   7.606  -4.562
  118   HG11  VAL  16          HG11      VAL  16  15.477   5.387  -3.836
  119   HG12  VAL  16          HG12      VAL  16  13.784   5.725  -3.467
  120   HG13  VAL  16          HG13      VAL  16  14.332   5.683  -5.144
  121   HG21  VAL  16          HG21      VAL  16  12.873   7.880  -4.518
  122   HG22  VAL  16          HG22      VAL  16  13.936   9.287  -4.514
  123   HG23  VAL  16          HG23      VAL  16  13.986   8.148  -5.860
  124    H    ASN  17           HN       ASN  17  14.407   5.948  -1.124
  125    HA   ASN  17           HA       ASN  17  11.585   6.325  -1.105
  126    HB2  ASN  17           HB1      ASN  17  12.558   4.103  -0.835
  127    HB3  ASN  17           HB2      ASN  17  13.349   4.609   0.655
  128   HD21  ASN  17          HD21      ASN  17  10.094   4.681  -0.764
  129   HD22  ASN  17          HD22      ASN  17   9.279   4.135   0.659
  130    H    TRP  18           HN       TRP  18  14.192   7.083   1.149
  131    HA   TRP  18           HA       TRP  18  12.620   7.863   3.334
  132    HB2  TRP  18           HB1      TRP  18  15.063   7.471   3.445
  133    HB3  TRP  18           HB2      TRP  18  15.326   8.944   2.516
  134    HD1  TRP  18           HD1      TRP  18  14.355   7.736   6.006
  135    HE1  TRP  18           HE1      TRP  18  14.504   9.720   7.639
  136    HE3  TRP  18           HE3      TRP  18  15.147  11.501   2.639
  137    HZ2  TRP  18           HZ2      TRP  18  14.904  12.512   7.516
  138    HZ3  TRP  18           HZ3      TRP  18  15.402  13.800   3.479
  139    HH2  TRP  18           HH2      TRP  18  15.282  14.293   5.868
  140    H    GLY  19           HN       GLY  19  14.094   9.873   0.778
  141    HA2  GLY  19           HA1      GLY  19  13.134  12.343   1.570
  142    HA3  GLY  19           HA2      GLY  19  13.443  11.893  -0.101
  143    H    GLU  20           HN       GLU  20  11.479   9.849  -0.309
  144    HA   GLU  20           HA       GLU  20   9.215  11.436  -0.949
  145    HB2  GLU  20           HB1      GLU  20   9.877   8.529  -1.054
  146    HB3  GLU  20           HB2      GLU  20   8.188   9.002  -1.173
  147    HG2  GLU  20           HG1      GLU  20  10.256  10.263  -2.926
  148    HG3  GLU  20           HG2      GLU  20   9.556   8.696  -3.329
  149    H    ALA  21           HN       ALA  21   9.941   9.172   1.664
  150    HA   ALA  21           HA       ALA  21   7.359   9.191   2.827
  151    HB1  ALA  21           HB1      ALA  21   9.606   8.750   4.658
  152    HB2  ALA  21           HB2      ALA  21   8.218   7.725   4.292
  153    HB3  ALA  21           HB3      ALA  21   9.617   7.730   3.219
  154    H    PHE  22           HN       PHE  22  10.251  11.149   3.330
  155    HA   PHE  22           HA       PHE  22   9.383  12.519   5.628
  156    HB2  PHE  22           HB1      PHE  22  11.728  12.438   4.508
  157    HB3  PHE  22           HB2      PHE  22  11.142  13.800   3.558
  158    HD1  PHE  22           HD1      PHE  22  11.807  12.637   7.003
  159    HD2  PHE  22           HD2      PHE  22  11.079  15.968   4.456
  160    HE1  PHE  22           HE1      PHE  22  12.410  14.165   8.835
  161    HE2  PHE  22           HE2      PHE  22  11.682  17.501   6.283
  162    HZ   PHE  22           HZ       PHE  22  12.349  16.600   8.476
  163    H    SER  23           HN       SER  23   9.035  13.246   2.182
  164    HA   SER  23           HA       SER  23   7.935  15.788   2.362
  165    HB2  SER  23           HB1      SER  23   7.791  13.582   0.361
  166    HB3  SER  23           HB2      SER  23   6.648  14.915   0.196
  167    HG   SER  23           HG       SER  23   8.404  15.564  -0.919
  168    H    ALA  24           HN       ALA  24   6.292  12.640   2.411
  169    HA   ALA  24           HA       ALA  24   3.664  13.581   2.555
  170    HB1  ALA  24           HB1      ALA  24   5.038  11.051   2.977
  171    HB2  ALA  24           HB2      ALA  24   3.619  11.245   4.007
  172    HB3  ALA  24           HB3      ALA  24   3.462  11.379   2.256
  173    H    GLY  25           HN       GLY  25   5.979  12.827   5.141
  174    HA2  GLY  25           HA1      GLY  25   4.316  13.181   7.340
  175    HA3  GLY  25           HA2      GLY  25   6.047  13.484   7.339
  176    H    VAL  26           HN       VAL  26   5.832  15.582   5.293
  177    HA   VAL  26           HA       VAL  26   5.582  17.811   6.980
  178    HB   VAL  26           HB       VAL  26   5.449  17.751   3.962
  179   HG11  VAL  26          HG11      VAL  26   4.883  19.906   4.287
  180   HG12  VAL  26          HG12      VAL  26   5.475  19.921   5.949
  181   HG13  VAL  26          HG13      VAL  26   6.605  20.107   4.607
  182   HG21  VAL  26          HG21      VAL  26   7.588  17.181   5.778
  183   HG22  VAL  26          HG22      VAL  26   7.590  17.155   4.014
  184   HG23  VAL  26          HG23      VAL  26   7.955  18.650   4.874
  185    H    HIS  27           HN       HIS  27   3.321  16.317   4.725
  186    HA   HIS  27           HA       HIS  27   1.349  18.338   4.819
  187    HB2  HIS  27           HB1      HIS  27   1.388  16.641   3.056
  188    HB3  HIS  27           HB2      HIS  27   1.058  15.382   4.242
  189    HD1  HIS  27           HD1      HIS  27  -1.123  14.751   2.976
  190    HD2  HIS  27           HD2      HIS  27  -1.060  18.629   4.464
  191    HE1  HIS  27           HE1      HIS  27  -3.499  15.562   2.838
  192    H    ARG  28           HN       ARG  28   1.907  15.443   6.759
  193    HA   ARG  28           HA       ARG  28  -0.505  15.609   8.245
  194    HB2  ARG  28           HB1      ARG  28   0.798  13.534   8.064
  195    HB3  ARG  28           HB2      ARG  28   2.114  14.279   8.961
  196    HG2  ARG  28           HG1      ARG  28   1.006  14.159  10.961
  197    HG3  ARG  28           HG2      ARG  28  -0.588  14.176  10.203
  198    HD2  ARG  28           HD1      ARG  28  -0.668  11.955  10.209
  199    HD3  ARG  28           HD2      ARG  28   0.872  11.858   9.357
  200    HE   ARG  28           HE       ARG  28   0.422  11.409  12.135
  201   HH11  ARG  28          HH11      ARG  28   2.751  12.590   9.833
  202   HH12  ARG  28          HH12      ARG  28   4.118  12.226  10.833
  203   HH21  ARG  28          HH21      ARG  28   2.214  10.925  13.461
  204   HH22  ARG  28          HH22      ARG  28   3.812  11.278  12.896
  205    H    LEU  29           HN       LEU  29   2.762  16.843   8.753
  206    HA   LEU  29           HA       LEU  29   2.360  17.777  11.391
  207    HB2  LEU  29           HB1      LEU  29   4.355  18.246   9.241
  208    HB3  LEU  29           HB2      LEU  29   4.293  19.399  10.572
  209    HG   LEU  29           HG       LEU  29   4.541  16.467  11.128
  210   HD11  LEU  29          HD11      LEU  29   6.782  16.385  10.725
  211   HD12  LEU  29          HD12      LEU  29   6.996  18.125  10.914
  212   HD13  LEU  29          HD13      LEU  29   6.294  17.480   9.431
  213   HD21  LEU  29          HD21      LEU  29   5.951  17.567  13.014
  214   HD22  LEU  29          HD22      LEU  29   4.190  17.622  13.098
  215   HD23  LEU  29          HD23      LEU  29   5.092  19.037  12.553
  216    H    ALA  30           HN       ALA  30   1.806  19.196   8.227
  217    HA   ALA  30           HA       ALA  30   1.419  21.861   8.998
  218    HB1  ALA  30           HB1      ALA  30   1.473  20.615   6.633
  219    HB2  ALA  30           HB2      ALA  30  -0.270  20.814   6.810
  220    HB3  ALA  30           HB3      ALA  30   0.787  22.225   6.856
  221    H    ASN  31           HN       ASN  31  -0.745  19.092   9.040
  222    HA   ASN  31           HA       ASN  31  -3.025  20.715   9.802
  223    HB2  ASN  31           HB1      ASN  31  -2.584  17.828   9.162
  224    HB3  ASN  31           HB2      ASN  31  -4.001  18.278  10.107
  225   HD21  ASN  31          HD21      ASN  31  -5.386  19.975   9.172
  226   HD22  ASN  31          HD22      ASN  31  -5.591  20.004   7.457
  227    H    GLY  32           HN       GLY  32  -0.683  18.574  11.290
  228    HA2  GLY  32           HA1      GLY  32  -2.076  18.703  13.858
  229    HA3  GLY  32           HA2      GLY  32  -0.668  17.719  13.490
  230    H    GLY  33           HN       GLY  33   1.072  18.324  14.580
  231    HA2  GLY  33           HA1      GLY  33   2.704  20.269  14.621
  232    HA3  GLY  33           HA2      GLY  33   1.351  21.179  15.275
  233    H    ASN  34           HN       ASN  34   3.114  18.143  15.899
  234    HA   ASN  34           HA       ASN  34   3.445  18.934  18.678
  235    HB2  ASN  34           HB1      ASN  34   2.558  16.793  19.532
  236    HB3  ASN  34           HB2      ASN  34   1.316  17.744  18.724
  237   HD21  ASN  34          HD21      ASN  34   3.117  14.832  18.740
  238   HD22  ASN  34          HD22      ASN  34   2.344  14.083  17.389
  239    H    GLY  35           HN       GLY  35   4.976  17.563  19.836
  240    HA2  GLY  35           HA1      GLY  35   6.448  15.508  19.427
  241    HA3  GLY  35           HA2      GLY  35   6.916  16.366  17.967
  242    H    PHE  36           HN       PHE  36   8.158  15.542  20.738
  243    HA   PHE  36           HA       PHE  36   9.189  18.128  21.586
  244    HB2  PHE  36           HB1      PHE  36   8.600  16.620  23.363
  245    HB3  PHE  36           HB2      PHE  36   9.571  15.330  22.661
  246    HD1  PHE  36           HD1      PHE  36  10.066  18.878  23.720
  247    HD2  PHE  36           HD2      PHE  36  11.539  14.885  23.733
  248    HE1  PHE  36           HE1      PHE  36  11.989  19.596  25.076
  249    HE2  PHE  36           HE2      PHE  36  13.464  15.596  25.090
  250    HZ   PHE  36           HZ       PHE  36  13.691  17.954  25.764
  251    H    TRP  37           HN       TRP  37  10.805  15.002  21.035
  252    HA   TRP  37           HA       TRP  37  13.192  16.394  20.150
  253    HB2  TRP  37           HB1      TRP  37  13.115  14.320  21.686
  254    HB3  TRP  37           HB2      TRP  37  12.837  13.406  20.207
  255    HD1  TRP  37           HD1      TRP  37  14.861  14.562  18.220
  256    HE1  TRP  37           HE1      TRP  37  17.399  14.387  18.606
  257    HE3  TRP  37           HE3      TRP  37  14.864  13.860  23.284
  258    HZ2  TRP  37           HZ2      TRP  37  19.169  14.001  20.771
  259    HZ3  TRP  37           HZ3      TRP  37  17.022  13.596  24.436
  260    HH2  TRP  37           HH2      TRP  37  19.129  13.665  23.204
  Start of MODEL   10
    1    H1   LYS   1           HN       LYS   1   0.817   4.698   4.179
    2    HA   LYS   1           HA       LYS   1   1.050   3.428   6.142
    3    HB2  LYS   1           HB1      LYS   1  -1.860   3.339   5.336
    4    HB3  LYS   1           HB2      LYS   1  -1.278   2.933   6.945
    5    HG2  LYS   1           HG1      LYS   1  -0.419   5.187   7.227
    6    HG3  LYS   1           HG2      LYS   1  -0.939   5.603   5.592
    7    HD2  LYS   1           HD1      LYS   1  -2.630   6.442   6.984
    8    HD3  LYS   1           HD2      LYS   1  -3.283   4.927   6.355
    9    HE2  LYS   1           HE1      LYS   1  -3.021   3.827   8.379
   10    HE3  LYS   1           HE2      LYS   1  -1.795   4.958   8.949
   11    HZ1  LYS   1           HZ1      LYS   1  -3.837   6.604   8.747
   12    HZ2  LYS   1           HZ2      LYS   1  -3.549   5.698  10.146
   13    HZ3  LYS   1           HZ3      LYS   1  -4.702   5.177   9.023
   14    H    TYR   2           HN       TYR   2   1.648   1.770   3.835
   15    HA   TYR   2           HA       TYR   2   1.265  -0.799   5.081
   16    HB2  TYR   2           HB1      TYR   2  -0.771  -0.219   3.502
   17    HB3  TYR   2           HB2      TYR   2   0.355  -0.694   2.235
   18    HD1  TYR   2           HD1      TYR   2  -1.502  -1.861   5.194
   19    HD2  TYR   2           HD2      TYR   2   0.971  -2.989   1.921
   20    HE1  TYR   2           HE1      TYR   2  -2.051  -4.224   5.601
   21    HE2  TYR   2           HE2      TYR   2   0.428  -5.354   2.318
   22    HH   TYR   2           HH       TYR   2  -1.241  -6.406   5.152
   23    H    TYR   3           HN       TYR   3   2.954  -2.105   4.684
   24    HA   TYR   3           HA       TYR   3   5.100  -1.097   3.041
   25    HB2  TYR   3           HB1      TYR   3   5.235  -2.323   5.350
   26    HB3  TYR   3           HB2      TYR   3   5.155  -3.783   4.371
   27    HD1  TYR   3           HD1      TYR   3   6.956  -4.273   2.736
   28    HD2  TYR   3           HD2      TYR   3   7.219  -1.000   5.443
   29    HE1  TYR   3           HE1      TYR   3   9.375  -4.128   2.317
   30    HE2  TYR   3           HE2      TYR   3   9.639  -0.846   5.030
   31    HH   TYR   3           HH       TYR   3  11.304  -3.190   2.967
   32    H    GLY   4           HN       GLY   4   4.039  -1.263   0.972
   33    HA2  GLY   4           HA1      GLY   4   3.336  -3.879  -0.036
   34    HA3  GLY   4           HA2      GLY   4   3.311  -2.370  -0.936
   35    H    ASN   5           HN       ASN   5   4.794  -2.140  -2.469
   36    HA   ASN   5           HA       ASN   5   6.831  -4.128  -2.817
   37    HB2  ASN   5           HB1      ASN   5   7.458  -2.661  -4.802
   38    HB3  ASN   5           HB2      ASN   5   5.827  -3.326  -4.812
   39   HD21  ASN   5          HD21      ASN   5   4.075  -1.948  -4.297
   40   HD22  ASN   5          HD22      ASN   5   4.208  -0.237  -4.493
   41    H    GLY   6           HN       GLY   6   7.975  -3.726  -0.790
   42    HA2  GLY   6           HA1      GLY   6   9.692  -1.328  -0.895
   43    HA3  GLY   6           HA2      GLY   6   9.294  -2.209   0.573
   44    H    VAL   7           HN       VAL   7   9.694  -4.774  -1.024
   45    HA   VAL   7           HA       VAL   7  12.370  -5.239  -0.228
   46    HB   VAL   7           HB       VAL   7  12.138  -7.407  -1.412
   47   HG11  VAL   7          HG11      VAL   7  10.793  -6.500   0.853
   48   HG12  VAL   7          HG12      VAL   7   9.596  -7.434  -0.047
   49   HG13  VAL   7          HG13      VAL   7  11.129  -8.174   0.416
   50   HG21  VAL   7          HG21      VAL   7  10.827  -7.266  -3.247
   51   HG22  VAL   7          HG22      VAL   7   9.554  -7.699  -2.106
   52   HG23  VAL   7          HG23      VAL   7   9.801  -6.011  -2.552
   53    H    HIS   8           HN       HIS   8  10.865  -4.592  -3.358
   54    HA   HIS   8           HA       HIS   8  13.254  -4.972  -4.871
   55    HB2  HIS   8           HB1      HIS   8  10.854  -5.096  -5.730
   56    HB3  HIS   8           HB2      HIS   8  10.868  -3.335  -5.723
   57    HD1  HIS   8           HD1      HIS   8  10.404  -4.261  -8.395
   58    HD2  HIS   8           HD2      HIS   8  14.269  -4.183  -6.875
   59    HE1  HIS   8           HE1      HIS   8  11.916  -4.253 -10.405
   60    H    LEU   9           HN       LEU   9  11.759  -2.263  -3.248
   61    HA   LEU   9           HA       LEU   9  13.176  -0.176  -4.486
   62    HB2  LEU   9           HB1      LEU   9  11.339   0.485  -3.227
   63    HB3  LEU   9           HB2      LEU   9  11.814  -0.496  -1.843
   64    HG   LEU   9           HG       LEU   9  13.582   1.771  -2.586
   65   HD11  LEU   9          HD11      LEU   9  11.298   2.696  -2.777
   66   HD12  LEU   9          HD12      LEU   9  12.214   3.386  -1.438
   67   HD13  LEU   9          HD13      LEU   9  10.976   2.170  -1.125
   68   HD21  LEU   9          HD21      LEU   9  14.453   1.093  -0.657
   69   HD22  LEU   9          HD22      LEU   9  13.084   0.025  -0.343
   70   HD23  LEU   9          HD23      LEU   9  13.010   1.721   0.141
   71    H    THR  10           HN       THR  10  14.118  -2.520  -2.137
   72    HA   THR  10           HA       THR  10  16.295  -1.113  -0.984
   73    HB   THR  10           HB       THR  10  15.992  -4.110  -1.236
   74    HG1  THR  10           HG1      THR  10  15.238  -2.637   1.046
   75   HG21  THR  10          HG21      THR  10  17.781  -4.299   0.095
   76   HG22  THR  10          HG22      THR  10  17.200  -3.037   1.182
   77   HG23  THR  10          HG23      THR  10  18.104  -2.605  -0.269
   78    H    LYS  11           HN       LYS  11  16.334  -3.832  -3.299
   79    HA   LYS  11           HA       LYS  11  19.061  -3.464  -3.984
   80    HB2  LYS  11           HB1      LYS  11  17.198  -5.444  -4.381
   81    HB3  LYS  11           HB2      LYS  11  17.392  -4.789  -6.001
   82    HG2  LYS  11           HG1      LYS  11  19.916  -5.040  -5.570
   83    HG3  LYS  11           HG2      LYS  11  19.429  -6.100  -4.245
   84    HD2  LYS  11           HD1      LYS  11  18.245  -7.541  -5.779
   85    HD3  LYS  11           HD2      LYS  11  18.572  -6.440  -7.119
   86    HE2  LYS  11           HE1      LYS  11  20.967  -6.855  -6.879
   87    HE3  LYS  11           HE2      LYS  11  20.650  -7.936  -5.523
   88    HZ1  LYS  11           HZ1      LYS  11  19.344  -8.470  -8.096
   89    HZ2  LYS  11           HZ2      LYS  11  19.815  -9.553  -6.885
   90    HZ3  LYS  11           HZ3      LYS  11  20.976  -8.876  -7.914
   91    H    SER  12           HN       SER  12  16.081  -2.140  -5.188
   92    HA   SER  12           HA       SER  12  16.972  -1.274  -7.717
   93    HB2  SER  12           HB1      SER  12  14.733  -0.476  -5.891
   94    HB3  SER  12           HB2      SER  12  15.083   0.505  -7.314
   95    HG   SER  12           HG       SER  12  13.652  -0.997  -8.003
   96    H    GLY  13           HN       GLY  13  16.665   0.531  -4.653
   97    HA2  GLY  13           HA1      GLY  13  19.103   1.919  -4.991
   98    HA3  GLY  13           HA2      GLY  13  17.777   2.931  -5.543
   99    H    LEU  14           HN       LEU  14  18.438   0.778  -2.775
  100    HA   LEU  14           HA       LEU  14  16.772   2.049  -0.953
  101    HB2  LEU  14           HB1      LEU  14  17.833   0.818   0.716
  102    HB3  LEU  14           HB2      LEU  14  18.013  -0.165  -0.735
  103    HG   LEU  14           HG       LEU  14  20.181   1.637   0.331
  104   HD11  LEU  14          HD11      LEU  14  19.272  -0.957   1.266
  105   HD12  LEU  14          HD12      LEU  14  20.419   0.170   1.989
  106   HD13  LEU  14          HD13      LEU  14  20.961  -0.972   0.760
  107   HD21  LEU  14          HD21      LEU  14  20.173  -0.611  -1.681
  108   HD22  LEU  14          HD22      LEU  14  21.612   0.224  -1.094
  109   HD23  LEU  14          HD23      LEU  14  20.397   1.106  -2.020
  110    H    SER  15           HN       SER  15  19.885   2.978  -2.145
  111    HA   SER  15           HA       SER  15  20.572   4.760  -0.031
  112    HB2  SER  15           HB1      SER  15  22.078   3.710  -1.893
  113    HB3  SER  15           HB2      SER  15  21.571   5.108  -2.841
  114    HG   SER  15           HG       SER  15  23.562   5.217  -1.414
  115    H    VAL  16           HN       VAL  16  19.350   5.328  -3.332
  116    HA   VAL  16           HA       VAL  16  18.934   8.110  -2.936
  117    HB   VAL  16           HB       VAL  16  19.230   7.096  -5.173
  118   HG11  VAL  16          HG11      VAL  16  17.292   5.991  -6.238
  119   HG12  VAL  16          HG12      VAL  16  17.953   5.066  -4.889
  120   HG13  VAL  16          HG13      VAL  16  16.467   5.993  -4.680
  121   HG21  VAL  16          HG21      VAL  16  16.562   8.477  -4.971
  122   HG22  VAL  16          HG22      VAL  16  18.103   9.314  -4.784
  123   HG23  VAL  16          HG23      VAL  16  17.708   8.525  -6.311
  124    H    ASN  17           HN       ASN  17  16.988   5.267  -2.400
  125    HA   ASN  17           HA       ASN  17  14.489   6.626  -2.177
  126    HB2  ASN  17           HB1      ASN  17  15.458   3.883  -1.411
  127    HB3  ASN  17           HB2      ASN  17  13.848   4.435  -0.959
  128   HD21  ASN  17          HD21      ASN  17  12.570   5.376  -2.818
  129   HD22  ASN  17          HD22      ASN  17  12.649   4.520  -4.317
  130    H    TRP  18           HN       TRP  18  17.135   5.996  -0.030
  131    HA   TRP  18           HA       TRP  18  15.760   6.335   2.424
  132    HB2  TRP  18           HB1      TRP  18  17.937   5.265   2.368
  133    HB3  TRP  18           HB2      TRP  18  18.676   6.728   1.723
  134    HD1  TRP  18           HD1      TRP  18  19.756   8.271   3.459
  135    HE1  TRP  18           HE1      TRP  18  19.636   8.532   6.017
  136    HE3  TRP  18           HE3      TRP  18  16.052   4.889   4.447
  137    HZ2  TRP  18           HZ2      TRP  18  18.166   7.447   8.168
  138    HZ3  TRP  18           HZ3      TRP  18  15.348   4.559   6.782
  139    HH2  TRP  18           HH2      TRP  18  16.384   5.813   8.602
  140    H    GLY  19           HN       GLY  19  17.762   8.578   0.504
  141    HA2  GLY  19           HA1      GLY  19  17.452  10.822   2.142
  142    HA3  GLY  19           HA2      GLY  19  17.801  10.870   0.420
  143    H    GLU  20           HN       GLU  20  15.449   9.684  -0.550
  144    HA   GLU  20           HA       GLU  20  13.739  11.919  -0.653
  145    HB2  GLU  20           HB1      GLU  20  13.418   9.052  -1.514
  146    HB3  GLU  20           HB2      GLU  20  12.127  10.227  -1.719
  147    HG2  GLU  20           HG1      GLU  20  14.898  10.536  -2.846
  148    HG3  GLU  20           HG2      GLU  20  13.521   9.892  -3.737
  149    H    ALA  21           HN       ALA  21  13.633   8.940   1.226
  150    HA   ALA  21           HA       ALA  21  11.034   9.315   2.291
  151    HB1  ALA  21           HB1      ALA  21  12.957   7.841   3.955
  152    HB2  ALA  21           HB2      ALA  21  11.377   7.355   3.338
  153    HB3  ALA  21           HB3      ALA  21  12.798   7.262   2.296
  154    H    PHE  22           HN       PHE  22  14.237  10.351   3.300
  155    HA   PHE  22           HA       PHE  22  13.519  11.222   5.896
  156    HB2  PHE  22           HB1      PHE  22  15.867  10.795   4.968
  157    HB3  PHE  22           HB2      PHE  22  15.749  12.394   4.242
  158    HD1  PHE  22           HD2      PHE  22  14.677  11.117   7.574
  159    HD2  PHE  22           HD1      PHE  22  17.172  13.789   5.394
  160    HE1  PHE  22           HE2      PHE  22  15.435  12.125   9.686
  161    HE2  PHE  22           HE1      PHE  22  17.935  14.802   7.503
  162    HZ   PHE  22           HZ       PHE  22  17.066  13.971   9.652
  163    H    SER  23           HN       SER  23  14.027  13.039   2.873
  164    HA   SER  23           HA       SER  23  13.339  15.558   3.820
  165    HB2  SER  23           HB1      SER  23  14.303  15.548   1.691
  166    HB3  SER  23           HB2      SER  23  13.222  14.285   1.101
  167    HG   SER  23           HG       SER  23  12.833  17.024   1.274
  168    H    ALA  24           HN       ALA  24  11.282  12.988   2.535
  169    HA   ALA  24           HA       ALA  24   8.872  14.400   2.418
  170    HB1  ALA  24           HB1      ALA  24   9.719  11.709   2.109
  171    HB2  ALA  24           HB2      ALA  24   8.317  11.724   3.180
  172    HB3  ALA  24           HB3      ALA  24   8.211  12.457   1.580
  173    H    GLY  25           HN       GLY  25  10.574  12.980   5.117
  174    HA2  GLY  25           HA1      GLY  25   8.352  13.062   6.929
  175    HA3  GLY  25           HA2      GLY  25  10.037  12.803   7.356
  176    H    VAL  26           HN       VAL  26  11.122  15.171   6.287
  177    HA   VAL  26           HA       VAL  26  10.833  16.936   8.414
  178    HB   VAL  26           HB       VAL  26  11.733  17.612   5.610
  179   HG11  VAL  26          HG11      VAL  26  11.658  19.695   6.462
  180   HG12  VAL  26          HG12      VAL  26  11.635  19.125   8.132
  181   HG13  VAL  26          HG13      VAL  26  13.160  19.214   7.250
  182   HG21  VAL  26          HG21      VAL  26  12.890  15.918   7.589
  183   HG22  VAL  26          HG22      VAL  26  13.521  16.354   6.002
  184   HG23  VAL  26          HG23      VAL  26  13.901  17.351   7.406
  185    H    HIS  27           HN       HIS  27   9.187  16.857   5.296
  186    HA   HIS  27           HA       HIS  27   7.891  19.352   5.505
  187    HB2  HIS  27           HB1      HIS  27   8.083  18.112   3.387
  188    HB3  HIS  27           HB2      HIS  27   7.006  16.869   4.017
  189    HD1  HIS  27           HD1      HIS  27   5.438  17.430   1.963
  190    HD2  HIS  27           HD2      HIS  27   5.879  20.480   4.750
  191    HE1  HIS  27           HE1      HIS  27   3.580  19.055   1.481
  192    H    ARG  28           HN       ARG  28   6.986  16.106   6.556
  193    HA   ARG  28           HA       ARG  28   4.350  16.782   7.366
  194    HB2  ARG  28           HB1      ARG  28   5.207  14.460   6.886
  195    HB3  ARG  28           HB2      ARG  28   6.050  14.524   8.427
  196    HG2  ARG  28           HG1      ARG  28   3.987  14.679   9.626
  197    HG3  ARG  28           HG2      ARG  28   3.075  14.850   8.125
  198    HD2  ARG  28           HD1      ARG  28   2.755  12.625   8.513
  199    HD3  ARG  28           HD2      ARG  28   4.241  12.548   7.568
  200    HE   ARG  28           HE       ARG  28   5.291  11.705   9.405
  201   HH11  ARG  28          HH11      ARG  28   2.427  13.390  10.444
  202   HH12  ARG  28          HH12      ARG  28   2.601  12.929  12.105
  203   HH21  ARG  28          HH21      ARG  28   5.531  11.093  11.589
  204   HH22  ARG  28          HH22      ARG  28   4.367  11.624  12.756
  205    H    LEU  29           HN       LEU  29   7.459  16.657   9.033
  206    HA   LEU  29           HA       LEU  29   6.487  17.080  11.642
  207    HB2  LEU  29           HB1      LEU  29   9.112  17.364  10.279
  208    HB3  LEU  29           HB2      LEU  29   8.911  18.128  11.854
  209    HG   LEU  29           HG       LEU  29   8.360  15.206  11.396
  210   HD11  LEU  29          HD11      LEU  29  10.926  16.348  12.469
  211   HD12  LEU  29          HD12      LEU  29  10.718  15.873  10.784
  212   HD13  LEU  29          HD13      LEU  29  10.560  14.671  12.064
  213   HD21  LEU  29          HD21      LEU  29   7.382  15.882  13.402
  214   HD22  LEU  29          HD22      LEU  29   8.704  16.984  13.787
  215   HD23  LEU  29          HD23      LEU  29   8.949  15.240  13.894
  216    H    ALA  30           HN       ALA  30   7.454  19.303   9.079
  217    HA   ALA  30           HA       ALA  30   7.418  21.684  10.550
  218    HB1  ALA  30           HB1      ALA  30   8.051  21.077   8.017
  219    HB2  ALA  30           HB2      ALA  30   6.469  21.811   7.756
  220    HB3  ALA  30           HB3      ALA  30   7.741  22.723   8.568
  221    H    ASN  31           HN       ASN  31   4.827  19.821   9.095
  222    HA   ASN  31           HA       ASN  31   2.853  21.880   9.605
  223    HB2  ASN  31           HB1      ASN  31   2.825  19.174   8.327
  224    HB3  ASN  31           HB2      ASN  31   1.306  19.871   8.883
  225   HD21  ASN  31          HD21      ASN  31   2.390  19.281   6.176
  226   HD22  ASN  31          HD22      ASN  31   2.243  20.765   5.305
  227    H    GLY  32           HN       GLY  32   2.923  18.423  10.492
  228    HA2  GLY  32           HA1      GLY  32   1.150  18.734  12.667
  229    HA3  GLY  32           HA2      GLY  32   2.179  17.340  12.375
  230    H    GLY  33           HN       GLY  33   3.911  17.015  13.653
  231    HA2  GLY  33           HA1      GLY  33   5.691  18.601  14.816
  232    HA3  GLY  33           HA2      GLY  33   4.298  18.902  15.845
  233    H    ASN  34           HN       ASN  34   3.460  17.188  17.121
  234    HA   ASN  34           HA       ASN  34   5.512  15.252  17.856
  235    HB2  ASN  34           HB1      ASN  34   4.371  16.680  19.582
  236    HB3  ASN  34           HB2      ASN  34   2.881  15.806  19.238
  237   HD21  ASN  34          HD21      ASN  34   2.536  14.633  21.000
  238   HD22  ASN  34          HD22      ASN  34   3.666  13.534  21.707
  239    H    GLY  35           HN       GLY  35   2.194  15.377  16.673
  240    HA2  GLY  35           HA1      GLY  35   1.276  13.729  15.238
  241    HA3  GLY  35           HA2      GLY  35   2.452  12.576  15.852
  242    H    PHE  36           HN       PHE  36   0.197  14.681  17.608
  243    HA   PHE  36           HA       PHE  36  -0.749  12.342  19.076
  244    HB2  PHE  36           HB1      PHE  36  -1.660  13.896  20.675
  245    HB3  PHE  36           HB2      PHE  36  -0.018  14.403  20.292
  246    HD1  PHE  36           HD1      PHE  36   0.380  16.393  18.925
  247    HD2  PHE  36           HD2      PHE  36  -3.546  15.241  20.097
  248    HE1  PHE  36           HE1      PHE  36  -0.448  18.637  18.345
  249    HE2  PHE  36           HE2      PHE  36  -4.381  17.482  19.518
  250    HZ   PHE  36           HZ       PHE  36  -2.832  19.183  18.640
  251    H    TRP  37           HN       TRP  37  -1.848  14.753  16.806
  252    HA   TRP  37           HA       TRP  37  -4.613  13.848  17.018
  253    HB2  TRP  37           HB1      TRP  37  -3.892  16.304  16.758
  254    HB3  TRP  37           HB2      TRP  37  -3.574  15.901  15.073
  255    HD1  TRP  37           HD1      TRP  37  -6.417  16.518  17.520
  256    HE1  TRP  37           HE1      TRP  37  -8.631  16.655  16.215
  257    HE3  TRP  37           HE3      TRP  37  -4.748  15.005  12.931
  258    HZ2  TRP  37           HZ2      TRP  37  -9.549  16.182  13.588
  259    HZ3  TRP  37           HZ3      TRP  37  -6.358  14.873  11.075
  260    HH2  TRP  37           HH2      TRP  37  -8.709  15.450  11.399
  Start of MODEL   11
    1    H1   LYS   1           HN       LYS   1   2.531  -4.248  -2.204
    2    HA   LYS   1           HA       LYS   1   3.906  -1.860  -3.081
    3    HB2  LYS   1           HB1      LYS   1   1.718  -2.607  -4.040
    4    HB3  LYS   1           HB2      LYS   1   0.966  -2.243  -2.493
    5    HG2  LYS   1           HG1      LYS   1   0.575  -0.424  -3.999
    6    HG3  LYS   1           HG2      LYS   1   1.691   0.109  -2.740
    7    HD2  LYS   1           HD1      LYS   1   3.476   0.224  -4.182
    8    HD3  LYS   1           HD2      LYS   1   2.810  -0.993  -5.273
    9    HE2  LYS   1           HE1      LYS   1   1.479   1.671  -4.947
   10    HE3  LYS   1           HE2      LYS   1   2.858   1.480  -6.028
   11    HZ1  LYS   1           HZ1      LYS   1   1.524   0.628  -7.554
   12    HZ2  LYS   1           HZ2      LYS   1   0.191   0.882  -6.545
   13    HZ3  LYS   1           HZ3      LYS   1   1.017  -0.594  -6.499
   14    H    TYR   2           HN       TYR   2   5.064  -1.027  -1.390
   15    HA   TYR   2           HA       TYR   2   5.508   0.033   0.576
   16    HB2  TYR   2           HB1      TYR   2   2.704   0.937  -0.035
   17    HB3  TYR   2           HB2      TYR   2   3.549   1.504   1.402
   18    HD1  TYR   2           HD2      TYR   2   5.464   2.995   1.213
   19    HD2  TYR   2           HD1      TYR   2   3.397   1.642  -2.251
   20    HE1  TYR   2           HE2      TYR   2   6.567   4.742  -0.121
   21    HE2  TYR   2           HE1      TYR   2   4.496   3.385  -3.595
   22    HH   TYR   2           HH       TYR   2   6.491   4.775  -3.530
   23    H    TYR   3           HN       TYR   3   4.847  -2.655   0.879
   24    HA   TYR   3           HA       TYR   3   2.976  -2.898   3.075
   25    HB2  TYR   3           HB1      TYR   3   3.209  -4.656   1.315
   26    HB3  TYR   3           HB2      TYR   3   4.826  -4.994   1.921
   27    HD1  TYR   3           HD2      TYR   3   1.233  -5.261   2.625
   28    HD2  TYR   3           HD1      TYR   3   5.154  -6.188   3.994
   29    HE1  TYR   3           HE2      TYR   3   0.284  -6.835   4.259
   30    HE2  TYR   3           HE1      TYR   3   4.215  -7.766   5.631
   31    HH   TYR   3           HH       TYR   3   2.376  -8.758   6.387
   32    H    GLY   4           HN       GLY   4   6.460  -2.930   2.567
   33    HA2  GLY   4           HA1      GLY   4   7.401  -1.885   4.807
   34    HA3  GLY   4           HA2      GLY   4   6.939  -3.475   5.396
   35    H    ASN   5           HN       ASN   5   7.816  -5.329   3.993
   36    HA   ASN   5           HA       ASN   5  10.661  -5.082   3.957
   37    HB2  ASN   5           HB1      ASN   5   8.750  -7.300   3.252
   38    HB3  ASN   5           HB2      ASN   5  10.483  -7.462   2.986
   39   HD21  ASN   5          HD21      ASN   5   8.056  -8.090   5.087
   40   HD22  ASN   5          HD22      ASN   5   8.961  -8.223   6.552
   41    H    GLY   6           HN       GLY   6  10.900  -3.379   2.379
   42    HA2  GLY   6           HA1      GLY   6  10.286  -4.097  -0.392
   43    HA3  GLY   6           HA2      GLY   6  10.815  -2.521   0.177
   44    H    VAL   7           HN       VAL   7  11.884  -5.817  -0.492
   45    HA   VAL   7           HA       VAL   7  14.649  -5.337  -0.134
   46    HB   VAL   7           HB       VAL   7  14.981  -7.411  -1.454
   47   HG11  VAL   7          HG11      VAL   7  12.753  -8.094   0.372
   48   HG12  VAL   7          HG12      VAL   7  14.394  -8.740   0.289
   49   HG13  VAL   7          HG13      VAL   7  14.097  -7.179   1.055
   50   HG21  VAL   7          HG21      VAL   7  13.249  -7.261  -3.079
   51   HG22  VAL   7          HG22      VAL   7  12.908  -8.681  -2.091
   52   HG23  VAL   7          HG23      VAL   7  12.001  -7.191  -1.835
   53    H    HIS   8           HN       HIS   8  12.519  -5.151  -2.946
   54    HA   HIS   8           HA       HIS   8  14.611  -4.626  -4.814
   55    HB2  HIS   8           HB1      HIS   8  11.615  -4.418  -4.900
   56    HB3  HIS   8           HB2      HIS   8  12.595  -3.794  -6.224
   57    HD1  HIS   8           HD1      HIS   8  11.204  -6.896  -4.837
   58    HD2  HIS   8           HD2      HIS   8  14.119  -5.823  -7.596
   59    HE1  HIS   8           HE1      HIS   8  11.690  -8.986  -6.148
   60    H    LEU   9           HN       LEU   9  12.575  -2.662  -2.764
   61    HA   LEU   9           HA       LEU   9  12.986  -0.173  -4.004
   62    HB2  LEU   9           HB1      LEU   9  11.259  -0.226  -2.455
   63    HB3  LEU   9           HB2      LEU   9  12.245  -1.035  -1.239
   64    HG   LEU   9           HG       LEU   9  13.015   1.727  -2.009
   65   HD11  LEU   9          HD11      LEU   9  10.891   2.429  -1.719
   66   HD12  LEU   9          HD12      LEU   9  11.311   2.284  -0.013
   67   HD13  LEU   9          HD13      LEU   9  10.420   0.990  -0.814
   68   HD21  LEU   9          HD21      LEU   9  14.356   1.304  -0.286
   69   HD22  LEU   9          HD22      LEU   9  13.471  -0.165   0.127
   70   HD23  LEU   9          HD23      LEU   9  12.932   1.395   0.751
   71    H    THR  10           HN       THR  10  15.038  -2.131  -2.055
   72    HA   THR  10           HA       THR  10  16.759  -0.105  -1.065
   73    HB   THR  10           HB       THR  10  17.594  -2.949  -1.614
   74    HG1  THR  10           HG1      THR  10  16.127  -3.544  -0.222
   75   HG21  THR  10          HG21      THR  10  19.248  -2.616  -0.054
   76   HG22  THR  10          HG22      THR  10  18.341  -1.368   0.801
   77   HG23  THR  10          HG23      THR  10  19.129  -0.993  -0.732
   78    H    LYS  11           HN       LYS  11  17.348  -2.508  -3.640
   79    HA   LYS  11           HA       LYS  11  19.624  -1.137  -4.648
   80    HB2  LYS  11           HB1      LYS  11  17.919  -3.394  -5.665
   81    HB3  LYS  11           HB2      LYS  11  19.189  -2.702  -6.667
   82    HG2  LYS  11           HG1      LYS  11  20.122  -3.331  -3.995
   83    HG3  LYS  11           HG2      LYS  11  19.471  -4.741  -4.833
   84    HD2  LYS  11           HD1      LYS  11  21.302  -2.950  -6.341
   85    HD3  LYS  11           HD2      LYS  11  22.003  -3.988  -5.098
   86    HE2  LYS  11           HE1      LYS  11  20.788  -5.910  -6.197
   87    HE3  LYS  11           HE2      LYS  11  20.425  -4.810  -7.526
   88    HZ1  LYS  11           HZ1      LYS  11  23.185  -4.731  -6.872
   89    HZ2  LYS  11           HZ2      LYS  11  22.448  -5.100  -8.349
   90    HZ3  LYS  11           HZ3      LYS  11  22.704  -6.319  -7.204
   91    H    SER  12           HN       SER  12  16.214  -0.953  -5.286
   92    HA   SER  12           HA       SER  12  16.301   0.262  -7.826
   93    HB2  SER  12           HB1      SER  12  14.221  -0.646  -7.056
   94    HB3  SER  12           HB2      SER  12  14.239   0.374  -5.617
   95    HG   SER  12           HG       SER  12  13.235   1.807  -6.759
   96    H    GLY  13           HN       GLY  13  16.888   1.477  -4.640
   97    HA2  GLY  13           HA1      GLY  13  18.273   3.679  -5.099
   98    HA3  GLY  13           HA2      GLY  13  16.666   4.259  -5.509
   99    H    LEU  14           HN       LEU  14  18.135   2.330  -2.890
  100    HA   LEU  14           HA       LEU  14  16.330   3.035  -0.902
  101    HB2  LEU  14           HB1      LEU  14  17.807   2.099   0.624
  102    HB3  LEU  14           HB2      LEU  14  18.180   1.268  -0.885
  103    HG   LEU  14           HG       LEU  14  19.778   3.580   0.208
  104   HD11  LEU  14          HD11      LEU  14  20.047   1.835   1.777
  105   HD12  LEU  14          HD12      LEU  14  21.458   1.768   0.721
  106   HD13  LEU  14          HD13      LEU  14  20.143   0.611   0.511
  107   HD21  LEU  14          HD21      LEU  14  19.906   1.881  -2.209
  108   HD22  LEU  14          HD22      LEU  14  21.436   2.248  -1.412
  109   HD23  LEU  14          HD23      LEU  14  20.396   3.558  -1.971
  110    H    SER  15           HN       SER  15  18.954   4.835  -2.264
  111    HA   SER  15           HA       SER  15  19.275   6.692  -0.129
  112    HB2  SER  15           HB1      SER  15  20.073   6.722  -3.036
  113    HB3  SER  15           HB2      SER  15  20.386   8.091  -1.970
  114    HG   SER  15           HG       SER  15  21.750   5.795  -2.205
  115    H    VAL  16           HN       VAL  16  17.632   6.906  -3.282
  116    HA   VAL  16           HA       VAL  16  16.515   9.471  -2.786
  117    HB   VAL  16           HB       VAL  16  16.832   8.597  -5.063
  118   HG11  VAL  16          HG11      VAL  16  16.318   6.292  -4.823
  119   HG12  VAL  16          HG12      VAL  16  14.691   6.647  -4.239
  120   HG13  VAL  16          HG13      VAL  16  15.115   6.967  -5.921
  121   HG21  VAL  16          HG21      VAL  16  13.887   9.008  -4.697
  122   HG22  VAL  16          HG22      VAL  16  15.029  10.311  -4.366
  123   HG23  VAL  16          HG23      VAL  16  14.944   9.601  -5.979
  124    H    ASN  17           HN       ASN  17  15.557   6.241  -1.987
  125    HA   ASN  17           HA       ASN  17  12.789   6.730  -1.594
  126    HB2  ASN  17           HB1      ASN  17  13.504   4.464  -1.868
  127    HB3  ASN  17           HB2      ASN  17  14.646   4.597  -0.534
  128   HD21  ASN  17          HD21      ASN  17  14.016   3.717   1.288
  129   HD22  ASN  17          HD22      ASN  17  12.382   3.477   1.795
  130    H    TRP  18           HN       TRP  18  15.524   6.535   0.677
  131    HA   TRP  18           HA       TRP  18  14.135   7.072   3.021
  132    HB2  TRP  18           HB1      TRP  18  16.550   6.360   2.807
  133    HB3  TRP  18           HB2      TRP  18  16.936   8.036   2.423
  134    HD1  TRP  18           HD1      TRP  18  17.915   9.197   4.469
  135    HE1  TRP  18           HE1      TRP  18  17.486   9.158   7.007
  136    HE3  TRP  18           HE3      TRP  18  14.208   5.680   4.613
  137    HZ2  TRP  18           HZ2      TRP  18  15.801   7.814   8.828
  138    HZ3  TRP  18           HZ3      TRP  18  13.241   5.073   6.793
  139    HH2  TRP  18           HH2      TRP  18  14.023   6.119   8.856
  140    H    GLY  19           HN       GLY  19  15.672   9.349   0.762
  141    HA2  GLY  19           HA1      GLY  19  15.137  11.702   2.181
  142    HA3  GLY  19           HA2      GLY  19  15.365  11.600   0.441
  143    H    GLU  20           HN       GLU  20  13.221  10.134  -0.377
  144    HA   GLU  20           HA       GLU  20  11.158  12.051  -0.403
  145    HB2  GLU  20           HB1      GLU  20  11.501   9.276  -1.415
  146    HB3  GLU  20           HB2      GLU  20   9.856   9.883  -1.277
  147    HG2  GLU  20           HG1      GLU  20  11.919  11.533  -2.656
  148    HG3  GLU  20           HG2      GLU  20  11.187  10.167  -3.494
  149    H    ALA  21           HN       ALA  21  11.499   8.976   1.329
  150    HA   ALA  21           HA       ALA  21   8.954   8.997   2.541
  151    HB1  ALA  21           HB1      ALA  21  10.959   7.705   4.172
  152    HB2  ALA  21           HB2      ALA  21   9.593   7.007   3.301
  153    HB3  ALA  21           HB3      ALA  21  11.127   7.269   2.472
  154    H    PHE  22           HN       PHE  22  12.074  10.313   3.532
  155    HA   PHE  22           HA       PHE  22  11.453  10.981   6.168
  156    HB2  PHE  22           HB1      PHE  22  13.710  11.108   4.891
  157    HB3  PHE  22           HB2      PHE  22  13.192  12.733   4.454
  158    HD1  PHE  22           HD1      PHE  22  13.950  10.517   7.314
  159    HD2  PHE  22           HD2      PHE  22  13.374  14.515   5.971
  160    HE1  PHE  22           HE1      PHE  22  14.791  11.358   9.468
  161    HE2  PHE  22           HE2      PHE  22  14.216  15.362   8.122
  162    HZ   PHE  22           HZ       PHE  22  14.926  13.784   9.874
  163    H    SER  23           HN       SER  23  11.225  13.005   3.244
  164    HA   SER  23           HA       SER  23  10.184  15.289   4.439
  165    HB2  SER  23           HB1      SER  23   9.404  15.920   2.216
  166    HB3  SER  23           HB2      SER  23  10.998  15.176   2.099
  167    HG   SER  23           HG       SER  23   9.841  14.173   0.559
  168    H    ALA  24           HN       ALA  24   8.478  12.496   3.065
  169    HA   ALA  24           HA       ALA  24   5.865  13.393   3.387
  170    HB1  ALA  24           HB1      ALA  24   7.122  11.002   2.629
  171    HB2  ALA  24           HB2      ALA  24   6.012  10.582   3.934
  172    HB3  ALA  24           HB3      ALA  24   5.411  11.411   2.498
  173    H    GLY  25           HN       GLY  25   8.116  12.101   5.727
  174    HA2  GLY  25           HA1      GLY  25   6.195  11.554   7.764
  175    HA3  GLY  25           HA2      GLY  25   7.932  11.701   7.988
  176    H    VAL  26           HN       VAL  26   8.204  14.352   6.987
  177    HA   VAL  26           HA       VAL  26   7.731  15.829   9.324
  178    HB   VAL  26           HB       VAL  26   8.212  16.917   6.547
  179   HG11  VAL  26          HG11      VAL  26   7.818  18.861   7.594
  180   HG12  VAL  26          HG12      VAL  26   7.971  18.141   9.198
  181   HG13  VAL  26          HG13      VAL  26   9.414  18.618   8.303
  182   HG21  VAL  26          HG21      VAL  26   9.879  15.317   8.174
  183   HG22  VAL  26          HG22      VAL  26  10.287  16.135   6.666
  184   HG23  VAL  26          HG23      VAL  26  10.529  16.956   8.208
  185    H    HIS  27           HN       HIS  27   5.872  15.482   6.364
  186    HA   HIS  27           HA       HIS  27   4.076  17.612   6.770
  187    HB2  HIS  27           HB1      HIS  27   4.422  16.267   4.641
  188    HB3  HIS  27           HB2      HIS  27   3.414  15.020   5.371
  189    HD1  HIS  27           HD1      HIS  27   0.940  16.008   6.157
  190    HD2  HIS  27           HD2      HIS  27   3.010  18.057   3.194
  191    HE1  HIS  27           HE1      HIS  27  -0.784  17.409   4.980
  192    H    ARG  28           HN       ARG  28   3.954  14.206   7.732
  193    HA   ARG  28           HA       ARG  28   1.356  14.309   8.855
  194    HB2  ARG  28           HB1      ARG  28   3.676  12.423   9.095
  195    HB3  ARG  28           HB2      ARG  28   2.277  12.236  10.144
  196    HG2  ARG  28           HG1      ARG  28   0.833  12.023   8.183
  197    HG3  ARG  28           HG2      ARG  28   2.240  12.205   7.133
  198    HD2  ARG  28           HD1      ARG  28   3.225  10.189   8.195
  199    HD3  ARG  28           HD2      ARG  28   1.731   9.986   9.111
  200    HE   ARG  28           HE       ARG  28   0.859  10.063   6.563
  201   HH11  ARG  28          HH11      ARG  28   3.354   8.230   8.154
  202   HH12  ARG  28          HH12      ARG  28   3.199   6.860   7.104
  203   HH21  ARG  28          HH21      ARG  28   0.645   8.266   5.174
  204   HH22  ARG  28          HH22      ARG  28   1.659   6.883   5.408
  205    H    LEU  29           HN       LEU  29   4.578  14.865  10.159
  206    HA   LEU  29           HA       LEU  29   3.917  14.941  12.882
  207    HB2  LEU  29           HB1      LEU  29   6.118  16.051  11.215
  208    HB3  LEU  29           HB2      LEU  29   5.950  16.620  12.874
  209    HG   LEU  29           HG       LEU  29   6.118  13.689  12.268
  210   HD11  LEU  29          HD11      LEU  29   8.394  15.644  12.506
  211   HD12  LEU  29          HD12      LEU  29   8.050  14.540  11.175
  212   HD13  LEU  29          HD13      LEU  29   8.571  13.904  12.735
  213   HD21  LEU  29          HD21      LEU  29   5.627  15.066  14.566
  214   HD22  LEU  29          HD22      LEU  29   7.375  14.845  14.649
  215   HD23  LEU  29          HD23      LEU  29   6.315  13.444  14.488
  216    H    ALA  30           HN       ALA  30   4.077  17.550  10.475
  217    HA   ALA  30           HA       ALA  30   3.404  19.662  12.191
  218    HB1  ALA  30           HB1      ALA  30   4.142  19.504   9.604
  219    HB2  ALA  30           HB2      ALA  30   2.423  19.853   9.421
  220    HB3  ALA  30           HB3      ALA  30   3.452  20.950  10.342
  221    H    ASN  31           HN       ASN  31   1.360  17.555  10.199
  222    HA   ASN  31           HA       ASN  31  -1.048  18.820  11.230
  223    HB2  ASN  31           HB1      ASN  31  -0.822  18.130   8.822
  224    HB3  ASN  31           HB2      ASN  31  -0.831  16.453   9.361
  225   HD21  ASN  31          HD21      ASN  31  -2.700  19.315   8.866
  226   HD22  ASN  31          HD22      ASN  31  -4.251  18.602   9.131
  227    H    GLY  32           HN       GLY  32  -0.322  18.074  13.453
  228    HA2  GLY  32           HA1      GLY  32  -1.975  15.940  14.289
  229    HA3  GLY  32           HA2      GLY  32  -0.305  15.396  14.235
  230    H    GLY  33           HN       GLY  33   1.272  16.951  15.360
  231    HA2  GLY  33           HA1      GLY  33   1.706  18.462  17.139
  232    HA3  GLY  33           HA2      GLY  33   0.046  18.260  17.680
  233    H    ASN  34           HN       ASN  34   2.019  15.513  16.843
  234    HA   ASN  34           HA       ASN  34   1.785  14.541  19.572
  235    HB2  ASN  34           HB1      ASN  34   2.405  13.328  16.921
  236    HB3  ASN  34           HB2      ASN  34   3.039  12.526  18.355
  237   HD21  ASN  34          HD21      ASN  34   1.678  11.440  19.691
  238   HD22  ASN  34          HD22      ASN  34  -0.002  11.203  19.361
  239    H    GLY  35           HN       GLY  35   3.319  16.385  20.170
  240    HA2  GLY  35           HA1      GLY  35   5.497  15.908  21.389
  241    HA3  GLY  35           HA2      GLY  35   6.120  15.537  19.789
  242    H    PHE  36           HN       PHE  36   6.103  17.289  18.190
  243    HA   PHE  36           HA       PHE  36   6.832  19.805  19.475
  244    HB2  PHE  36           HB1      PHE  36   7.335  18.616  16.762
  245    HB3  PHE  36           HB2      PHE  36   7.567  20.339  17.040
  246    HD1  PHE  36           HD1      PHE  36   8.979  20.848  19.262
  247    HD2  PHE  36           HD2      PHE  36   9.177  17.275  16.958
  248    HE1  PHE  36           HE1      PHE  36  11.228  20.402  20.153
  249    HE2  PHE  36           HE2      PHE  36  11.426  16.823  17.846
  250    HZ   PHE  36           HZ       PHE  36  12.455  18.387  19.446
  251    H    TRP  37           HN       TRP  37   5.535  21.512  19.495
  252    HA   TRP  37           HA       TRP  37   3.807  22.923  19.056
  253    HB2  TRP  37           HB1      TRP  37   5.027  22.711  16.728
  254    HB3  TRP  37           HB2      TRP  37   3.553  21.862  16.270
  255    HD1  TRP  37           HD1      TRP  37   3.860  25.050  18.456
  256    HE1  TRP  37           HE1      TRP  37   2.449  26.901  17.358
  257    HE3  TRP  37           HE3      TRP  37   2.386  22.556  14.244
  258    HZ2  TRP  37           HZ2      TRP  37   0.913  27.257  15.016
  259    HZ3  TRP  37           HZ3      TRP  37   0.946  23.723  12.625
  260    HH2  TRP  37           HH2      TRP  37   0.226  26.024  13.005
  Start of MODEL   12
    1    H1   LYS   1           HN       LYS   1   4.038   0.950  -6.143
    2    HA   LYS   1           HA       LYS   1   1.704   1.475  -4.423
    3    HB2  LYS   1           HB1      LYS   1   0.465   0.127  -6.206
    4    HB3  LYS   1           HB2      LYS   1   0.990   1.746  -6.649
    5    HG2  LYS   1           HG1      LYS   1   2.811  -0.516  -7.258
    6    HG3  LYS   1           HG2      LYS   1   1.354  -0.331  -8.238
    7    HD2  LYS   1           HD1      LYS   1   3.021   2.081  -7.741
    8    HD3  LYS   1           HD2      LYS   1   3.631   0.870  -8.871
    9    HE2  LYS   1           HE1      LYS   1   0.814   1.831  -9.115
   10    HE3  LYS   1           HE2      LYS   1   2.129   2.839  -9.716
   11    HZ1  LYS   1           HZ1      LYS   1   2.534   0.210 -10.603
   12    HZ2  LYS   1           HZ2      LYS   1   2.221   1.593 -11.525
   13    HZ3  LYS   1           HZ3      LYS   1   0.938   0.645 -10.962
   14    H    TYR   2           HN       TYR   2   4.040  -0.872  -5.461
   15    HA   TYR   2           HA       TYR   2   2.673  -3.123  -4.294
   16    HB2  TYR   2           HB1      TYR   2   5.399  -2.736  -5.513
   17    HB3  TYR   2           HB2      TYR   2   4.950  -4.241  -4.719
   18    HD1  TYR   2           HD2      TYR   2   4.266  -2.036  -7.585
   19    HD2  TYR   2           HD1      TYR   2   3.434  -5.787  -5.756
   20    HE1  TYR   2           HE2      TYR   2   3.210  -2.811  -9.667
   21    HE2  TYR   2           HE1      TYR   2   2.377  -6.572  -7.833
   22    HH   TYR   2           HH       TYR   2   2.402  -6.083 -10.210
   23    H    TYR   3           HN       TYR   3   4.187  -4.544  -2.797
   24    HA   TYR   3           HA       TYR   3   5.633  -2.974  -0.834
   25    HB2  TYR   3           HB1      TYR   3   4.204  -3.994   1.029
   26    HB3  TYR   3           HB2      TYR   3   3.499  -2.663   0.119
   27    HD1  TYR   3           HD1      TYR   3   1.726  -3.110  -1.552
   28    HD2  TYR   3           HD2      TYR   3   3.245  -6.181   0.970
   29    HE1  TYR   3           HE1      TYR   3  -0.235  -4.500  -2.074
   30    HE2  TYR   3           HE2      TYR   3   1.289  -7.581   0.454
   31    HH   TYR   3           HH       TYR   3  -1.487  -6.440  -0.876
   32    H    GLY   4           HN       GLY   4   7.430  -4.103  -0.531
   33    HA2  GLY   4           HA1      GLY   4   7.252  -7.051  -0.556
   34    HA3  GLY   4           HA2      GLY   4   8.675  -6.139  -1.036
   35    H    ASN   5           HN       ASN   5   9.605  -7.758   0.540
   36    HA   ASN   5           HA       ASN   5   9.108  -7.386   3.327
   37    HB2  ASN   5           HB1      ASN   5   9.920  -9.521   2.695
   38    HB3  ASN   5           HB2      ASN   5  11.255  -8.829   1.778
   39   HD21  ASN   5          HD21      ASN   5  13.159  -8.713   2.734
   40   HD22  ASN   5          HD22      ASN   5  13.448  -8.876   4.430
   41    H    GLY   6           HN       GLY   6  11.228  -5.935   0.988
   42    HA2  GLY   6           HA1      GLY   6  11.907  -3.624   1.767
   43    HA3  GLY   6           HA2      GLY   6  12.587  -4.459   3.155
   44    H    VAL   7           HN       VAL   7  13.324  -6.700   1.189
   45    HA   VAL   7           HA       VAL   7  16.008  -5.895   0.793
   46    HB   VAL   7           HB       VAL   7  15.454  -8.237   1.109
   47   HG11  VAL   7          HG11      VAL   7  14.365  -8.553  -1.626
   48   HG12  VAL   7          HG12      VAL   7  13.996  -9.442  -0.146
   49   HG13  VAL   7          HG13      VAL   7  13.298  -7.844  -0.414
   50   HG21  VAL   7          HG21      VAL   7  17.486  -7.661  -0.144
   51   HG22  VAL   7          HG22      VAL   7  16.806  -9.202  -0.668
   52   HG23  VAL   7          HG23      VAL   7  16.575  -7.757  -1.651
   53    H    HIS   8           HN       HIS   8  13.222  -6.146  -1.366
   54    HA   HIS   8           HA       HIS   8  14.681  -5.513  -3.736
   55    HB2  HIS   8           HB1      HIS   8  11.769  -5.685  -3.031
   56    HB3  HIS   8           HB2      HIS   8  12.264  -4.997  -4.575
   57    HD1  HIS   8           HD1      HIS   8  14.466  -6.897  -5.420
   58    HD2  HIS   8           HD2      HIS   8  10.905  -8.164  -3.695
   59    HE1  HIS   8           HE1      HIS   8  14.185  -9.291  -6.138
   60    H    LEU   9           HN       LEU   9  13.002  -3.658  -1.295
   61    HA   LEU   9           HA       LEU   9  12.757  -1.230  -2.687
   62    HB2  LEU   9           HB1      LEU   9  11.513  -1.377  -0.732
   63    HB3  LEU   9           HB2      LEU   9  12.879  -1.978   0.206
   64    HG   LEU   9           HG       LEU   9  13.053   0.794  -0.844
   65   HD11  LEU   9          HD11      LEU   9  11.445   1.712   0.420
   66   HD12  LEU   9          HD12      LEU   9  11.691   0.574   1.744
   67   HD13  LEU   9          HD13      LEU   9  10.715   0.108   0.351
   68   HD21  LEU   9          HD21      LEU   9  14.842   0.645   0.469
   69   HD22  LEU   9          HD22      LEU   9  14.288  -0.876   1.168
   70   HD23  LEU   9          HD23      LEU   9  13.738   0.658   1.844
   71    H    THR  10           HN       THR  10  15.479  -2.802  -1.286
   72    HA   THR  10           HA       THR  10  17.123  -0.529  -0.863
   73    HB   THR  10           HB       THR  10  18.071  -3.331  -1.477
   74    HG1  THR  10           HG1      THR  10  17.650  -3.846   0.584
   75   HG21  THR  10          HG21      THR  10  20.118  -2.642  -0.875
   76   HG22  THR  10          HG22      THR  10  19.500  -1.733   0.504
   77   HG23  THR  10          HG23      THR  10  19.500  -1.007  -1.103
   78    H    LYS  11           HN       LYS  11  17.327  -3.019  -3.414
   79    HA   LYS  11           HA       LYS  11  19.066  -1.468  -5.040
   80    HB2  LYS  11           HB1      LYS  11  17.520  -4.003  -5.400
   81    HB3  LYS  11           HB2      LYS  11  18.221  -3.223  -6.812
   82    HG2  LYS  11           HG1      LYS  11  19.991  -4.508  -6.311
   83    HG3  LYS  11           HG2      LYS  11  20.350  -3.213  -5.166
   84    HD2  LYS  11           HD1      LYS  11  20.528  -5.236  -3.951
   85    HD3  LYS  11           HD2      LYS  11  18.991  -4.511  -3.472
   86    HE2  LYS  11           HE1      LYS  11  18.529  -6.793  -3.821
   87    HE3  LYS  11           HE2      LYS  11  17.918  -5.966  -5.253
   88    HZ1  LYS  11           HZ1      LYS  11  19.411  -8.108  -5.424
   89    HZ2  LYS  11           HZ2      LYS  11  20.662  -6.973  -5.330
   90    HZ3  LYS  11           HZ3      LYS  11  19.515  -6.867  -6.569
   91    H    SER  12           HN       SER  12  15.612  -1.732  -4.760
   92    HA   SER  12           HA       SER  12  14.882  -0.685  -7.272
   93    HB2  SER  12           HB1      SER  12  13.214  -1.786  -5.942
   94    HB3  SER  12           HB2      SER  12  13.456  -0.661  -4.605
   95    HG   SER  12           HG       SER  12  12.319   0.830  -5.628
   96    H    GLY  13           HN       GLY  13  16.101   0.800  -4.395
   97    HA2  GLY  13           HA1      GLY  13  17.017   3.116  -5.277
   98    HA3  GLY  13           HA2      GLY  13  15.295   3.471  -5.264
   99    H    LEU  14           HN       LEU  14  17.645   1.916  -3.072
  100    HA   LEU  14           HA       LEU  14  16.340   2.522  -0.697
  101    HB2  LEU  14           HB1      LEU  14  18.281   1.887   0.408
  102    HB3  LEU  14           HB2      LEU  14  18.355   1.005  -1.116
  103    HG   LEU  14           HG       LEU  14  19.851   3.567  -0.576
  104   HD11  LEU  14          HD11      LEU  14  21.493   2.435   0.407
  105   HD12  LEU  14          HD12      LEU  14  21.442   1.158  -0.807
  106   HD13  LEU  14          HD13      LEU  14  20.351   1.102   0.577
  107   HD21  LEU  14          HD21      LEU  14  19.575   1.726  -2.876
  108   HD22  LEU  14          HD22      LEU  14  21.193   2.340  -2.534
  109   HD23  LEU  14          HD23      LEU  14  19.868   3.465  -2.840
  110    H    SER  15           HN       SER  15  18.245   4.540  -2.766
  111    HA   SER  15           HA       SER  15  18.848   6.563  -0.853
  112    HB2  SER  15           HB1      SER  15  20.101   6.245  -2.987
  113    HB3  SER  15           HB2      SER  15  18.687   6.827  -3.864
  114    HG   SER  15           HG       SER  15  19.178   8.801  -3.327
  115    H    VAL  16           HN       VAL  16  16.436   6.366  -3.467
  116    HA   VAL  16           HA       VAL  16  15.141   8.795  -2.765
  117    HB   VAL  16           HB       VAL  16  14.983   7.822  -5.021
  118   HG11  VAL  16          HG11      VAL  16  13.390   5.689  -3.615
  119   HG12  VAL  16          HG12      VAL  16  13.351   5.944  -5.361
  120   HG13  VAL  16          HG13      VAL  16  14.860   5.489  -4.567
  121   HG21  VAL  16          HG21      VAL  16  12.207   7.906  -3.894
  122   HG22  VAL  16          HG22      VAL  16  13.213   9.353  -3.944
  123   HG23  VAL  16          HG23      VAL  16  12.798   8.516  -5.440
  124    H    ASN  17           HN       ASN  17  14.883   5.530  -1.647
  125    HA   ASN  17           HA       ASN  17  12.267   5.627  -0.587
  126    HB2  ASN  17           HB1      ASN  17  13.170   3.473  -0.800
  127    HB3  ASN  17           HB2      ASN  17  14.682   3.929  -0.020
  128   HD21  ASN  17          HD21      ASN  17  11.288   4.340   0.914
  129   HD22  ASN  17          HD22      ASN  17  11.431   3.529   2.434
  130    H    TRP  18           HN       TRP  18  15.442   6.187   0.915
  131    HA   TRP  18           HA       TRP  18  14.488   6.775   3.489
  132    HB2  TRP  18           HB1      TRP  18  16.923   6.355   2.586
  133    HB3  TRP  18           HB2      TRP  18  16.946   8.109   2.420
  134    HD1  TRP  18           HD1      TRP  18  15.405   8.885   5.086
  135    HE1  TRP  18           HE1      TRP  18  16.559   8.546   7.362
  136    HE3  TRP  18           HE3      TRP  18  18.886   5.399   3.721
  137    HZ2  TRP  18           HZ2      TRP  18  18.666   7.006   8.436
  138    HZ3  TRP  18           HZ3      TRP  18  20.433   4.544   5.433
  139    HH2  TRP  18           HH2      TRP  18  20.324   5.332   7.741
  140    H    GLY  19           HN       GLY  19  15.581   9.038   0.947
  141    HA2  GLY  19           HA1      GLY  19  14.913  11.410   2.200
  142    HA3  GLY  19           HA2      GLY  19  14.908  11.179   0.457
  143    H    GLU  20           HN       GLU  20  12.826   9.313   0.249
  144    HA   GLU  20           HA       GLU  20  10.586  11.036   0.256
  145    HB2  GLU  20           HB1      GLU  20  11.036   8.144  -0.333
  146    HB3  GLU  20           HB2      GLU  20   9.385   8.707  -0.113
  147    HG2  GLU  20           HG1      GLU  20  11.324   9.915  -2.068
  148    HG3  GLU  20           HG2      GLU  20  10.163   8.653  -2.475
  149    H    ALA  21           HN       ALA  21  11.490   8.295   2.319
  150    HA   ALA  21           HA       ALA  21   9.176   8.281   3.914
  151    HB1  ALA  21           HB1      ALA  21  11.646   7.510   5.285
  152    HB2  ALA  21           HB2      ALA  21  10.172   6.586   4.990
  153    HB3  ALA  21           HB3      ALA  21  11.399   6.716   3.730
  154    H    PHE  22           HN       PHE  22  12.149  10.141   4.102
  155    HA   PHE  22           HA       PHE  22  11.820  11.159   6.705
  156    HB2  PHE  22           HB1      PHE  22  13.935  11.278   5.409
  157    HB3  PHE  22           HB2      PHE  22  13.196  12.481   4.358
  158    HD1  PHE  22           HD2      PHE  22  14.420  11.816   7.761
  159    HD2  PHE  22           HD1      PHE  22  12.974  14.749   5.036
  160    HE1  PHE  22           HE2      PHE  22  15.143  13.595   9.298
  161    HE2  PHE  22           HE1      PHE  22  13.695  16.533   6.570
  162    HZ   PHE  22           HZ       PHE  22  14.779  15.957   8.704
  163    H    SER  23           HN       SER  23  10.939  12.533   3.544
  164    HA   SER  23           HA       SER  23   9.852  14.930   4.430
  165    HB2  SER  23           HB1      SER  23   9.085  13.219   2.056
  166    HB3  SER  23           HB2      SER  23   8.503  14.863   2.311
  167    HG   SER  23           HG       SER  23  10.296  15.510   1.456
  168    H    ALA  24           HN       ALA  24   8.394  11.729   4.213
  169    HA   ALA  24           HA       ALA  24   5.731  12.389   4.668
  170    HB1  ALA  24           HB1      ALA  24   7.249  10.036   4.502
  171    HB2  ALA  24           HB2      ALA  24   6.390   9.959   6.041
  172    HB3  ALA  24           HB3      ALA  24   5.492  10.186   4.541
  173    H    GLY  25           HN       GLY  25   8.159  11.385   7.091
  174    HA2  GLY  25           HA1      GLY  25   6.549  11.807   9.344
  175    HA3  GLY  25           HA2      GLY  25   8.306  11.803   9.342
  176    H    VAL  26           HN       VAL  26   8.738  14.015   7.652
  177    HA   VAL  26           HA       VAL  26   8.742  16.122   9.456
  178    HB   VAL  26           HB       VAL  26   8.780  16.296   6.440
  179   HG11  VAL  26          HG11      VAL  26   8.549  18.492   6.888
  180   HG12  VAL  26          HG12      VAL  26   9.037  18.307   8.574
  181   HG13  VAL  26          HG13      VAL  26  10.259  18.383   7.304
  182   HG21  VAL  26          HG21      VAL  26  10.595  15.068   8.132
  183   HG22  VAL  26          HG22      VAL  26  10.898  15.597   6.477
  184   HG23  VAL  26          HG23      VAL  26  11.300  16.656   7.829
  185    H    HIS  27           HN       HIS  27   6.297  15.145   7.152
  186    HA   HIS  27           HA       HIS  27   4.755  17.499   7.151
  187    HB2  HIS  27           HB1      HIS  27   4.551  15.536   5.560
  188    HB3  HIS  27           HB2      HIS  27   3.676  14.696   6.837
  189    HD1  HIS  27           HD1      HIS  27   3.395  18.011   4.980
  190    HD2  HIS  27           HD2      HIS  27   1.007  15.062   6.672
  191    HE1  HIS  27           HE1      HIS  27   1.027  18.687   4.468
  192    H    ARG  28           HN       ARG  28   4.642  14.610   9.196
  193    HA   ARG  28           HA       ARG  28   2.368  15.431  10.690
  194    HB2  ARG  28           HB1      ARG  28   4.461  13.320  10.987
  195    HB3  ARG  28           HB2      ARG  28   3.443  13.701  12.370
  196    HG2  ARG  28           HG1      ARG  28   2.165  13.154   9.735
  197    HG3  ARG  28           HG2      ARG  28   2.776  11.809  10.700
  198    HD2  ARG  28           HD1      ARG  28   0.907  13.908  11.779
  199    HD3  ARG  28           HD2      ARG  28   0.352  12.399  11.056
  200    HE   ARG  28           HE       ARG  28   2.102  11.580  12.953
  201   HH11  ARG  28          HH11      ARG  28  -0.670  13.685  12.987
  202   HH12  ARG  28          HH12      ARG  28  -1.093  13.316  14.626
  203   HH21  ARG  28          HH21      ARG  28   1.556  11.087  15.112
  204   HH22  ARG  28          HH22      ARG  28   0.175  11.839  15.834
  205    H    LEU  29           HN       LEU  29   5.767  16.094  10.902
  206    HA   LEU  29           HA       LEU  29   5.856  16.926  13.606
  207    HB2  LEU  29           HB1      LEU  29   7.744  16.415  11.835
  208    HB3  LEU  29           HB2      LEU  29   7.639  18.153  11.563
  209    HG   LEU  29           HG       LEU  29   8.333  16.780  14.159
  210   HD11  LEU  29          HD11      LEU  29  10.480  18.100  13.761
  211   HD12  LEU  29          HD12      LEU  29   9.928  18.262  12.094
  212   HD13  LEU  29          HD13      LEU  29  10.216  16.661  12.775
  213   HD21  LEU  29          HD21      LEU  29   8.013  19.701  13.489
  214   HD22  LEU  29          HD22      LEU  29   8.782  19.092  14.954
  215   HD23  LEU  29          HD23      LEU  29   7.075  18.763  14.651
  216    H    ALA  30           HN       ALA  30   5.542  18.755  10.570
  217    HA   ALA  30           HA       ALA  30   5.345  21.302  11.731
  218    HB1  ALA  30           HB1      ALA  30   5.480  20.370   9.188
  219    HB2  ALA  30           HB2      ALA  30   3.799  20.898   9.269
  220    HB3  ALA  30           HB3      ALA  30   5.099  22.036   9.623
  221    H    ASN  31           HN       ASN  31   3.025  18.745  11.369
  222    HA   ASN  31           HA       ASN  31   0.739  20.436  11.880
  223    HB2  ASN  31           HB1      ASN  31   0.514  18.452  10.447
  224    HB3  ASN  31           HB2      ASN  31   0.971  17.419  11.798
  225   HD21  ASN  31          HD21      ASN  31  -0.709  16.398  12.585
  226   HD22  ASN  31          HD22      ASN  31  -2.300  17.043  12.781
  227    H    GLY  32           HN       GLY  32   2.062  17.595  13.598
  228    HA2  GLY  32           HA1      GLY  32   2.378  18.739  16.092
  229    HA3  GLY  32           HA2      GLY  32   0.697  18.233  16.018
  230    H    GLY  33           HN       GLY  33   3.855  16.858  15.067
  231    HA2  GLY  33           HA1      GLY  33   2.953  14.210  15.816
  232    HA3  GLY  33           HA2      GLY  33   4.518  14.628  15.134
  233    H    ASN  34           HN       ASN  34   5.019  16.704  17.148
  234    HA   ASN  34           HA       ASN  34   5.988  14.929  19.241
  235    HB2  ASN  34           HB1      ASN  34   6.590  17.774  18.464
  236    HB3  ASN  34           HB2      ASN  34   7.135  17.114  20.004
  237   HD21  ASN  34          HD21      ASN  34   8.998  18.003  18.312
  238   HD22  ASN  34          HD22      ASN  34   9.865  16.691  17.597
  239    H    GLY  35           HN       GLY  35   4.447  18.154  19.205
  240    HA2  GLY  35           HA1      GLY  35   2.604  17.314  21.288
  241    HA3  GLY  35           HA2      GLY  35   3.775  18.532  21.769
  242    H    PHE  36           HN       PHE  36   3.305  20.608  21.402
  243    HA   PHE  36           HA       PHE  36   0.804  21.217  20.050
  244    HB2  PHE  36           HB1      PHE  36   2.692  22.942  21.664
  245    HB3  PHE  36           HB2      PHE  36   1.188  23.518  20.952
  246    HD1  PHE  36           HD2      PHE  36  -0.926  22.036  21.577
  247    HD2  PHE  36           HD1      PHE  36   2.658  22.290  23.859
  248    HE1  PHE  36           HE2      PHE  36  -2.154  21.309  23.581
  249    HE2  PHE  36           HE1      PHE  36   1.436  21.562  25.866
  250    HZ   PHE  36           HZ       PHE  36  -0.974  21.071  25.729
  251    H    TRP  37           HN       TRP  37   0.991  21.310  17.892
  252    HA   TRP  37           HA       TRP  37   1.617  22.004  15.820
  253    HB2  TRP  37           HB1      TRP  37   1.397  24.250  17.124
  254    HB3  TRP  37           HB2      TRP  37   3.157  24.271  17.046
  255    HD1  TRP  37           HD1      TRP  37   0.608  23.320  14.275
  256    HE1  TRP  37           HE1      TRP  37   1.102  24.782  12.215
  257    HE3  TRP  37           HE3      TRP  37   4.368  26.196  16.204
  258    HZ2  TRP  37           HZ2      TRP  37   2.855  26.877  11.502
  259    HZ3  TRP  37           HZ3      TRP  37   5.401  27.906  14.768
  260    HH2  TRP  37           HH2      TRP  37   4.659  28.237  12.465
  Start of MODEL   13
    1    H1   LYS   1           HN       LYS   1  -0.282  -1.204  -8.334
    2    HA   LYS   1           HA       LYS   1  -0.604  -2.576  -6.072
    3    HB2  LYS   1           HB1      LYS   1  -0.694  -3.625  -8.894
    4    HB3  LYS   1           HB2      LYS   1  -1.155  -4.623  -7.521
    5    HG2  LYS   1           HG1      LYS   1  -2.402  -1.950  -8.098
    6    HG3  LYS   1           HG2      LYS   1  -3.036  -3.474  -8.724
    7    HD2  LYS   1           HD1      LYS   1  -3.242  -4.302  -6.405
    8    HD3  LYS   1           HD2      LYS   1  -2.690  -2.731  -5.819
    9    HE2  LYS   1           HE1      LYS   1  -5.027  -2.883  -7.673
   10    HE3  LYS   1           HE2      LYS   1  -5.244  -3.262  -5.965
   11    HZ1  LYS   1           HZ1      LYS   1  -5.040  -1.126  -5.386
   12    HZ2  LYS   1           HZ2      LYS   1  -5.379  -0.792  -7.009
   13    HZ3  LYS   1           HZ3      LYS   1  -3.776  -0.829  -6.471
   14    H    TYR   2           HN       TYR   2   2.259  -2.081  -6.496
   15    HA   TYR   2           HA       TYR   2   3.513  -4.661  -6.748
   16    HB2  TYR   2           HB1      TYR   2   5.583  -3.508  -6.403
   17    HB3  TYR   2           HB2      TYR   2   4.586  -2.492  -7.438
   18    HD1  TYR   2           HD1      TYR   2   3.468  -0.478  -6.471
   19    HD2  TYR   2           HD2      TYR   2   6.318  -2.750  -4.276
   20    HE1  TYR   2           HE1      TYR   2   3.757   1.402  -4.912
   21    HE2  TYR   2           HE2      TYR   2   6.614  -0.877  -2.710
   22    HH   TYR   2           HH       TYR   2   4.807   1.294  -2.075
   23    H    TYR   3           HN       TYR   3   5.018  -5.446  -5.019
   24    HA   TYR   3           HA       TYR   3   4.245  -4.787  -2.296
   25    HB2  TYR   3           HB1      TYR   3   3.780  -7.501  -3.532
   26    HB3  TYR   3           HB2      TYR   3   3.871  -7.248  -1.792
   27    HD1  TYR   3           HD1      TYR   3   2.283  -5.292  -0.912
   28    HD2  TYR   3           HD2      TYR   3   1.691  -7.489  -4.507
   29    HE1  TYR   3           HE1      TYR   3  -0.106  -4.710  -0.867
   30    HE2  TYR   3           HE2      TYR   3  -0.700  -6.912  -4.473
   31    HH   TYR   3           HH       TYR   3  -2.030  -4.657  -3.163
   32    H    GLY   4           HN       GLY   4   6.188  -4.374  -1.458
   33    HA2  GLY   4           HA1      GLY   4   8.291  -6.414  -1.821
   34    HA3  GLY   4           HA2      GLY   4   8.658  -4.699  -1.940
   35    H    ASN   5           HN       ASN   5   9.259  -7.101  -0.018
   36    HA   ASN   5           HA       ASN   5   8.292  -6.279   2.523
   37    HB2  ASN   5           HB1      ASN   5  10.084  -7.812   3.400
   38    HB3  ASN   5           HB2      ASN   5   8.984  -8.560   2.246
   39   HD21  ASN   5          HD21      ASN   5   9.726  -9.100   0.199
   40   HD22  ASN   5          HD22      ASN   5  11.410  -9.181  -0.176
   41    H    GLY   6           HN       GLY   6  10.982  -5.332   0.549
   42    HA2  GLY   6           HA1      GLY   6  11.701  -2.987   1.288
   43    HA3  GLY   6           HA2      GLY   6  12.116  -3.794   2.793
   44    H    VAL   7           HN       VAL   7  12.902  -6.197   1.049
   45    HA   VAL   7           HA       VAL   7  15.676  -5.638   0.985
   46    HB   VAL   7           HB       VAL   7  14.879  -7.906   1.328
   47   HG11  VAL   7          HG11      VAL   7  12.985  -7.423  -0.490
   48   HG12  VAL   7          HG12      VAL   7  14.134  -8.288  -1.512
   49   HG13  VAL   7          HG13      VAL   7  13.496  -9.054  -0.056
   50   HG21  VAL   7          HG21      VAL   7  16.897  -7.136  -0.503
   51   HG22  VAL   7          HG22      VAL   7  16.821  -8.588   0.495
   52   HG23  VAL   7          HG23      VAL   7  16.136  -8.599  -1.130
   53    H    HIS   8           HN       HIS   8  13.188  -5.782  -1.520
   54    HA   HIS   8           HA       HIS   8  14.996  -5.406  -3.695
   55    HB2  HIS   8           HB1      HIS   8  12.592  -6.385  -3.715
   56    HB3  HIS   8           HB2      HIS   8  12.076  -4.704  -3.806
   57    HD1  HIS   8           HD1      HIS   8  14.346  -7.086  -5.712
   58    HD2  HIS   8           HD2      HIS   8  11.969  -3.735  -6.333
   59    HE1  HIS   8           HE1      HIS   8  14.379  -6.689  -8.195
   60    H    LEU   9           HN       LEU   9  13.192  -3.286  -1.585
   61    HA   LEU   9           HA       LEU   9  13.339  -0.927  -3.105
   62    HB2  LEU   9           HB1      LEU   9  11.851  -0.866  -1.322
   63    HB3  LEU   9           HB2      LEU   9  13.034  -1.517  -0.188
   64    HG   LEU   9           HG       LEU   9  13.572   1.167  -1.338
   65   HD11  LEU   9          HD11      LEU   9  11.482   1.837  -0.813
   66   HD12  LEU   9          HD12      LEU   9  12.151   1.891   0.817
   67   HD13  LEU   9          HD13      LEU   9  11.209   0.494   0.297
   68   HD21  LEU   9          HD21      LEU   9  15.165   0.956   0.200
   69   HD22  LEU   9          HD22      LEU   9  14.401  -0.475   0.893
   70   HD23  LEU   9          HD23      LEU   9  13.903   1.134   1.419
   71    H    THR  10           HN       THR  10  15.711  -2.632  -1.280
   72    HA   THR  10           HA       THR  10  17.484  -0.479  -0.760
   73    HB   THR  10           HB       THR  10  18.310  -3.357  -1.119
   74    HG1  THR  10           HG1      THR  10  17.276  -2.135   1.241
   75   HG21  THR  10          HG21      THR  10  20.218  -2.810  -0.025
   76   HG22  THR  10          HG22      THR  10  19.412  -1.634   1.013
   77   HG23  THR  10          HG23      THR  10  19.849  -1.199  -0.639
   78    H    LYS  11           HN       LYS  11  17.787  -3.132  -3.131
   79    HA   LYS  11           HA       LYS  11  19.853  -1.836  -4.588
   80    HB2  LYS  11           HB1      LYS  11  18.056  -4.170  -5.245
   81    HB3  LYS  11           HB2      LYS  11  19.331  -3.612  -6.321
   82    HG2  LYS  11           HG1      LYS  11  21.014  -4.314  -4.910
   83    HG3  LYS  11           HG2      LYS  11  19.973  -4.286  -3.485
   84    HD2  LYS  11           HD1      LYS  11  18.687  -6.152  -4.884
   85    HD3  LYS  11           HD2      LYS  11  20.299  -6.374  -5.569
   86    HE2  LYS  11           HE1      LYS  11  21.224  -6.951  -3.506
   87    HE3  LYS  11           HE2      LYS  11  19.883  -6.248  -2.603
   88    HZ1  LYS  11           HZ1      LYS  11  19.768  -8.649  -2.577
   89    HZ2  LYS  11           HZ2      LYS  11  19.763  -8.706  -4.267
   90    HZ3  LYS  11           HZ3      LYS  11  18.455  -8.022  -3.440
   91    H    SER  12           HN       SER  12  16.388  -1.757  -4.732
   92    HA   SER  12           HA       SER  12  16.066  -0.833  -7.374
   93    HB2  SER  12           HB1      SER  12  14.386  -0.726  -4.892
   94    HB3  SER  12           HB2      SER  12  13.894   0.190  -6.317
   95    HG   SER  12           HG       SER  12  13.486  -1.624  -7.366
   96    H    GLY  13           HN       GLY  13  17.096   0.734  -4.467
   97    HA2  GLY  13           HA1      GLY  13  18.346   2.879  -5.359
   98    HA3  GLY  13           HA2      GLY  13  16.685   3.399  -5.600
   99    H    LEU  14           HN       LEU  14  18.525   1.771  -3.011
  100    HA   LEU  14           HA       LEU  14  17.004   2.712  -0.885
  101    HB2  LEU  14           HB1      LEU  14  18.675   1.928   0.517
  102    HB3  LEU  14           HB2      LEU  14  18.858   0.942  -0.933
  103    HG   LEU  14           HG       LEU  14  20.561   3.349  -0.300
  104   HD11  LEU  14          HD11      LEU  14  21.819   0.726  -0.182
  105   HD12  LEU  14          HD12      LEU  14  20.594   0.966   1.063
  106   HD13  LEU  14          HD13      LEU  14  21.941   2.096   0.923
  107   HD21  LEU  14          HD21      LEU  14  20.382   1.423  -2.534
  108   HD22  LEU  14          HD22      LEU  14  22.003   1.845  -1.982
  109   HD23  LEU  14          HD23      LEU  14  20.898   3.109  -2.524
  110    H    SER  15           HN       SER  15  19.400   4.324  -2.791
  111    HA   SER  15           HA       SER  15  20.007   6.403  -0.941
  112    HB2  SER  15           HB1      SER  15  20.701   7.564  -3.213
  113    HB3  SER  15           HB2      SER  15  21.650   6.232  -2.556
  114    HG   SER  15           HG       SER  15  21.068   5.024  -4.181
  115    H    VAL  16           HN       VAL  16  17.932   6.280  -3.834
  116    HA   VAL  16           HA       VAL  16  16.882   8.895  -3.476
  117    HB   VAL  16           HB       VAL  16  16.875   7.772  -5.662
  118   HG11  VAL  16          HG11      VAL  16  15.063   6.069  -6.075
  119   HG12  VAL  16          HG12      VAL  16  16.427   5.512  -5.104
  120   HG13  VAL  16          HG13      VAL  16  14.902   5.936  -4.324
  121   HG21  VAL  16          HG21      VAL  16  14.057   8.348  -4.768
  122   HG22  VAL  16          HG22      VAL  16  15.259   9.598  -5.086
  123   HG23  VAL  16          HG23      VAL  16  14.731   8.532  -6.387
  124    H    ASN  17           HN       ASN  17  16.067   5.785  -2.190
  125    HA   ASN  17           HA       ASN  17  13.385   6.399  -1.441
  126    HB2  ASN  17           HB1      ASN  17  14.191   4.081  -1.716
  127    HB3  ASN  17           HB2      ASN  17  15.255   4.295  -0.329
  128   HD21  ASN  17          HD21      ASN  17  11.844   4.629  -1.234
  129   HD22  ASN  17          HD22      ASN  17  11.213   4.018   0.254
  130    H    TRP  18           HN       TRP  18  16.523   6.754   0.074
  131    HA   TRP  18           HA       TRP  18  15.760   7.168   2.717
  132    HB2  TRP  18           HB1      TRP  18  18.126   7.043   1.596
  133    HB3  TRP  18           HB2      TRP  18  17.964   8.795   1.500
  134    HD1  TRP  18           HD1      TRP  18  16.398   8.935   4.425
  135    HE1  TRP  18           HE1      TRP  18  17.867   8.793   6.533
  136    HE3  TRP  18           HE3      TRP  18  20.562   6.796   2.370
  137    HZ2  TRP  18           HZ2      TRP  18  20.450   7.895   7.233
  138    HZ3  TRP  18           HZ3      TRP  18  22.489   6.329   3.828
  139    HH2  TRP  18           HH2      TRP  18  22.432   6.868   6.208
  140    H    GLY  19           HN       GLY  19  16.397   9.677   0.251
  141    HA2  GLY  19           HA1      GLY  19  15.561  11.869   1.742
  142    HA3  GLY  19           HA2      GLY  19  15.524  11.783  -0.013
  143    H    GLU  20           HN       GLU  20  13.643   9.755  -0.364
  144    HA   GLU  20           HA       GLU  20  11.240  11.206  -0.174
  145    HB2  GLU  20           HB1      GLU  20  11.938   8.388  -0.905
  146    HB3  GLU  20           HB2      GLU  20  10.250   8.829  -0.684
  147    HG2  GLU  20           HG1      GLU  20  12.015  10.431  -2.486
  148    HG3  GLU  20           HG2      GLU  20  11.281   8.928  -3.043
  149    H    ALA  21           HN       ALA  21  12.466   8.447   1.693
  150    HA   ALA  21           HA       ALA  21  10.222   8.089   3.333
  151    HB1  ALA  21           HB1      ALA  21  12.802   7.551   4.613
  152    HB2  ALA  21           HB2      ALA  21  11.438   6.476   4.307
  153    HB3  ALA  21           HB3      ALA  21  12.603   6.808   3.026
  154    H    PHE  22           HN       PHE  22  13.106  10.104   3.753
  155    HA   PHE  22           HA       PHE  22  12.676  10.984   6.346
  156    HB2  PHE  22           HB1      PHE  22  14.653  11.431   4.723
  157    HB3  PHE  22           HB2      PHE  22  13.721  12.839   4.226
  158    HD1  PHE  22           HD1      PHE  22  12.856  14.331   6.226
  159    HD2  PHE  22           HD2      PHE  22  16.175  11.674   6.421
  160    HE1  PHE  22           HE1      PHE  22  13.755  15.600   8.132
  161    HE2  PHE  22           HE2      PHE  22  17.080  12.939   8.327
  162    HZ   PHE  22           HZ       PHE  22  15.869  14.904   9.186
  163    H    SER  23           HN       SER  23  11.744  12.697   3.357
  164    HA   SER  23           HA       SER  23  10.276  14.727   4.566
  165    HB2  SER  23           HB1      SER  23   9.066  14.829   2.316
  166    HB3  SER  23           HB2      SER  23  10.821  14.989   2.272
  167    HG   SER  23           HG       SER  23   9.252  13.121   1.125
  168    H    ALA  24           HN       ALA  24   9.173  11.580   3.345
  169    HA   ALA  24           HA       ALA  24   6.449  11.880   3.849
  170    HB1  ALA  24           HB1      ALA  24   8.204   9.775   3.086
  171    HB2  ALA  24           HB2      ALA  24   7.133   9.182   4.356
  172    HB3  ALA  24           HB3      ALA  24   6.455   9.883   2.887
  173    H    GLY  25           HN       GLY  25   9.095  11.187   6.015
  174    HA2  GLY  25           HA1      GLY  25   7.385  10.344   8.187
  175    HA3  GLY  25           HA2      GLY  25   9.120  10.609   8.264
  176    H    VAL  26           HN       VAL  26   8.909  13.314   7.137
  177    HA   VAL  26           HA       VAL  26   8.742  14.775   9.521
  178    HB   VAL  26           HB       VAL  26   8.516  15.800   6.687
  179   HG11  VAL  26          HG11      VAL  26   7.928  17.687   7.771
  180   HG12  VAL  26          HG12      VAL  26   8.586  17.134   9.313
  181   HG13  VAL  26          HG13      VAL  26   9.660  17.803   8.083
  182   HG21  VAL  26          HG21      VAL  26  10.755  14.834   8.305
  183   HG22  VAL  26          HG22      VAL  26  10.621  15.035   6.558
  184   HG23  VAL  26          HG23      VAL  26  11.022  16.418   7.577
  185    H    HIS  27           HN       HIS  27   6.346  14.059   7.068
  186    HA   HIS  27           HA       HIS  27   4.413  15.966   7.817
  187    HB2  HIS  27           HB1      HIS  27   4.571  14.333   5.744
  188    HB3  HIS  27           HB2      HIS  27   3.582  13.294   6.766
  189    HD1  HIS  27           HD1      HIS  27   1.671  13.618   4.972
  190    HD2  HIS  27           HD2      HIS  27   2.771  17.053   7.032
  191    HE1  HIS  27           HE1      HIS  27  -0.174  15.274   4.551
  192    H    ARG  28           HN       ARG  28   4.932  12.609   8.832
  193    HA   ARG  28           HA       ARG  28   2.669  12.444  10.515
  194    HB2  ARG  28           HB1      ARG  28   4.004  10.504   9.634
  195    HB3  ARG  28           HB2      ARG  28   5.255  10.909  10.802
  196    HG2  ARG  28           HG1      ARG  28   4.044  10.152  12.575
  197    HG3  ARG  28           HG2      ARG  28   2.494  10.514  11.812
  198    HD2  ARG  28           HD1      ARG  28   2.497   8.223  11.706
  199    HD3  ARG  28           HD2      ARG  28   3.223   8.624  10.150
  200    HE   ARG  28           HE       ARG  28   5.250   8.331  12.078
  201   HH11  ARG  28          HH11      ARG  28   2.934   6.443  10.290
  202   HH12  ARG  28          HH12      ARG  28   3.895   5.002  10.315
  203   HH21  ARG  28          HH21      ARG  28   6.524   6.439  12.118
  204   HH22  ARG  28          HH22      ARG  28   5.936   5.000  11.355
  205    H    LEU  29           HN       LEU  29   6.017  13.408  11.087
  206    HA   LEU  29           HA       LEU  29   5.889  13.588  13.888
  207    HB2  LEU  29           HB1      LEU  29   7.641  14.695  11.764
  208    HB3  LEU  29           HB2      LEU  29   7.723  15.438  13.359
  209    HG   LEU  29           HG       LEU  29   8.203  12.515  12.782
  210   HD11  LEU  29          HD11      LEU  29   9.878  14.326  11.942
  211   HD12  LEU  29          HD12      LEU  29  10.471  12.904  12.799
  212   HD13  LEU  29          HD13      LEU  29  10.311  14.442  13.648
  213   HD21  LEU  29          HD21      LEU  29   9.339  13.141  15.200
  214   HD22  LEU  29          HD22      LEU  29   7.795  12.319  14.970
  215   HD23  LEU  29          HD23      LEU  29   7.836  14.065  15.225
  216    H    ALA  30           HN       ALA  30   5.211  15.960  11.350
  217    HA   ALA  30           HA       ALA  30   4.804  18.192  12.991
  218    HB1  ALA  30           HB1      ALA  30   4.718  17.694  10.287
  219    HB2  ALA  30           HB2      ALA  30   3.049  18.118  10.671
  220    HB3  ALA  30           HB3      ALA  30   4.356  19.233  11.069
  221    H    ASN  31           HN       ASN  31   2.662  15.557  12.081
  222    HA   ASN  31           HA       ASN  31   0.369  16.796  13.349
  223    HB2  ASN  31           HB1      ASN  31   0.829  14.231  11.855
  224    HB3  ASN  31           HB2      ASN  31  -0.636  14.454  12.806
  225   HD21  ASN  31          HD21      ASN  31  -1.916  14.370  10.957
  226   HD22  ASN  31          HD22      ASN  31  -1.999  15.688   9.843
  227    H    GLY  32           HN       GLY  32   2.096  16.741  15.300
  228    HA2  GLY  32           HA1      GLY  32   0.921  15.174  17.304
  229    HA3  GLY  32           HA2      GLY  32   2.383  14.358  16.771
  230    H    GLY  33           HN       GLY  33   4.374  15.801  16.697
  231    HA2  GLY  33           HA1      GLY  33   4.632  17.036  19.293
  232    HA3  GLY  33           HA2      GLY  33   5.915  16.801  18.114
  233    H    ASN  34           HN       ASN  34   3.066  18.792  18.818
  234    HA   ASN  34           HA       ASN  34   4.517  21.133  17.883
  235    HB2  ASN  34           HB1      ASN  34   3.122  20.074  15.969
  236    HB3  ASN  34           HB2      ASN  34   1.729  20.705  16.843
  237   HD21  ASN  34          HD21      ASN  34   3.986  21.354  14.513
  238   HD22  ASN  34          HD22      ASN  34   3.830  23.074  14.448
  239    H    GLY  35           HN       GLY  35   4.198  22.786  19.229
  240    HA2  GLY  35           HA1      GLY  35   2.291  22.522  21.377
  241    HA3  GLY  35           HA2      GLY  35   3.448  23.827  21.161
  242    H    PHE  36           HN       PHE  36   2.403  25.696  21.093
  243    HA   PHE  36           HA       PHE  36   0.229  26.021  19.179
  244    HB2  PHE  36           HB1      PHE  36  -1.107  27.288  20.915
  245    HB3  PHE  36           HB2      PHE  36  -1.038  25.543  21.140
  246    HD1  PHE  36           HD1      PHE  36   0.254  24.572  22.959
  247    HD2  PHE  36           HD2      PHE  36  -0.052  28.788  22.462
  248    HE1  PHE  36           HE1      PHE  36   1.086  24.900  25.252
  249    HE2  PHE  36           HE2      PHE  36   0.779  29.122  24.753
  250    HZ   PHE  36           HZ       PHE  36   1.351  27.177  26.151
  251    H    TRP  37           HN       TRP  37   0.218  27.983  18.212
  252    HA   TRP  37           HA       TRP  37   0.926  30.045  17.567
  253    HB2  TRP  37           HB1      TRP  37   1.624  30.474  20.478
  254    HB3  TRP  37           HB2      TRP  37   1.298  31.712  19.268
  255    HD1  TRP  37           HD1      TRP  37  -1.364  30.107  18.126
  256    HE1  TRP  37           HE1      TRP  37  -3.528  30.314  19.505
  257    HE3  TRP  37           HE3      TRP  37   0.657  31.520  22.605
  258    HZ2  TRP  37           HZ2      TRP  37  -4.279  30.987  22.141
  259    HZ3  TRP  37           HZ3      TRP  37  -0.853  31.926  24.505
  260    HH2  TRP  37           HH2      TRP  37  -3.270  31.665  24.275
  Start of MODEL   14
    1    H1   LYS   1           HN       LYS   1  -0.232  -8.258  -6.032
    2    HA   LYS   1           HA       LYS   1  -0.652  -5.344  -5.895
    3    HB2  LYS   1           HB1      LYS   1  -2.667  -6.961  -5.598
    4    HB3  LYS   1           HB2      LYS   1  -1.970  -7.278  -4.015
    5    HG2  LYS   1           HG1      LYS   1  -1.988  -4.693  -3.777
    6    HG3  LYS   1           HG2      LYS   1  -3.173  -4.765  -5.084
    7    HD2  LYS   1           HD1      LYS   1  -3.475  -6.499  -2.660
    8    HD3  LYS   1           HD2      LYS   1  -3.992  -4.812  -2.623
    9    HE2  LYS   1           HE1      LYS   1  -5.220  -5.449  -4.841
   10    HE3  LYS   1           HE2      LYS   1  -5.058  -7.094  -4.228
   11    HZ1  LYS   1           HZ1      LYS   1  -6.433  -4.823  -2.904
   12    HZ2  LYS   1           HZ2      LYS   1  -6.146  -6.313  -2.158
   13    HZ3  LYS   1           HZ3      LYS   1  -7.145  -6.229  -3.521
   14    H    TYR   2           HN       TYR   2   1.871  -6.094  -5.543
   15    HA   TYR   2           HA       TYR   2   2.335  -5.485  -2.754
   16    HB2  TYR   2           HB1      TYR   2   3.697  -7.372  -2.241
   17    HB3  TYR   2           HB2      TYR   2   2.193  -8.006  -2.901
   18    HD1  TYR   2           HD2      TYR   2   2.189  -8.613  -5.411
   19    HD2  TYR   2           HD1      TYR   2   5.741  -8.042  -3.139
   20    HE1  TYR   2           HE2      TYR   2   3.458  -9.895  -7.083
   21    HE2  TYR   2           HE1      TYR   2   7.020  -9.322  -4.805
   22    HH   TYR   2           HH       TYR   2   5.542 -10.421  -7.807
   23    H    TYR   3           HN       TYR   3   4.153  -4.307  -2.465
   24    HA   TYR   3           HA       TYR   3   5.602  -3.505  -4.839
   25    HB2  TYR   3           HB1      TYR   3   4.789  -1.934  -2.990
   26    HB3  TYR   3           HB2      TYR   3   6.123  -2.557  -2.025
   27    HD1  TYR   3           HD1      TYR   3   5.509  -1.116  -5.421
   28    HD2  TYR   3           HD2      TYR   3   8.116  -1.395  -2.070
   29    HE1  TYR   3           HE1      TYR   3   7.020   0.517  -6.469
   30    HE2  TYR   3           HE2      TYR   3   9.634   0.238  -3.108
   31    HH   TYR   3           HH       TYR   3   9.285   1.247  -6.384
   32    H    GLY   4           HN       GLY   4   6.659  -4.476  -1.566
   33    HA2  GLY   4           HA1      GLY   4   8.348  -6.549  -2.339
   34    HA3  GLY   4           HA2      GLY   4   9.305  -5.075  -2.383
   35    H    ASN   5           HN       ASN   5   9.978  -7.132  -0.688
   36    HA   ASN   5           HA       ASN   5   8.883  -6.816   1.919
   37    HB2  ASN   5           HB1      ASN   5  11.512  -8.028   1.035
   38    HB3  ASN   5           HB2      ASN   5  10.823  -8.175   2.649
   39   HD21  ASN   5          HD21      ASN   5   9.621  -9.888   3.036
   40   HD22  ASN   5          HD22      ASN   5   8.882 -10.899   1.846
   41    H    GLY   6           HN       GLY   6  11.392  -5.217   0.129
   42    HA2  GLY   6           HA1      GLY   6  11.765  -2.896   1.069
   43    HA3  GLY   6           HA2      GLY   6  12.166  -3.733   2.561
   44    H    VAL   7           HN       VAL   7  13.435  -5.892   0.799
   45    HA   VAL   7           HA       VAL   7  16.094  -4.940   0.998
   46    HB   VAL   7           HB       VAL   7  16.717  -7.015  -0.212
   47   HG11  VAL   7          HG11      VAL   7  15.390  -6.775   2.303
   48   HG12  VAL   7          HG12      VAL   7  14.992  -8.338   1.588
   49   HG13  VAL   7          HG13      VAL   7  16.679  -7.881   1.831
   50   HG21  VAL   7          HG21      VAL   7  15.163  -7.647  -1.725
   51   HG22  VAL   7          HG22      VAL   7  14.529  -8.574  -0.365
   52   HG23  VAL   7          HG23      VAL   7  13.820  -7.011  -0.774
   53    H    HIS   8           HN       HIS   8  13.861  -5.307  -1.716
   54    HA   HIS   8           HA       HIS   8  15.764  -4.566  -3.710
   55    HB2  HIS   8           HB1      HIS   8  13.500  -5.859  -3.940
   56    HB3  HIS   8           HB2      HIS   8  12.806  -4.247  -4.086
   57    HD1  HIS   8           HD1      HIS   8  12.212  -4.271  -6.527
   58    HD2  HIS   8           HD2      HIS   8  16.164  -5.346  -5.830
   59    HE1  HIS   8           HE1      HIS   8  13.290  -4.375  -8.797
   60    H    LEU   9           HN       LEU   9  13.517  -2.835  -1.675
   61    HA   LEU   9           HA       LEU   9  13.430  -0.405  -3.082
   62    HB2  LEU   9           HB1      LEU   9  11.822  -0.644  -1.424
   63    HB3  LEU   9           HB2      LEU   9  12.998  -1.183  -0.227
   64    HG   LEU   9           HG       LEU   9  13.231   1.607  -1.215
   65   HD11  LEU   9          HD11      LEU   9  10.773   1.135  -0.802
   66   HD12  LEU   9          HD12      LEU   9  11.491   2.457   0.119
   67   HD13  LEU   9          HD13      LEU   9  11.209   0.896   0.890
   68   HD21  LEU   9          HD21      LEU   9  14.724   1.528   0.434
   69   HD22  LEU   9          HD22      LEU   9  14.108  -0.021   1.013
   70   HD23  LEU   9          HD23      LEU   9  13.362   1.484   1.553
   71    H    THR  10           HN       THR  10  15.892  -1.851  -1.163
   72    HA   THR  10           HA       THR  10  17.287   0.499  -0.401
   73    HB   THR  10           HB       THR  10  18.514  -2.227  -0.831
   74    HG1  THR  10           HG1      THR  10  17.956  -2.530   1.421
   75   HG21  THR  10          HG21      THR  10  20.309  -1.473   0.312
   76   HG22  THR  10          HG22      THR  10  19.328  -0.510   1.417
   77   HG23  THR  10          HG23      THR  10  19.725   0.115  -0.183
   78    H    LYS  11           HN       LYS  11  18.143  -1.933  -2.872
   79    HA   LYS  11           HA       LYS  11  20.086  -0.264  -4.100
   80    HB2  LYS  11           HB1      LYS  11  18.742  -2.833  -4.902
   81    HB3  LYS  11           HB2      LYS  11  19.851  -2.007  -5.988
   82    HG2  LYS  11           HG1      LYS  11  21.578  -2.122  -4.192
   83    HG3  LYS  11           HG2      LYS  11  20.462  -3.125  -3.262
   84    HD2  LYS  11           HD1      LYS  11  21.429  -3.784  -6.043
   85    HD3  LYS  11           HD2      LYS  11  22.151  -4.419  -4.562
   86    HE2  LYS  11           HE1      LYS  11  19.274  -4.786  -5.395
   87    HE3  LYS  11           HE2      LYS  11  20.550  -5.987  -5.594
   88    HZ1  LYS  11           HZ1      LYS  11  20.805  -5.540  -3.023
   89    HZ2  LYS  11           HZ2      LYS  11  19.694  -6.665  -3.622
   90    HZ3  LYS  11           HZ3      LYS  11  19.172  -5.122  -3.167
   91    H    SER  12           HN       SER  12  16.669  -0.745  -4.553
   92    HA   SER  12           HA       SER  12  16.418   0.322  -7.148
   93    HB2  SER  12           HB1      SER  12  14.603  -0.940  -6.142
   94    HB3  SER  12           HB2      SER  12  14.436   0.260  -4.860
   95    HG   SER  12           HG       SER  12  12.926   0.857  -6.288
   96    H    GLY  13           HN       GLY  13  16.896   1.802  -4.057
   97    HA2  GLY  13           HA1      GLY  13  17.817   4.196  -4.704
   98    HA3  GLY  13           HA2      GLY  13  16.109   4.439  -5.035
   99    H    LEU  14           HN       LEU  14  18.091   3.003  -2.437
  100    HA   LEU  14           HA       LEU  14  16.296   3.431  -0.363
  101    HB2  LEU  14           HB1      LEU  14  18.033   2.933   1.102
  102    HB3  LEU  14           HB2      LEU  14  18.470   2.092  -0.384
  103    HG   LEU  14           HG       LEU  14  19.621   4.754   0.442
  104   HD11  LEU  14          HD11      LEU  14  20.278   2.024   1.273
  105   HD12  LEU  14          HD12      LEU  14  20.698   3.570   2.008
  106   HD13  LEU  14          HD13      LEU  14  21.646   2.951   0.657
  107   HD21  LEU  14          HD21      LEU  14  19.975   2.911  -1.853
  108   HD22  LEU  14          HD22      LEU  14  21.417   3.697  -1.211
  109   HD23  LEU  14          HD23      LEU  14  20.063   4.671  -1.786
  110    H    SER  15           HN       SER  15  18.394   5.657  -1.984
  111    HA   SER  15           HA       SER  15  18.431   7.665   0.036
  112    HB2  SER  15           HB1      SER  15  20.072   7.455  -1.882
  113    HB3  SER  15           HB2      SER  15  18.808   8.094  -2.932
  114    HG   SER  15           HG       SER  15  19.622   9.447  -0.590
  115    H    VAL  16           HN       VAL  16  16.644   7.405  -3.039
  116    HA   VAL  16           HA       VAL  16  15.012   9.675  -2.535
  117    HB   VAL  16           HB       VAL  16  15.452   8.786  -4.809
  118   HG11  VAL  16          HG11      VAL  16  15.311   6.417  -4.374
  119   HG12  VAL  16          HG12      VAL  16  13.610   6.565  -3.928
  120   HG13  VAL  16          HG13      VAL  16  14.115   6.858  -5.592
  121   HG21  VAL  16          HG21      VAL  16  13.096   9.874  -3.782
  122   HG22  VAL  16          HG22      VAL  16  13.627   9.879  -5.464
  123   HG23  VAL  16          HG23      VAL  16  12.576   8.592  -4.875
  124    H    ASN  17           HN       ASN  17  14.756   6.286  -1.762
  125    HA   ASN  17           HA       ASN  17  11.968   6.302  -1.156
  126    HB2  ASN  17           HB1      ASN  17  14.232   4.402  -0.620
  127    HB3  ASN  17           HB2      ASN  17  12.662   4.151   0.138
  128   HD21  ASN  17          HD21      ASN  17  10.787   4.308  -1.456
  129   HD22  ASN  17          HD22      ASN  17  11.000   3.473  -2.953
  130    H    TRP  18           HN       TRP  18  14.923   6.530   0.794
  131    HA   TRP  18           HA       TRP  18  13.645   6.639   3.303
  132    HB2  TRP  18           HB1      TRP  18  15.992   6.135   3.197
  133    HB3  TRP  18           HB2      TRP  18  16.337   7.660   2.386
  134    HD1  TRP  18           HD1      TRP  18  17.082   9.592   3.902
  135    HE1  TRP  18           HE1      TRP  18  17.081  10.041   6.436
  136    HE3  TRP  18           HE3      TRP  18  14.449   5.493   5.451
  137    HZ2  TRP  18           HZ2      TRP  18  16.096   8.818   8.782
  138    HZ3  TRP  18           HZ3      TRP  18  14.022   5.206   7.857
  139    HH2  TRP  18           HH2      TRP  18  14.829   6.835   9.486
  140    H    GLY  19           HN       GLY  19  14.818   9.221   1.153
  141    HA2  GLY  19           HA1      GLY  19  14.086  11.380   2.801
  142    HA3  GLY  19           HA2      GLY  19  14.315  11.459   1.061
  143    H    GLU  20           HN       GLU  20  12.299   9.736   0.214
  144    HA   GLU  20           HA       GLU  20  10.072  11.457   0.221
  145    HB2  GLU  20           HB1      GLU  20  10.634   8.713  -0.784
  146    HB3  GLU  20           HB2      GLU  20   8.950   9.196  -0.642
  147    HG2  GLU  20           HG1      GLU  20  11.006  10.800  -2.133
  148    HG3  GLU  20           HG2      GLU  20  10.000   9.564  -2.885
  149    H    ALA  21           HN       ALA  21  10.713   8.431   1.952
  150    HA   ALA  21           HA       ALA  21   8.196   8.207   3.193
  151    HB1  ALA  21           HB1      ALA  21  10.458   7.180   4.741
  152    HB2  ALA  21           HB2      ALA  21   9.038   6.345   4.111
  153    HB3  ALA  21           HB3      ALA  21  10.423   6.644   3.061
  154    H    PHE  22           HN       PHE  22  11.131   9.926   4.084
  155    HA   PHE  22           HA       PHE  22  10.463  10.537   6.740
  156    HB2  PHE  22           HB1      PHE  22  12.708  10.847   5.537
  157    HB3  PHE  22           HB2      PHE  22  12.046  12.367   4.944
  158    HD1  PHE  22           HD2      PHE  22  13.188  10.535   7.904
  159    HD2  PHE  22           HD1      PHE  22  11.747  14.247   6.402
  160    HE1  PHE  22           HE2      PHE  22  13.875  11.642   9.991
  161    HE2  PHE  22           HE1      PHE  22  12.432  15.361   8.486
  162    HZ   PHE  22           HZ       PHE  22  13.497  14.058  10.284
  163    H    SER  23           HN       SER  23  10.059  12.494   3.790
  164    HA   SER  23           HA       SER  23   8.828  14.701   4.900
  165    HB2  SER  23           HB1      SER  23   9.559  14.303   2.467
  166    HB3  SER  23           HB2      SER  23   7.972  13.567   2.240
  167    HG   SER  23           HG       SER  23   7.845  15.740   1.714
  168    H    ALA  24           HN       ALA  24   7.466  11.568   4.114
  169    HA   ALA  24           HA       ALA  24   4.743  12.206   4.295
  170    HB1  ALA  24           HB1      ALA  24   6.334   9.837   4.088
  171    HB2  ALA  24           HB2      ALA  24   5.065   9.595   5.290
  172    HB3  ALA  24           HB3      ALA  24   4.644  10.086   3.650
  173    H    GLY  25           HN       GLY  25   7.092  11.292   6.778
  174    HA2  GLY  25           HA1      GLY  25   5.139  11.214   8.884
  175    HA3  GLY  25           HA2      GLY  25   6.885  11.149   9.076
  176    H    VAL  26           HN       VAL  26   7.381  13.613   7.631
  177    HA   VAL  26           HA       VAL  26   7.320  15.433   9.749
  178    HB   VAL  26           HB       VAL  26   7.553  16.045   6.799
  179   HG11  VAL  26          HG11      VAL  26   7.281  18.142   7.617
  180   HG12  VAL  26          HG12      VAL  26   7.793  17.693   9.245
  181   HG13  VAL  26          HG13      VAL  26   8.996  17.955   7.982
  182   HG21  VAL  26          HG21      VAL  26   9.409  14.916   8.780
  183   HG22  VAL  26          HG22      VAL  26   9.411  14.790   7.020
  184   HG23  VAL  26          HG23      VAL  26  10.061  16.231   7.802
  185    H    HIS  27           HN       HIS  27   5.107  14.971   7.043
  186    HA   HIS  27           HA       HIS  27   3.555  17.293   7.451
  187    HB2  HIS  27           HB1      HIS  27   3.550  15.873   5.381
  188    HB3  HIS  27           HB2      HIS  27   2.619  14.672   6.271
  189    HD1  HIS  27           HD1      HIS  27   2.340  18.227   5.013
  190    HD2  HIS  27           HD2      HIS  27  -0.080  15.127   6.352
  191    HE1  HIS  27           HE1      HIS  27  -0.020  18.981   4.581
  192    H    ARG  28           HN       ARG  28   3.297  14.000   8.705
  193    HA   ARG  28           HA       ARG  28   0.814  14.376  10.023
  194    HB2  ARG  28           HB1      ARG  28   3.000  12.341  10.154
  195    HB3  ARG  28           HB2      ARG  28   1.774  12.355  11.415
  196    HG2  ARG  28           HG1      ARG  28   0.029  12.090   9.730
  197    HG3  ARG  28           HG2      ARG  28   1.256  12.087   8.461
  198    HD2  ARG  28           HD1      ARG  28   1.494  10.141  10.704
  199    HD3  ARG  28           HD2      ARG  28   0.302   9.839   9.441
  200    HE   ARG  28           HE       ARG  28   2.623  10.379   8.098
  201   HH11  ARG  28          HH11      ARG  28   1.638   8.084  10.524
  202   HH12  ARG  28          HH12      ARG  28   2.745   6.859  10.000
  203   HH21  ARG  28          HH21      ARG  28   4.084   8.774   7.399
  204   HH22  ARG  28          HH22      ARG  28   4.136   7.252   8.223
  205    H    LEU  29           HN       LEU  29   4.172  14.790  10.998
  206    HA   LEU  29           HA       LEU  29   3.677  15.187  13.756
  207    HB2  LEU  29           HB1      LEU  29   5.936  15.708  11.897
  208    HB3  LEU  29           HB2      LEU  29   5.948  16.517  13.463
  209    HG   LEU  29           HG       LEU  29   5.622  13.542  13.269
  210   HD11  LEU  29          HD11      LEU  29   8.236  13.824  13.870
  211   HD12  LEU  29          HD12      LEU  29   8.029  15.143  12.718
  212   HD13  LEU  29          HD13      LEU  29   7.626  13.492  12.249
  213   HD21  LEU  29          HD21      LEU  29   6.270  15.552  15.362
  214   HD22  LEU  29          HD22      LEU  29   6.991  13.947  15.491
  215   HD23  LEU  29          HD23      LEU  29   5.236  14.125  15.443
  216    H    ALA  30           HN       ALA  30   3.803  17.361  10.989
  217    HA   ALA  30           HA       ALA  30   3.730  19.789  12.425
  218    HB1  ALA  30           HB1      ALA  30   4.008  19.117   9.801
  219    HB2  ALA  30           HB2      ALA  30   2.384  19.807   9.823
  220    HB3  ALA  30           HB3      ALA  30   3.754  20.756  10.402
  221    H    ASN  31           HN       ASN  31   1.234  17.556  11.399
  222    HA   ASN  31           HA       ASN  31  -0.897  19.377  12.165
  223    HB2  ASN  31           HB1      ASN  31  -0.963  17.732  10.181
  224    HB3  ASN  31           HB2      ASN  31  -1.254  16.489  11.393
  225   HD21  ASN  31          HD21      ASN  31  -3.312  15.982  10.887
  226   HD22  ASN  31          HD22      ASN  31  -4.639  17.082  11.002
  227    H    GLY  32           HN       GLY  32  -0.386  19.578  14.406
  228    HA2  GLY  32           HA1      GLY  32  -1.759  18.645  16.338
  229    HA3  GLY  32           HA2      GLY  32  -0.905  17.147  15.996
  230    H    GLY  33           HN       GLY  33   1.574  18.702  15.340
  231    HA2  GLY  33           HA1      GLY  33   2.381  19.196  18.136
  232    HA3  GLY  33           HA2      GLY  33   3.453  18.597  16.879
  233    H    ASN  34           HN       ASN  34   1.873  21.398  18.218
  234    HA   ASN  34           HA       ASN  34   3.150  23.171  16.286
  235    HB2  ASN  34           HB1      ASN  34   1.316  23.810  18.608
  236    HB3  ASN  34           HB2      ASN  34   1.875  24.957  17.394
  237   HD21  ASN  34          HD21      ASN  34   0.560  25.314  15.766
  238   HD22  ASN  34          HD22      ASN  34  -0.690  24.257  15.216
  239    H    GLY  35           HN       GLY  35   3.352  22.239  19.664
  240    HA2  GLY  35           HA1      GLY  35   5.234  24.298  20.364
  241    HA3  GLY  35           HA2      GLY  35   4.781  22.918  21.353
  242    H    PHE  36           HN       PHE  36   6.949  22.578  21.953
  243    HA   PHE  36           HA       PHE  36   8.993  21.591  21.822
  244    HB2  PHE  36           HB1      PHE  36   8.011  20.359  19.243
  245    HB3  PHE  36           HB2      PHE  36   9.279  19.751  20.302
  246    HD1  PHE  36           HD2      PHE  36   8.230  19.723  22.915
  247    HD2  PHE  36           HD1      PHE  36   6.188  18.980  19.255
  248    HE1  PHE  36           HE2      PHE  36   6.571  18.364  24.120
  249    HE2  PHE  36           HE1      PHE  36   4.525  17.620  20.455
  250    HZ   PHE  36           HZ       PHE  36   4.716  17.310  22.891
  251    H    TRP  37           HN       TRP  37   8.600  24.196  20.647
  252    HA   TRP  37           HA       TRP  37  10.987  24.253  18.979
  253    HB2  TRP  37           HB1      TRP  37   8.987  24.098  17.449
  254    HB3  TRP  37           HB2      TRP  37   8.462  25.654  18.087
  255    HD1  TRP  37           HD1      TRP  37  11.586  24.191  16.301
  256    HE1  TRP  37           HE1      TRP  37  12.539  26.018  14.758
  257    HE3  TRP  37           HE3      TRP  37   8.386  27.999  17.481
  258    HZ2  TRP  37           HZ2      TRP  37  12.005  28.717  14.127
  259    HZ3  TRP  37           HZ3      TRP  37   8.676  30.172  16.363
  260    HH2  TRP  37           HH2      TRP  37  10.449  30.521  14.721
  Start of MODEL   15
    1    H1   LYS   1           HN       LYS   1   5.236  -6.101  -9.174
    2    HA   LYS   1           HA       LYS   1   2.920  -7.398  -8.037
    3    HB2  LYS   1           HB1      LYS   1   4.634  -8.314  -9.797
    4    HB3  LYS   1           HB2      LYS   1   5.574  -8.747  -8.375
    5    HG2  LYS   1           HG1      LYS   1   4.380 -10.674  -8.810
    6    HG3  LYS   1           HG2      LYS   1   3.404  -9.887  -7.568
    7    HD2  LYS   1           HD1      LYS   1   1.788  -9.195  -9.115
    8    HD3  LYS   1           HD2      LYS   1   2.866  -9.453 -10.489
    9    HE2  LYS   1           HE1      LYS   1   1.811 -11.656  -8.722
   10    HE3  LYS   1           HE2      LYS   1   1.070 -11.171 -10.246
   11    HZ1  LYS   1           HZ1      LYS   1   2.450 -12.574 -11.235
   12    HZ2  LYS   1           HZ2      LYS   1   3.306 -12.859  -9.804
   13    HZ3  LYS   1           HZ3      LYS   1   3.739 -11.565 -10.804
   14    H    TYR   2           HN       TYR   2   5.963  -6.158  -6.933
   15    HA   TYR   2           HA       TYR   2   5.881  -7.589  -4.419
   16    HB2  TYR   2           HB1      TYR   2   7.721  -5.511  -5.584
   17    HB3  TYR   2           HB2      TYR   2   7.842  -6.004  -3.899
   18    HD1  TYR   2           HD2      TYR   2   7.480  -8.848  -3.919
   19    HD2  TYR   2           HD1      TYR   2   9.490  -6.407  -6.765
   20    HE1  TYR   2           HE2      TYR   2   8.868 -10.769  -4.577
   21    HE2  TYR   2           HE1      TYR   2  10.882  -8.321  -7.433
   22    HH   TYR   2           HH       TYR   2  11.541 -10.743  -5.893
   23    H    TYR   3           HN       TYR   3   4.341  -7.003  -3.027
   24    HA   TYR   3           HA       TYR   3   3.388  -4.287  -2.862
   25    HB2  TYR   3           HB1      TYR   3   2.688  -6.856  -1.472
   26    HB3  TYR   3           HB2      TYR   3   2.069  -5.319  -0.878
   27    HD1  TYR   3           HD1      TYR   3   0.655  -3.904  -2.414
   28    HD2  TYR   3           HD2      TYR   3   1.706  -7.923  -3.334
   29    HE1  TYR   3           HE1      TYR   3  -1.174  -4.001  -4.055
   30    HE2  TYR   3           HE2      TYR   3  -0.119  -8.030  -4.979
   31    HH   TYR   3           HH       TYR   3  -2.598  -5.798  -5.120
   32    H    GLY   4           HN       GLY   4   5.450  -6.425  -0.978
   33    HA2  GLY   4           HA1      GLY   4   6.222  -4.096   0.656
   34    HA3  GLY   4           HA2      GLY   4   5.870  -5.639   1.421
   35    H    ASN   5           HN       ASN   5   7.091  -7.393  -0.338
   36    HA   ASN   5           HA       ASN   5   9.821  -7.119   0.462
   37    HB2  ASN   5           HB1      ASN   5   8.777  -9.131  -1.525
   38    HB3  ASN   5           HB2      ASN   5  10.146  -9.290  -0.428
   39   HD21  ASN   5          HD21      ASN   5   9.610  -9.239   1.907
   40   HD22  ASN   5          HD22      ASN   5   8.156 -10.022   2.414
   41    H    GLY   6           HN       GLY   6  10.228  -5.055  -0.637
   42    HA2  GLY   6           HA1      GLY   6  10.518  -5.237  -3.546
   43    HA3  GLY   6           HA2      GLY   6  10.640  -3.772  -2.583
   44    H    VAL   7           HN       VAL   7  12.304  -6.754  -3.465
   45    HA   VAL   7           HA       VAL   7  14.759  -6.142  -2.200
   46    HB   VAL   7           HB       VAL   7  15.737  -7.855  -3.705
   47   HG11  VAL   7          HG11      VAL   7  13.125  -8.615  -2.400
   48   HG12  VAL   7          HG12      VAL   7  14.403  -9.741  -2.863
   49   HG13  VAL   7          HG13      VAL   7  14.702  -8.531  -1.615
   50   HG21  VAL   7          HG21      VAL   7  14.128  -9.121  -5.160
   51   HG22  VAL   7          HG22      VAL   7  12.986  -7.797  -4.931
   52   HG23  VAL   7          HG23      VAL   7  14.531  -7.501  -5.727
   53    H    HIS   8           HN       HIS   8  13.507  -5.532  -5.446
   54    HA   HIS   8           HA       HIS   8  15.948  -4.458  -6.462
   55    HB2  HIS   8           HB1      HIS   8  13.095  -4.427  -7.421
   56    HB3  HIS   8           HB2      HIS   8  14.354  -3.529  -8.264
   57    HD1  HIS   8           HD1      HIS   8  13.008  -6.935  -7.769
   58    HD2  HIS   8           HD2      HIS   8  16.338  -5.160  -9.508
   59    HE1  HIS   8           HE1      HIS   8  14.049  -8.719  -9.203
   60    H    LEU   9           HN       LEU   9  13.180  -3.150  -4.785
   61    HA   LEU   9           HA       LEU   9  13.594  -0.422  -5.380
   62    HB2  LEU   9           HB1      LEU   9  11.499  -0.928  -4.516
   63    HB3  LEU   9           HB2      LEU   9  12.167  -1.906  -3.210
   64    HG   LEU   9           HG       LEU   9  12.755   1.004  -3.179
   65   HD11  LEU   9          HD11      LEU   9  10.335   0.797  -3.789
   66   HD12  LEU   9          HD12      LEU   9  10.649   1.604  -2.253
   67   HD13  LEU   9          HD13      LEU   9  10.094  -0.070  -2.272
   68   HD21  LEU   9          HD21      LEU   9  13.552   0.315  -1.220
   69   HD22  LEU   9          HD22      LEU   9  12.781  -1.263  -1.385
   70   HD23  LEU   9          HD23      LEU   9  11.880   0.093  -0.704
   71    H    THR  10           HN       THR  10  15.199  -2.607  -3.261
   72    HA   THR  10           HA       THR  10  16.245  -0.729  -1.409
   73    HB   THR  10           HB       THR  10  17.654  -3.282  -2.142
   74    HG1  THR  10           HG1      THR  10  16.165  -4.200  -0.487
   75   HG21  THR  10          HG21      THR  10  18.385  -3.278   0.100
   76   HG22  THR  10          HG22      THR  10  17.181  -2.079   0.575
   77   HG23  THR  10          HG23      THR  10  18.545  -1.606  -0.438
   78    H    LYS  11           HN       LYS  11  17.910  -2.467  -4.047
   79    HA   LYS  11           HA       LYS  11  20.178  -0.759  -3.988
   80    HB2  LYS  11           HB1      LYS  11  19.189  -2.930  -5.783
   81    HB3  LYS  11           HB2      LYS  11  20.463  -1.873  -6.376
   82    HG2  LYS  11           HG1      LYS  11  21.887  -2.479  -4.528
   83    HG3  LYS  11           HG2      LYS  11  20.595  -3.445  -3.810
   84    HD2  LYS  11           HD1      LYS  11  21.941  -5.020  -4.889
   85    HD3  LYS  11           HD2      LYS  11  20.616  -4.749  -6.024
   86    HE2  LYS  11           HE1      LYS  11  22.063  -3.105  -7.212
   87    HE3  LYS  11           HE2      LYS  11  23.387  -3.564  -6.142
   88    HZ1  LYS  11           HZ1      LYS  11  23.497  -5.679  -7.059
   89    HZ2  LYS  11           HZ2      LYS  11  23.227  -4.696  -8.408
   90    HZ3  LYS  11           HZ3      LYS  11  21.952  -5.588  -7.744
   91    H    SER  12           HN       SER  12  17.115  -0.624  -5.592
   92    HA   SER  12           HA       SER  12  17.787   1.086  -7.728
   93    HB2  SER  12           HB1      SER  12  15.244   0.395  -6.303
   94    HB3  SER  12           HB2      SER  12  15.254   1.741  -7.443
   95    HG   SER  12           HG       SER  12  15.126   0.301  -8.952
   96    H    GLY  13           HN       GLY  13  17.307   1.654  -4.348
   97    HA2  GLY  13           HA1      GLY  13  18.525   3.957  -3.949
   98    HA3  GLY  13           HA2      GLY  13  17.067   4.543  -4.735
   99    H    LEU  14           HN       LEU  14  17.813   2.144  -2.200
  100    HA   LEU  14           HA       LEU  14  15.438   2.430  -0.785
  101    HB2  LEU  14           HB1      LEU  14  16.412   1.166   0.888
  102    HB3  LEU  14           HB2      LEU  14  17.322   0.696  -0.546
  103    HG   LEU  14           HG       LEU  14  18.277   2.686   1.511
  104   HD11  LEU  14          HD11      LEU  14  19.671   0.132   1.276
  105   HD12  LEU  14          HD12      LEU  14  18.026  -0.009   1.893
  106   HD13  LEU  14          HD13      LEU  14  19.187   1.036   2.711
  107   HD21  LEU  14          HD21      LEU  14  19.366   1.613  -1.039
  108   HD22  LEU  14          HD22      LEU  14  20.487   1.917   0.288
  109   HD23  LEU  14          HD23      LEU  14  19.492   3.229  -0.344
  110    H    SER  15           HN       SER  15  18.163   4.517  -0.958
  111    HA   SER  15           HA       SER  15  17.936   5.842   1.515
  112    HB2  SER  15           HB1      SER  15  19.067   6.658  -1.156
  113    HB3  SER  15           HB2      SER  15  19.072   7.756   0.224
  114    HG   SER  15           HG       SER  15  20.138   5.136   0.347
  115    H    VAL  16           HN       VAL  16  15.978   5.910  -1.288
  116    HA   VAL  16           HA       VAL  16  14.899   8.524  -1.025
  117    HB   VAL  16           HB       VAL  16  14.767   7.067  -3.086
  118   HG11  VAL  16          HG11      VAL  16  13.524   5.200  -3.176
  119   HG12  VAL  16          HG12      VAL  16  13.656   5.225  -1.417
  120   HG13  VAL  16          HG13      VAL  16  12.228   5.897  -2.205
  121   HG21  VAL  16          HG21      VAL  16  12.749   8.827  -1.952
  122   HG22  VAL  16          HG22      VAL  16  13.436   8.792  -3.576
  123   HG23  VAL  16          HG23      VAL  16  12.091   7.729  -3.164
  124    H    ASN  17           HN       ASN  17  14.351   5.557   0.629
  125    HA   ASN  17           HA       ASN  17  11.695   6.055   1.509
  126    HB2  ASN  17           HB1      ASN  17  12.744   3.804   1.504
  127    HB3  ASN  17           HB2      ASN  17  13.818   4.326   2.799
  128   HD21  ASN  17          HD21      ASN  17  10.383   4.082   1.980
  129   HD22  ASN  17          HD22      ASN  17   9.854   3.675   3.574
  130    H    TRP  18           HN       TRP  18  14.853   6.994   2.650
  131    HA   TRP  18           HA       TRP  18  14.229   7.707   5.280
  132    HB2  TRP  18           HB1      TRP  18  16.528   7.597   4.552
  133    HB3  TRP  18           HB2      TRP  18  16.260   8.873   3.368
  134    HD1  TRP  18           HD1      TRP  18  15.432   8.803   7.165
  135    HE1  TRP  18           HE1      TRP  18  16.503  10.881   8.242
  136    HE3  TRP  18           HE3      TRP  18  17.774  10.732   3.051
  137    HZ2  TRP  18           HZ2      TRP  18  18.126  13.051   7.451
  138    HZ3  TRP  18           HZ3      TRP  18  19.065  12.813   3.296
  139    HH2  TRP  18           HH2      TRP  18  19.235  13.947   5.451
  140    H    GLY  19           HN       GLY  19  14.161   9.670   2.310
  141    HA2  GLY  19           HA1      GLY  19  13.328  12.068   3.520
  142    HA3  GLY  19           HA2      GLY  19  13.104  11.649   1.828
  143    H    GLU  20           HN       GLU  20  11.464   9.377   2.176
  144    HA   GLU  20           HA       GLU  20   8.934  10.623   2.402
  145    HB2  GLU  20           HB1      GLU  20   9.887   7.813   2.044
  146    HB3  GLU  20           HB2      GLU  20   8.203   8.089   2.465
  147    HG2  GLU  20           HG1      GLU  20   9.545   9.407   0.124
  148    HG3  GLU  20           HG2      GLU  20   8.705   7.861   0.015
  149    H    ALA  21           HN       ALA  21  10.745   8.466   4.549
  150    HA   ALA  21           HA       ALA  21   8.746   8.183   6.515
  151    HB1  ALA  21           HB1      ALA  21  11.506   8.121   7.495
  152    HB2  ALA  21           HB2      ALA  21  10.244   6.890   7.569
  153    HB3  ALA  21           HB3      ALA  21  11.202   7.084   6.101
  154    H    PHE  22           HN       PHE  22  11.235  10.606   5.993
  155    HA   PHE  22           HA       PHE  22  11.009  11.886   8.508
  156    HB2  PHE  22           HB1      PHE  22  12.822  12.099   6.614
  157    HB3  PHE  22           HB2      PHE  22  11.782  13.400   6.045
  158    HD1  PHE  22           HD2      PHE  22  13.828  12.229   8.881
  159    HD2  PHE  22           HD1      PHE  22  11.732  15.495   7.132
  160    HE1  PHE  22           HE2      PHE  22  14.866  13.760  10.504
  161    HE2  PHE  22           HE1      PHE  22  12.768  17.031   8.751
  162    HZ   PHE  22           HZ       PHE  22  14.336  16.164  10.441
  163    H    SER  23           HN       SER  23   9.570  12.588   5.336
  164    HA   SER  23           HA       SER  23   8.151  14.881   6.072
  165    HB2  SER  23           HB1      SER  23   7.416  12.810   3.988
  166    HB3  SER  23           HB2      SER  23   6.759  14.444   4.087
  167    HG   SER  23           HG       SER  23   9.539  14.088   3.962
  168    H    ALA  24           HN       ALA  24   7.509  11.521   6.643
  169    HA   ALA  24           HA       ALA  24   4.772  11.505   7.066
  170    HB1  ALA  24           HB1      ALA  24   6.866   9.723   7.447
  171    HB2  ALA  24           HB2      ALA  24   6.143   9.905   9.046
  172    HB3  ALA  24           HB3      ALA  24   5.148   9.401   7.680
  173    H    GLY  25           HN       GLY  25   7.339  12.131   9.464
  174    HA2  GLY  25           HA1      GLY  25   5.566  12.713  11.592
  175    HA3  GLY  25           HA2      GLY  25   7.267  13.148  11.523
  176    H    VAL  26           HN       VAL  26   7.238  14.798   9.265
  177    HA   VAL  26           HA       VAL  26   6.560  17.267  10.369
  178    HB   VAL  26           HB       VAL  26   6.887  16.586   7.443
  179   HG11  VAL  26          HG11      VAL  26   6.095  18.686   7.217
  180   HG12  VAL  26          HG12      VAL  26   6.448  19.113   8.893
  181   HG13  VAL  26          HG13      VAL  26   7.735  19.134   7.686
  182   HG21  VAL  26          HG21      VAL  26   8.810  15.959   8.871
  183   HG22  VAL  26          HG22      VAL  26   9.197  17.230   7.711
  184   HG23  VAL  26          HG23      VAL  26   8.923  17.636   9.405
  185    H    HIS  27           HN       HIS  27   4.713  15.089   8.330
  186    HA   HIS  27           HA       HIS  27   2.650  16.870   7.614
  187    HB2  HIS  27           HB1      HIS  27   3.096  14.644   6.548
  188    HB3  HIS  27           HB2      HIS  27   2.415  13.878   7.981
  189    HD1  HIS  27           HD1      HIS  27  -0.167  14.243   8.387
  190    HD2  HIS  27           HD2      HIS  27   1.257  15.584   4.722
  191    HE1  HIS  27           HE1      HIS  27  -2.208  14.593   6.960
  192    H    ARG  28           HN       ARG  28   3.057  14.694  10.369
  193    HA   ARG  28           HA       ARG  28   0.479  15.106  11.468
  194    HB2  ARG  28           HB1      ARG  28   3.043  13.929  12.410
  195    HB3  ARG  28           HB2      ARG  28   1.870  14.395  13.635
  196    HG2  ARG  28           HG1      ARG  28   1.578  12.077  13.094
  197    HG3  ARG  28           HG2      ARG  28   0.185  12.988  12.507
  198    HD2  ARG  28           HD1      ARG  28   1.239  13.037  10.257
  199    HD3  ARG  28           HD2      ARG  28   2.519  11.995  10.878
  200    HE   ARG  28           HE       ARG  28  -0.130  11.211  10.123
  201   HH11  ARG  28          HH11      ARG  28   2.573  10.453  12.182
  202   HH12  ARG  28          HH12      ARG  28   2.167   8.774  12.317
  203   HH21  ARG  28          HH21      ARG  28  -0.675   9.003  10.293
  204   HH22  ARG  28          HH22      ARG  28   0.320   7.950  11.241
  205    H    LEU  29           HN       LEU  29   3.647  16.547  12.191
  206    HA   LEU  29           HA       LEU  29   2.789  18.233  14.263
  207    HB2  LEU  29           HB1      LEU  29   5.127  18.140  12.434
  208    HB3  LEU  29           HB2      LEU  29   4.841  19.631  13.329
  209    HG   LEU  29           HG       LEU  29   4.932  17.046  14.816
  210   HD11  LEU  29          HD11      LEU  29   7.230  16.896  14.846
  211   HD12  LEU  29          HD12      LEU  29   7.454  18.562  14.314
  212   HD13  LEU  29          HD13      LEU  29   6.924  17.334  13.165
  213   HD21  LEU  29          HD21      LEU  29   4.518  18.626  16.365
  214   HD22  LEU  29          HD22      LEU  29   5.153  19.930  15.361
  215   HD23  LEU  29          HD23      LEU  29   6.258  18.895  16.268
  216    H    ALA  30           HN       ALA  30   2.636  18.545  10.795
  217    HA   ALA  30           HA       ALA  30   2.226  21.313  10.590
  218    HB1  ALA  30           HB1      ALA  30   2.501  19.338   8.795
  219    HB2  ALA  30           HB2      ALA  30   0.757  19.585   8.700
  220    HB3  ALA  30           HB3      ALA  30   1.856  20.930   8.394
  221    H    ASN  31           HN       ASN  31   0.073  18.701  11.457
  222    HA   ASN  31           HA       ASN  31  -2.296  20.357  11.272
  223    HB2  ASN  31           HB1      ASN  31  -2.188  17.833  10.816
  224    HB3  ASN  31           HB2      ASN  31  -2.132  17.640  12.566
  225   HD21  ASN  31          HD21      ASN  31  -4.066  16.776  12.982
  226   HD22  ASN  31          HD22      ASN  31  -5.581  17.510  12.592
  227    H    GLY  32           HN       GLY  32  -0.287  18.916  13.812
  228    HA2  GLY  32           HA1      GLY  32  -1.881  20.180  15.893
  229    HA3  GLY  32           HA2      GLY  32  -0.500  19.120  16.135
  230    H    GLY  33           HN       GLY  33   1.605  19.983  16.063
  231    HA2  GLY  33           HA1      GLY  33   3.223  21.644  16.120
  232    HA3  GLY  33           HA2      GLY  33   2.002  22.806  15.624
  233    H    ASN  34           HN       ASN  34   1.683  20.689  18.404
  234    HA   ASN  34           HA       ASN  34   1.477  23.048  20.111
  235    HB2  ASN  34           HB1      ASN  34   0.933  20.184  20.895
  236    HB3  ASN  34           HB2      ASN  34   0.371  21.649  21.696
  237   HD21  ASN  34          HD21      ASN  34  -0.739  19.185  20.052
  238   HD22  ASN  34          HD22      ASN  34  -2.012  19.919  19.142
  239    H    GLY  35           HN       GLY  35   3.538  23.690  20.578
  240    HA2  GLY  35           HA1      GLY  35   4.923  22.508  22.667
  241    HA3  GLY  35           HA2      GLY  35   5.658  21.897  21.193
  242    H    PHE  36           HN       PHE  36   7.412  22.974  20.625
  243    HA   PHE  36           HA       PHE  36   7.836  25.678  21.594
  244    HB2  PHE  36           HB1      PHE  36   9.633  23.943  21.703
  245    HB3  PHE  36           HB2      PHE  36   9.685  23.945  19.944
  246    HD1  PHE  36           HD2      PHE  36  10.274  25.998  22.953
  247    HD2  PHE  36           HD1      PHE  36  10.860  25.607  18.755
  248    HE1  PHE  36           HE2      PHE  36  11.882  27.859  23.007
  249    HE2  PHE  36           HE1      PHE  36  12.470  27.467  18.803
  250    HZ   PHE  36           HZ       PHE  36  12.982  28.597  20.931
  251    H    TRP  37           HN       TRP  37   7.334  23.985  18.558
  252    HA   TRP  37           HA       TRP  37   7.719  26.397  16.994
  253    HB2  TRP  37           HB1      TRP  37   7.048  23.544  16.306
  254    HB3  TRP  37           HB2      TRP  37   6.954  24.827  15.103
  255    HD1  TRP  37           HD1      TRP  37   9.380  22.514  16.756
  256    HE1  TRP  37           HE1      TRP  37  11.765  22.998  15.917
  257    HE3  TRP  37           HE3      TRP  37   8.507  26.932  14.337
  258    HZ2  TRP  37           HZ2      TRP  37  13.099  24.990  14.426
  259    HZ3  TRP  37           HZ3      TRP  37  10.391  28.063  13.230
  260    HH2  TRP  37           HH2      TRP  37  12.639  27.111  13.276
  Start of MODEL   16
    1    H1   LYS   1           HN       LYS   1   3.327   3.060  -3.881
    2    HA   LYS   1           HA       LYS   1   1.389   1.180  -5.063
    3    HB2  LYS   1           HB1      LYS   1   3.655   2.734  -6.295
    4    HB3  LYS   1           HB2      LYS   1   2.961   1.326  -7.088
    5    HG2  LYS   1           HG1      LYS   1   0.797   2.396  -7.178
    6    HG3  LYS   1           HG2      LYS   1   1.418   3.783  -6.280
    7    HD2  LYS   1           HD1      LYS   1   2.577   2.900  -8.914
    8    HD3  LYS   1           HD2      LYS   1   1.241   4.049  -8.798
    9    HE2  LYS   1           HE1      LYS   1   2.585   5.599  -7.583
   10    HE3  LYS   1           HE2      LYS   1   3.878   4.417  -7.390
   11    HZ1  LYS   1           HZ1      LYS   1   4.747   5.065  -9.303
   12    HZ2  LYS   1           HZ2      LYS   1   3.569   6.271  -9.431
   13    HZ3  LYS   1           HZ3      LYS   1   3.304   4.753 -10.129
   14    H    TYR   2           HN       TYR   2   3.154   0.723  -2.756
   15    HA   TYR   2           HA       TYR   2   5.221  -1.058  -3.733
   16    HB2  TYR   2           HB1      TYR   2   4.326  -0.602  -0.882
   17    HB3  TYR   2           HB2      TYR   2   5.832  -1.341  -1.413
   18    HD1  TYR   2           HD1      TYR   2   7.457   0.129  -2.752
   19    HD2  TYR   2           HD2      TYR   2   4.212   1.699  -0.492
   20    HE1  TYR   2           HE1      TYR   2   8.554   2.330  -2.719
   21    HE2  TYR   2           HE2      TYR   2   5.300   3.905  -0.453
   22    HH   TYR   2           HH       TYR   2   7.670   4.792  -0.656
   23    H    TYR   3           HN       TYR   3   5.074  -3.204  -3.929
   24    HA   TYR   3           HA       TYR   3   2.509  -4.463  -3.431
   25    HB2  TYR   3           HB1      TYR   3   5.034  -5.381  -4.802
   26    HB3  TYR   3           HB2      TYR   3   3.667  -6.455  -4.526
   27    HD1  TYR   3           HD2      TYR   3   1.435  -5.858  -5.556
   28    HD2  TYR   3           HD1      TYR   3   5.052  -3.886  -6.622
   29    HE1  TYR   3           HE2      TYR   3   0.380  -5.054  -7.627
   30    HE2  TYR   3           HE1      TYR   3   4.005  -3.075  -8.695
   31    HH   TYR   3           HH       TYR   3   1.722  -4.180 -10.158
   32    H    GLY   4           HN       GLY   4   3.415  -3.832  -1.025
   33    HA2  GLY   4           HA1      GLY   4   3.350  -5.138   0.968
   34    HA3  GLY   4           HA2      GLY   4   4.143  -6.445   0.101
   35    H    ASN   5           HN       ASN   5   6.055  -6.817   0.999
   36    HA   ASN   5           HA       ASN   5   7.530  -4.772   2.364
   37    HB2  ASN   5           HB1      ASN   5   8.343  -7.595   1.635
   38    HB3  ASN   5           HB2      ASN   5   9.191  -6.540   2.762
   39   HD21  ASN   5          HD21      ASN   5   7.350  -5.487   4.314
   40   HD22  ASN   5          HD22      ASN   5   6.440  -6.696   5.149
   41    H    GLY   6           HN       GLY   6   8.647  -6.965  -0.218
   42    HA2  GLY   6           HA1      GLY   6   9.548  -6.259  -2.302
   43    HA3  GLY   6           HA2      GLY   6   9.794  -4.658  -1.620
   44    H    VAL   7           HN       VAL   7  10.984  -7.977  -1.613
   45    HA   VAL   7           HA       VAL   7  13.287  -7.490  -0.041
   46    HB   VAL   7           HB       VAL   7  14.143  -9.618  -0.991
   47   HG11  VAL   7          HG11      VAL   7  11.248  -9.848  -0.190
   48   HG12  VAL   7          HG12      VAL   7  12.537 -11.026   0.065
   49   HG13  VAL   7          HG13      VAL   7  12.551  -9.498   0.945
   50   HG21  VAL   7          HG21      VAL   7  13.484  -9.951  -3.126
   51   HG22  VAL   7          HG22      VAL   7  12.136 -10.783  -2.353
   52   HG23  VAL   7          HG23      VAL   7  11.947  -9.117  -2.898
   53    H    HIS   8           HN       HIS   8  12.686  -7.426  -3.523
   54    HA   HIS   8           HA       HIS   8  15.411  -6.979  -4.241
   55    HB2  HIS   8           HB1      HIS   8  13.382  -7.852  -5.671
   56    HB3  HIS   8           HB2      HIS   8  13.141  -6.139  -6.002
   57    HD1  HIS   8           HD1      HIS   8  15.501  -4.930  -6.890
   58    HD2  HIS   8           HD2      HIS   8  15.044  -9.022  -7.443
   59    HE1  HIS   8           HE1      HIS   8  17.133  -5.550  -8.700
   60    H    LEU   9           HN       LEU   9  12.714  -4.935  -3.394
   61    HA   LEU   9           HA       LEU   9  13.679  -2.497  -4.416
   62    HB2  LEU   9           HB1      LEU   9  11.437  -2.498  -3.806
   63    HB3  LEU   9           HB2      LEU   9  11.764  -3.241  -2.241
   64    HG   LEU   9           HG       LEU   9  12.837  -0.513  -2.712
   65   HD11  LEU   9          HD11      LEU   9   9.967  -1.212  -2.751
   66   HD12  LEU   9          HD12      LEU   9  10.812   0.170  -3.448
   67   HD13  LEU   9          HD13      LEU   9  10.440   0.143  -1.725
   68   HD21  LEU   9          HD21      LEU   9  13.264  -0.851  -0.556
   69   HD22  LEU   9          HD22      LEU   9  12.254  -2.297  -0.511
   70   HD23  LEU   9          HD23      LEU   9  11.530  -0.706  -0.269
   71    H    THR  10           HN       THR  10  14.591  -4.368  -1.671
   72    HA   THR  10           HA       THR  10  15.727  -2.299  -0.098
   73    HB   THR  10           HB       THR  10  16.635  -5.175  -0.096
   74    HG1  THR  10           HG1      THR  10  14.799  -5.723   0.830
   75   HG21  THR  10          HG21      THR  10  17.540  -4.754   1.947
   76   HG22  THR  10          HG22      THR  10  16.301  -3.573   2.372
   77   HG23  THR  10          HG23      THR  10  17.627  -3.116   1.303
   78    H    LYS  11           HN       LYS  11  17.358  -4.824  -2.025
   79    HA   LYS  11           HA       LYS  11  19.875  -3.510  -1.953
   80    HB2  LYS  11           HB1      LYS  11  18.786  -5.763  -3.636
   81    HB3  LYS  11           HB2      LYS  11  20.432  -5.168  -3.809
   82    HG2  LYS  11           HG1      LYS  11  20.493  -5.585  -1.208
   83    HG3  LYS  11           HG2      LYS  11  19.193  -6.715  -1.598
   84    HD2  LYS  11           HD1      LYS  11  20.989  -8.101  -1.861
   85    HD3  LYS  11           HD2      LYS  11  20.891  -7.442  -3.496
   86    HE2  LYS  11           HE1      LYS  11  22.569  -6.101  -1.410
   87    HE3  LYS  11           HE2      LYS  11  23.182  -7.504  -2.284
   88    HZ1  LYS  11           HZ1      LYS  11  23.904  -5.709  -3.534
   89    HZ2  LYS  11           HZ2      LYS  11  22.464  -4.844  -3.340
   90    HZ3  LYS  11           HZ3      LYS  11  22.508  -6.193  -4.359
   91    H    SER  12           HN       SER  12  17.109  -3.284  -4.021
   92    HA   SER  12           HA       SER  12  18.340  -2.228  -6.325
   93    HB2  SER  12           HB1      SER  12  16.065  -3.052  -6.422
   94    HB3  SER  12           HB2      SER  12  15.538  -1.850  -5.243
   95    HG   SER  12           HG       SER  12  15.568  -1.593  -7.842
   96    H    GLY  13           HN       GLY  13  17.558  -0.838  -3.253
   97    HA2  GLY  13           HA1      GLY  13  19.117   1.284  -3.142
   98    HA3  GLY  13           HA2      GLY  13  17.899   1.888  -4.255
   99    H    LEU  14           HN       LEU  14  17.878   0.048  -1.198
  100    HA   LEU  14           HA       LEU  14  15.438   1.003  -0.269
  101    HB2  LEU  14           HB1      LEU  14  15.952   0.022   1.761
  102    HB3  LEU  14           HB2      LEU  14  16.931  -0.893   0.617
  103    HG   LEU  14           HG       LEU  14  17.971   1.346   2.350
  104   HD11  LEU  14          HD11      LEU  14  17.167  -0.766   3.534
  105   HD12  LEU  14          HD12      LEU  14  18.826  -0.250   3.832
  106   HD13  LEU  14          HD13      LEU  14  18.504  -1.583   2.724
  107   HD21  LEU  14          HD21      LEU  14  19.153  -0.433   0.282
  108   HD22  LEU  14          HD22      LEU  14  20.138  -0.004   1.681
  109   HD23  LEU  14          HD23      LEU  14  19.483   1.262   0.641
  110    H    SER  15           HN       SER  15  18.497   2.560  -0.426
  111    HA   SER  15           HA       SER  15  18.211   4.434   1.655
  112    HB2  SER  15           HB1      SER  15  19.936   5.727   0.476
  113    HB3  SER  15           HB2      SER  15  20.355   4.014   0.522
  114    HG   SER  15           HG       SER  15  19.797   5.632  -1.623
  115    H    VAL  16           HN       VAL  16  16.659   4.153  -1.379
  116    HA   VAL  16           HA       VAL  16  16.050   6.890  -1.833
  117    HB   VAL  16           HB       VAL  16  15.909   5.037  -3.546
  118   HG11  VAL  16          HG11      VAL  16  14.286   3.815  -1.735
  119   HG12  VAL  16          HG12      VAL  16  13.111   4.495  -2.862
  120   HG13  VAL  16          HG13      VAL  16  14.370   3.407  -3.448
  121   HG21  VAL  16          HG21      VAL  16  14.269   7.354  -3.183
  122   HG22  VAL  16          HG22      VAL  16  14.910   6.668  -4.676
  123   HG23  VAL  16          HG23      VAL  16  13.358   6.115  -4.047
  124    H    ASN  17           HN       ASN  17  14.771   4.499   0.284
  125    HA   ASN  17           HA       ASN  17  12.168   5.609   0.610
  126    HB2  ASN  17           HB1      ASN  17  12.521   3.305   1.204
  127    HB3  ASN  17           HB2      ASN  17  13.799   3.738   2.336
  128   HD21  ASN  17          HD21      ASN  17  10.352   4.061   1.698
  129   HD22  ASN  17          HD22      ASN  17   9.876   4.211   3.352
  130    H    TRP  18           HN       TRP  18  15.291   6.265   1.979
  131    HA   TRP  18           HA       TRP  18  14.569   7.558   4.342
  132    HB2  TRP  18           HB1      TRP  18  16.902   6.938   3.606
  133    HB3  TRP  18           HB2      TRP  18  16.873   8.351   2.555
  134    HD1  TRP  18           HD1      TRP  18  16.257   7.683   6.341
  135    HE1  TRP  18           HE1      TRP  18  17.343   9.607   7.662
  136    HE3  TRP  18           HE3      TRP  18  18.008  10.467   2.427
  137    HZ2  TRP  18           HZ2      TRP  18  18.754  11.990   7.116
  138    HZ3  TRP  18           HZ3      TRP  18  19.215  12.556   2.912
  139    HH2  TRP  18           HH2      TRP  18  19.579  13.300   5.209
  140    H    GLY  19           HN       GLY  19  15.079   8.933   1.094
  141    HA2  GLY  19           HA1      GLY  19  14.506  11.596   1.750
  142    HA3  GLY  19           HA2      GLY  19  14.343  10.890   0.149
  143    H    GLU  20           HN       GLU  20  12.352   9.000   0.655
  144    HA   GLU  20           HA       GLU  20  10.037  10.604   0.452
  145    HB2  GLU  20           HB1      GLU  20  10.570   7.669   0.617
  146    HB3  GLU  20           HB2      GLU  20   8.922   8.241   0.831
  147    HG2  GLU  20           HG1      GLU  20   9.351   9.531  -1.375
  148    HG3  GLU  20           HG2      GLU  20  10.672   8.382  -1.582
  149    H    ALA  21           HN       ALA  21  11.389   8.676   3.083
  150    HA   ALA  21           HA       ALA  21   9.216   8.958   4.865
  151    HB1  ALA  21           HB1      ALA  21  11.829   8.742   6.142
  152    HB2  ALA  21           HB2      ALA  21  10.436   7.662   6.215
  153    HB3  ALA  21           HB3      ALA  21  11.569   7.551   4.868
  154    H    PHE  22           HN       PHE  22  12.082  10.912   4.254
  155    HA   PHE  22           HA       PHE  22  11.839  12.628   6.477
  156    HB2  PHE  22           HB1      PHE  22  13.855  12.369   4.963
  157    HB3  PHE  22           HB2      PHE  22  13.007  13.377   3.795
  158    HD1  PHE  22           HD2      PHE  22  13.986  13.401   7.394
  159    HD2  PHE  22           HD1      PHE  22  13.419  15.633   3.815
  160    HE1  PHE  22           HE2      PHE  22  14.844  15.414   8.519
  161    HE2  PHE  22           HE1      PHE  22  14.277  17.650   4.933
  162    HZ   PHE  22           HZ       PHE  22  14.989  17.543   7.288
  163    H    SER  23           HN       SER  23  10.614  12.860   3.161
  164    HA   SER  23           HA       SER  23   9.542  15.420   3.263
  165    HB2  SER  23           HB1      SER  23   9.468  14.557   1.129
  166    HB3  SER  23           HB2      SER  23   8.946  12.964   1.676
  167    HG   SER  23           HG       SER  23   6.950  13.564   1.435
  168    H    ALA  24           HN       ALA  24   8.223  12.367   4.411
  169    HA   ALA  24           HA       ALA  24   5.598  13.196   4.927
  170    HB1  ALA  24           HB1      ALA  24   7.056  10.864   5.254
  171    HB2  ALA  24           HB2      ALA  24   6.576  11.307   6.893
  172    HB3  ALA  24           HB3      ALA  24   5.351  11.102   5.641
  173    H    GLY  25           HN       GLY  25   8.553  13.524   6.811
  174    HA2  GLY  25           HA1      GLY  25   7.267  14.410   9.202
  175    HA3  GLY  25           HA2      GLY  25   8.977  14.560   8.825
  176    H    VAL  26           HN       VAL  26   9.010  16.134   6.619
  177    HA   VAL  26           HA       VAL  26   8.747  18.709   7.653
  178    HB   VAL  26           HB       VAL  26   8.813  17.885   4.746
  179   HG11  VAL  26          HG11      VAL  26   8.305  20.060   4.455
  180   HG12  VAL  26          HG12      VAL  26   8.783  20.501   6.096
  181   HG13  VAL  26          HG13      VAL  26  10.008  20.305   4.841
  182   HG21  VAL  26          HG21      VAL  26  10.719  17.039   6.025
  183   HG22  VAL  26          HG22      VAL  26  11.216  18.298   4.895
  184   HG23  VAL  26          HG23      VAL  26  11.052  18.668   6.612
  185    H    HIS  27           HN       HIS  27   6.486  16.733   5.856
  186    HA   HIS  27           HA       HIS  27   4.660  18.746   5.124
  187    HB2  HIS  27           HB1      HIS  27   4.666  16.446   4.184
  188    HB3  HIS  27           HB2      HIS  27   4.071  15.840   5.727
  189    HD1  HIS  27           HD1      HIS  27   1.630  16.719   6.429
  190    HD2  HIS  27           HD2      HIS  27   2.731  17.324   2.469
  191    HE1  HIS  27           HE1      HIS  27  -0.513  17.195   5.201
  192    H    ARG  28           HN       ARG  28   4.874  16.690   8.000
  193    HA   ARG  28           HA       ARG  28   2.486  17.651   9.200
  194    HB2  ARG  28           HB1      ARG  28   3.611  15.491   9.770
  195    HB3  ARG  28           HB2      ARG  28   4.878  16.412  10.568
  196    HG2  ARG  28           HG1      ARG  28   3.567  15.908  12.358
  197    HG3  ARG  28           HG2      ARG  28   2.841  17.443  11.878
  198    HD2  ARG  28           HD1      ARG  28   1.066  16.317  10.731
  199    HD3  ARG  28           HD2      ARG  28   1.846  14.752  10.958
  200    HE   ARG  28           HE       ARG  28   1.260  16.094  13.424
  201   HH11  ARG  28          HH11      ARG  28  -0.026  14.042  10.924
  202   HH12  ARG  28          HH12      ARG  28  -1.237  13.338  11.943
  203   HH21  ARG  28          HH21      ARG  28  -0.330  15.175  14.776
  204   HH22  ARG  28          HH22      ARG  28  -1.410  13.984  14.134
  205    H    LEU  29           HN       LEU  29   5.753  18.805   9.081
  206    HA   LEU  29           HA       LEU  29   5.680  20.483  11.361
  207    HB2  LEU  29           HB1      LEU  29   7.653  19.677   9.808
  208    HB3  LEU  29           HB2      LEU  29   7.316  21.195   8.979
  209    HG   LEU  29           HG       LEU  29   8.142  20.867  11.862
  210   HD11  LEU  29          HD11      LEU  29  10.070  22.317  10.930
  211   HD12  LEU  29          HD12      LEU  29   9.557  21.696   9.362
  212   HD13  LEU  29          HD13      LEU  29  10.075  20.580  10.624
  213   HD21  LEU  29          HD21      LEU  29   7.456  23.337  10.273
  214   HD22  LEU  29          HD22      LEU  29   8.246  23.344  11.850
  215   HD23  LEU  29          HD23      LEU  29   6.607  22.712  11.688
  216    H    ALA  30           HN       ALA  30   5.303  21.225   7.894
  217    HA   ALA  30           HA       ALA  30   4.665  23.935   8.210
  218    HB1  ALA  30           HB1      ALA  30   4.988  22.192   6.079
  219    HB2  ALA  30           HB2      ALA  30   3.316  22.738   5.947
  220    HB3  ALA  30           HB3      ALA  30   4.627  23.916   5.986
  221    H    ASN  31           HN       ASN  31   2.765  21.073   8.647
  222    HA   ASN  31           HA       ASN  31   0.230  22.460   8.536
  223    HB2  ASN  31           HB1      ASN  31   1.070  19.633   9.110
  224    HB3  ASN  31           HB2      ASN  31  -0.567  20.168   9.480
  225   HD21  ASN  31          HD21      ASN  31  -1.559  18.897   7.970
  226   HD22  ASN  31          HD22      ASN  31  -1.400  19.148   6.268
  227    H    GLY  32           HN       GLY  32   2.317  21.033  11.025
  228    HA2  GLY  32           HA1      GLY  32   2.035  22.818  13.014
  229    HA3  GLY  32           HA2      GLY  32   0.543  21.899  13.150
  230    H    GLY  33           HN       GLY  33   3.585  22.160  14.339
  231    HA2  GLY  33           HA1      GLY  33   3.970  19.283  14.754
  232    HA3  GLY  33           HA2      GLY  33   5.145  20.542  15.103
  233    H    ASN  34           HN       ASN  34   2.033  19.216  16.165
  234    HA   ASN  34           HA       ASN  34   2.842  19.704  18.930
  235    HB2  ASN  34           HB1      ASN  34   0.089  20.471  17.950
  236    HB3  ASN  34           HB2      ASN  34   0.781  20.761  19.543
  237   HD21  ASN  34          HD21      ASN  34   1.592  22.693  19.899
  238   HD22  ASN  34          HD22      ASN  34   2.082  23.828  18.691
  239    H    GLY  35           HN       GLY  35   2.922  17.656  19.637
  240    HA2  GLY  35           HA1      GLY  35   0.451  16.134  19.700
  241    HA3  GLY  35           HA2      GLY  35   1.757  15.393  18.788
  242    H    PHE  36           HN       PHE  36   1.943  13.639  20.179
  243    HA   PHE  36           HA       PHE  36   2.493  14.108  22.989
  244    HB2  PHE  36           HB1      PHE  36   2.566  11.481  21.498
  245    HB3  PHE  36           HB2      PHE  36   2.431  11.718  23.237
  246    HD1  PHE  36           HD1      PHE  36   0.342  13.108  24.006
  247    HD2  PHE  36           HD2      PHE  36   0.660  11.073  20.281
  248    HE1  PHE  36           HE1      PHE  36  -2.112  13.068  23.822
  249    HE2  PHE  36           HE2      PHE  36  -1.792  11.031  20.091
  250    HZ   PHE  36           HZ       PHE  36  -3.181  12.030  21.862
  251    H    TRP  37           HN       TRP  37   4.426  13.659  24.031
  252    HA   TRP  37           HA       TRP  37   6.732  12.872  22.429
  253    HB2  TRP  37           HB1      TRP  37   6.369  15.474  22.536
  254    HB3  TRP  37           HB2      TRP  37   7.038  15.299  24.156
  255    HD1  TRP  37           HD1      TRP  37   8.157  13.689  20.798
  256    HE1  TRP  37           HE1      TRP  37  10.668  14.167  20.496
  257    HE3  TRP  37           HE3      TRP  37   8.953  16.515  24.983
  258    HZ2  TRP  37           HZ2      TRP  37  12.715  15.557  21.854
  259    HZ3  TRP  37           HZ3      TRP  37  11.217  17.380  25.409
  260    HH2  TRP  37           HH2      TRP  37  13.058  16.910  23.876
  Start of MODEL   17
    1    H1   LYS   1           HN       LYS   1   1.143   3.983   7.574
    2    HA   LYS   1           HA       LYS   1   1.340   3.280   4.902
    3    HB2  LYS   1           HB1      LYS   1   2.795   4.864   6.414
    4    HB3  LYS   1           HB2      LYS   1   3.813   3.440   6.582
    5    HG2  LYS   1           HG1      LYS   1   4.561   3.555   4.458
    6    HG3  LYS   1           HG2      LYS   1   3.022   4.153   3.831
    7    HD2  LYS   1           HD1      LYS   1   3.743   6.278   5.286
    8    HD3  LYS   1           HD2      LYS   1   5.346   5.638   4.915
    9    HE2  LYS   1           HE1      LYS   1   4.702   7.248   3.232
   10    HE3  LYS   1           HE2      LYS   1   4.759   5.636   2.520
   11    HZ1  LYS   1           HZ1      LYS   1   2.222   6.740   3.543
   12    HZ2  LYS   1           HZ2      LYS   1   2.463   5.522   2.396
   13    HZ3  LYS   1           HZ3      LYS   1   2.769   7.135   1.992
   14    H    TYR   2           HN       TYR   2   0.370   0.986   5.780
   15    HA   TYR   2           HA       TYR   2   2.487  -0.934   6.265
   16    HB2  TYR   2           HB1      TYR   2   0.016  -0.935   7.173
   17    HB3  TYR   2           HB2      TYR   2  -0.329  -1.734   5.644
   18    HD1  TYR   2           HD2      TYR   2   1.947  -1.971   8.591
   19    HD2  TYR   2           HD1      TYR   2  -0.107  -4.039   5.491
   20    HE1  TYR   2           HE2      TYR   2   2.658  -4.117   9.559
   21    HE2  TYR   2           HE1      TYR   2   0.597  -6.191   6.452
   22    HH   TYR   2           HH       TYR   2   2.339  -7.079   7.900
   23    H    TYR   3           HN       TYR   3   3.250   0.075   4.011
   24    HA   TYR   3           HA       TYR   3   2.833  -2.050   2.092
   25    HB2  TYR   3           HB1      TYR   3   1.830   0.727   1.674
   26    HB3  TYR   3           HB2      TYR   3   2.544  -0.109   0.300
   27    HD1  TYR   3           HD2      TYR   3   1.645  -2.631   0.036
   28    HD2  TYR   3           HD1      TYR   3  -0.450   0.547   1.935
   29    HE1  TYR   3           HE2      TYR   3  -0.480  -3.803  -0.362
   30    HE2  TYR   3           HE1      TYR   3  -2.582  -0.616   1.544
   31    HH   TYR   3           HH       TYR   3  -3.412  -2.395  -0.214
   32    H    GLY   4           HN       GLY   4   4.837  -2.627   1.591
   33    HA2  GLY   4           HA1      GLY   4   6.702  -0.681   0.559
   34    HA3  GLY   4           HA2      GLY   4   7.185  -1.372   2.101
   35    H    ASN   5           HN       ASN   5   8.159  -3.319   2.135
   36    HA   ASN   5           HA       ASN   5   9.346  -5.086   1.312
   37    HB2  ASN   5           HB1      ASN   5   6.680  -5.393  -0.063
   38    HB3  ASN   5           HB2      ASN   5   7.961  -6.591  -0.227
   39   HD21  ASN   5          HD21      ASN   5   5.254  -5.825   1.438
   40   HD22  ASN   5          HD22      ASN   5   5.531  -6.729   2.884
   41    H    GLY   6           HN       GLY   6   9.899  -2.638   0.009
   42    HA2  GLY   6           HA1      GLY   6   9.955  -3.059  -2.836
   43    HA3  GLY   6           HA2      GLY   6  10.726  -1.745  -1.959
   44    H    VAL   7           HN       VAL   7  11.050  -5.135  -2.882
   45    HA   VAL   7           HA       VAL   7  13.697  -5.470  -1.939
   46    HB   VAL   7           HB       VAL   7  13.776  -7.437  -3.451
   47   HG11  VAL   7          HG11      VAL   7  11.970  -8.687  -2.354
   48   HG12  VAL   7          HG12      VAL   7  12.841  -7.656  -1.217
   49   HG13  VAL   7          HG13      VAL   7  11.255  -7.168  -1.816
   50   HG21  VAL   7          HG21      VAL   7  11.394  -6.099  -4.565
   51   HG22  VAL   7          HG22      VAL   7  12.593  -7.126  -5.352
   52   HG23  VAL   7          HG23      VAL   7  11.296  -7.852  -4.404
   53    H    HIS   8           HN       HIS   8  12.355  -4.475  -5.052
   54    HA   HIS   8           HA       HIS   8  14.870  -4.389  -6.397
   55    HB2  HIS   8           HB1      HIS   8  12.143  -3.276  -7.034
   56    HB3  HIS   8           HB2      HIS   8  13.534  -2.990  -8.075
   57    HD1  HIS   8           HD1      HIS   8  14.300  -4.902  -9.567
   58    HD2  HIS   8           HD2      HIS   8  11.238  -5.969  -6.969
   59    HE1  HIS   8           HE1      HIS   8  13.519  -7.164 -10.341
   60    H    LEU   9           HN       LEU   9  12.995  -2.123  -4.513
   61    HA   LEU   9           HA       LEU   9  14.269   0.256  -5.296
   62    HB2  LEU   9           HB1      LEU   9  12.294   0.540  -4.110
   63    HB3  LEU   9           HB2      LEU   9  12.767  -0.606  -2.858
   64    HG   LEU   9           HG       LEU   9  14.344   1.899  -3.087
   65   HD11  LEU   9          HD11      LEU   9  11.976   2.611  -3.330
   66   HD12  LEU   9          HD12      LEU   9  12.749   3.196  -1.857
   67   HD13  LEU   9          HD13      LEU   9  11.629   1.836  -1.784
   68   HD21  LEU   9          HD21      LEU   9  15.144   0.970  -1.231
   69   HD22  LEU   9          HD22      LEU   9  13.839  -0.216  -1.178
   70   HD23  LEU   9          HD23      LEU   9  13.610   1.379  -0.462
   71    H    THR  10           HN       THR  10  15.308  -2.348  -3.302
   72    HA   THR  10           HA       THR  10  17.227  -0.961  -1.739
   73    HB   THR  10           HB       THR  10  17.291  -3.877  -2.534
   74    HG1  THR  10           HG1      THR  10  15.758  -2.458  -0.654
   75   HG21  THR  10          HG21      THR  10  18.963  -4.147  -1.061
   76   HG22  THR  10          HG22      THR  10  18.203  -3.088   0.128
   77   HG23  THR  10          HG23      THR  10  19.168  -2.399  -1.177
   78    H    LYS  11           HN       LYS  11  17.736  -3.195  -4.478
   79    HA   LYS  11           HA       LYS  11  20.440  -2.407  -4.851
   80    HB2  LYS  11           HB1      LYS  11  18.495  -3.991  -6.517
   81    HB3  LYS  11           HB2      LYS  11  20.120  -3.631  -7.087
   82    HG2  LYS  11           HG1      LYS  11  21.079  -4.806  -5.206
   83    HG3  LYS  11           HG2      LYS  11  19.472  -5.095  -4.536
   84    HD2  LYS  11           HD1      LYS  11  18.973  -6.265  -6.768
   85    HD3  LYS  11           HD2      LYS  11  20.722  -6.265  -7.003
   86    HE2  LYS  11           HE1      LYS  11  20.801  -7.315  -4.643
   87    HE3  LYS  11           HE2      LYS  11  19.094  -7.663  -4.911
   88    HZ1  LYS  11           HZ1      LYS  11  21.289  -8.517  -6.718
   89    HZ2  LYS  11           HZ2      LYS  11  19.655  -8.930  -6.854
   90    HZ3  LYS  11           HZ3      LYS  11  20.567  -9.506  -5.551
   91    H    SER  12           HN       SER  12  17.394  -1.275  -6.092
   92    HA   SER  12           HA       SER  12  18.331   0.102  -8.364
   93    HB2  SER  12           HB1      SER  12  15.885   0.317  -6.640
   94    HB3  SER  12           HB2      SER  12  16.196   1.541  -7.871
   95    HG   SER  12           HG       SER  12  15.054   0.025  -8.925
   96    H    GLY  13           HN       GLY  13  18.460   0.827  -4.984
   97    HA2  GLY  13           HA1      GLY  13  20.392   2.627  -4.852
   98    HA3  GLY  13           HA2      GLY  13  19.091   3.638  -5.463
   99    H    LEU  14           HN       LEU  14  19.500   1.167  -2.920
  100    HA   LEU  14           HA       LEU  14  17.512   2.098  -1.220
  101    HB2  LEU  14           HB1      LEU  14  18.400   0.700   0.412
  102    HB3  LEU  14           HB2      LEU  14  18.876  -0.058  -1.106
  103    HG   LEU  14           HG       LEU  14  20.697   1.684   0.549
  104   HD11  LEU  14          HD11      LEU  14  19.949  -1.137   0.814
  105   HD12  LEU  14          HD12      LEU  14  20.700  -0.043   1.976
  106   HD13  LEU  14          HD13      LEU  14  21.686  -0.837   0.748
  107   HD21  LEU  14          HD21      LEU  14  20.934   0.195  -2.000
  108   HD22  LEU  14          HD22      LEU  14  22.314   0.142  -0.904
  109   HD23  LEU  14          HD23      LEU  14  21.707   1.693  -1.484
  110    H    SER  15           HN       SER  15  20.695   3.327  -1.805
  111    HA   SER  15           HA       SER  15  20.949   4.846   0.591
  112    HB2  SER  15           HB1      SER  15  22.820   5.944  -0.534
  113    HB3  SER  15           HB2      SER  15  22.892   4.203  -0.801
  114    HG   SER  15           HG       SER  15  22.385   6.263  -2.596
  115    H    VAL  16           HN       VAL  16  20.162   5.777  -2.759
  116    HA   VAL  16           HA       VAL  16  19.516   8.463  -2.095
  117    HB   VAL  16           HB       VAL  16  20.181   7.781  -4.369
  118   HG11  VAL  16          HG11      VAL  16  19.065   5.649  -4.526
  119   HG12  VAL  16          HG12      VAL  16  17.486   6.428  -4.413
  120   HG13  VAL  16          HG13      VAL  16  18.503   6.695  -5.829
  121   HG21  VAL  16          HG21      VAL  16  18.233   9.623  -3.634
  122   HG22  VAL  16          HG22      VAL  16  19.138   9.590  -5.147
  123   HG23  VAL  16          HG23      VAL  16  17.562   8.805  -5.045
  124    H    ASN  17           HN       ASN  17  17.708   5.485  -2.179
  125    HA   ASN  17           HA       ASN  17  15.115   6.662  -2.181
  126    HB2  ASN  17           HB1      ASN  17  16.236   3.940  -1.759
  127    HB3  ASN  17           HB2      ASN  17  14.628   4.254  -1.113
  128   HD21  ASN  17          HD21      ASN  17  16.454   3.520  -3.857
  129   HD22  ASN  17          HD22      ASN  17  15.191   3.638  -5.031
  130    H    TRP  18           HN       TRP  18  17.476   5.987   0.262
  131    HA   TRP  18           HA       TRP  18  15.825   5.907   2.530
  132    HB2  TRP  18           HB1      TRP  18  18.236   5.279   2.494
  133    HB3  TRP  18           HB2      TRP  18  18.646   6.987   2.358
  134    HD1  TRP  18           HD1      TRP  18  17.925   8.551   4.529
  135    HE1  TRP  18           HE1      TRP  18  17.874   7.935   7.027
  136    HE3  TRP  18           HE3      TRP  18  17.857   3.457   4.107
  137    HZ2  TRP  18           HZ2      TRP  18  17.813   5.598   8.610
  138    HZ3  TRP  18           HZ3      TRP  18  17.803   2.104   6.161
  139    HH2  TRP  18           HH2      TRP  18  17.782   3.154   8.365
  140    H    GLY  19           HN       GLY  19  17.638   8.656   1.150
  141    HA2  GLY  19           HA1      GLY  19  16.729  10.615   2.910
  142    HA3  GLY  19           HA2      GLY  19  17.260  10.917   1.262
  143    H    GLU  20           HN       GLU  20  15.286   9.480  -0.120
  144    HA   GLU  20           HA       GLU  20  13.231  11.399  -0.246
  145    HB2  GLU  20           HB1      GLU  20  13.454   8.610  -1.373
  146    HB3  GLU  20           HB2      GLU  20  12.083   9.661  -1.699
  147    HG2  GLU  20           HG1      GLU  20  14.859  10.615  -2.238
  148    HG3  GLU  20           HG2      GLU  20  14.048   9.545  -3.380
  149    H    ALA  21           HN       ALA  21  13.464   8.285   1.371
  150    HA   ALA  21           HA       ALA  21  10.730   8.071   2.089
  151    HB1  ALA  21           HB1      ALA  21  12.691   6.826   3.893
  152    HB2  ALA  21           HB2      ALA  21  11.319   6.118   3.040
  153    HB3  ALA  21           HB3      ALA  21  12.842   6.384   2.192
  154    H    PHE  22           HN       PHE  22  13.487   9.671   3.529
  155    HA   PHE  22           HA       PHE  22  12.351  10.105   6.091
  156    HB2  PHE  22           HB1      PHE  22  14.815  10.290   5.392
  157    HB3  PHE  22           HB2      PHE  22  14.402  11.895   4.800
  158    HD1  PHE  22           HD2      PHE  22  13.952   9.827   7.874
  159    HD2  PHE  22           HD1      PHE  22  14.761  13.661   6.213
  160    HE1  PHE  22           HE2      PHE  22  14.268  10.737  10.138
  161    HE2  PHE  22           HE1      PHE  22  15.079  14.577   8.474
  162    HZ   PHE  22           HZ       PHE  22  14.831  13.115  10.440
  163    H    SER  23           HN       SER  23  12.719  12.260   3.276
  164    HA   SER  23           HA       SER  23  11.433  14.490   4.285
  165    HB2  SER  23           HB1      SER  23  12.663  14.232   2.057
  166    HB3  SER  23           HB2      SER  23  11.146  13.600   1.416
  167    HG   SER  23           HG       SER  23  10.962  15.713   1.035
  168    H    ALA  24           HN       ALA  24  10.089  11.498   3.126
  169    HA   ALA  24           HA       ALA  24   7.471  12.232   2.572
  170    HB1  ALA  24           HB1      ALA  24   8.889   9.842   2.821
  171    HB2  ALA  24           HB2      ALA  24   7.543   9.705   3.953
  172    HB3  ALA  24           HB3      ALA  24   7.232  10.047   2.251
  173    H    GLY  25           HN       GLY  25   9.076  11.793   5.653
  174    HA2  GLY  25           HA1      GLY  25   6.631  11.843   7.183
  175    HA3  GLY  25           HA2      GLY  25   8.267  11.891   7.824
  176    H    VAL  26           HN       VAL  26   9.197  14.151   6.407
  177    HA   VAL  26           HA       VAL  26   8.455  16.220   8.112
  178    HB   VAL  26           HB       VAL  26   9.629  16.454   5.337
  179   HG11  VAL  26          HG11      VAL  26   9.146  18.631   5.694
  180   HG12  VAL  26          HG12      VAL  26   9.015  18.428   7.442
  181   HG13  VAL  26          HG13      VAL  26  10.603  18.567   6.685
  182   HG21  VAL  26          HG21      VAL  26  10.705  15.501   7.838
  183   HG22  VAL  26          HG22      VAL  26  11.431  15.498   6.230
  184   HG23  VAL  26          HG23      VAL  26  11.589  16.916   7.267
  185    H    HIS  27           HN       HIS  27   7.137  15.254   5.008
  186    HA   HIS  27           HA       HIS  27   5.603  17.566   4.500
  187    HB2  HIS  27           HB1      HIS  27   6.176  15.646   2.898
  188    HB3  HIS  27           HB2      HIS  27   4.825  14.787   3.632
  189    HD1  HIS  27           HD1      HIS  27   5.079  18.407   2.483
  190    HD2  HIS  27           HD2      HIS  27   2.829  14.978   1.820
  191    HE1  HIS  27           HE1      HIS  27   3.260  19.094   0.888
  192    H    ARG  28           HN       ARG  28   4.871  14.552   6.203
  193    HA   ARG  28           HA       ARG  28   2.138  15.101   6.665
  194    HB2  ARG  28           HB1      ARG  28   3.573  12.897   6.945
  195    HB3  ARG  28           HB2      ARG  28   3.720  13.470   8.601
  196    HG2  ARG  28           HG1      ARG  28   1.236  13.583   8.713
  197    HG3  ARG  28           HG2      ARG  28   1.183  12.826   7.120
  198    HD2  ARG  28           HD1      ARG  28   2.355  10.879   7.987
  199    HD3  ARG  28           HD2      ARG  28   2.482  11.642   9.571
  200    HE   ARG  28           HE       ARG  28   0.299  11.074   9.989
  201   HH11  ARG  28          HH11      ARG  28   0.979  10.653   6.601
  202   HH12  ARG  28          HH12      ARG  28  -0.520   9.850   6.267
  203   HH21  ARG  28          HH21      ARG  28  -1.677  10.018   9.562
  204   HH22  ARG  28          HH22      ARG  28  -2.030   9.490   7.951
  205    H    LEU  29           HN       LEU  29   5.074  15.875   8.439
  206    HA   LEU  29           HA       LEU  29   3.843  16.764  10.818
  207    HB2  LEU  29           HB1      LEU  29   6.506  17.117   9.542
  208    HB3  LEU  29           HB2      LEU  29   6.070  18.183  10.876
  209    HG   LEU  29           HG       LEU  29   5.854  15.216  11.200
  210   HD11  LEU  29          HD11      LEU  29   8.373  16.850  11.471
  211   HD12  LEU  29          HD12      LEU  29   8.085  15.535  10.332
  212   HD13  LEU  29          HD13      LEU  29   8.162  15.201  12.062
  213   HD21  LEU  29          HD21      LEU  29   6.536  17.432  13.128
  214   HD22  LEU  29          HD22      LEU  29   6.212  15.744  13.523
  215   HD23  LEU  29          HD23      LEU  29   4.920  16.766  12.890
  216    H    ALA  30           HN       ALA  30   4.814  18.453   7.861
  217    HA   ALA  30           HA       ALA  30   4.166  21.056   8.737
  218    HB1  ALA  30           HB1      ALA  30   5.413  20.065   6.562
  219    HB2  ALA  30           HB2      ALA  30   3.849  20.490   5.865
  220    HB3  ALA  30           HB3      ALA  30   4.813  21.719   6.684
  221    H    ASN  31           HN       ASN  31   2.237  18.432   7.552
  222    HA   ASN  31           HA       ASN  31  -0.052  20.090   6.944
  223    HB2  ASN  31           HB1      ASN  31   0.161  17.076   7.128
  224    HB3  ASN  31           HB2      ASN  31  -1.188  17.980   6.446
  225   HD21  ASN  31          HD21      ASN  31   0.157  16.045   5.017
  226   HD22  ASN  31          HD22      ASN  31   1.019  16.793   3.720
  227    H    GLY  32           HN       GLY  32   1.185  18.282   9.634
  228    HA2  GLY  32           HA1      GLY  32   0.384  18.927  11.844
  229    HA3  GLY  32           HA2      GLY  32  -1.233  19.016  11.161
  230    H    GLY  33           HN       GLY  33   0.612  17.248  13.155
  231    HA2  GLY  33           HA1      GLY  33  -1.080  14.895  12.782
  232    HA3  GLY  33           HA2      GLY  33   0.658  14.646  12.698
  233    H    ASN  34           HN       ASN  34   1.907  15.505  14.614
  234    HA   ASN  34           HA       ASN  34   0.504  14.675  17.042
  235    HB2  ASN  34           HB1      ASN  34   3.449  15.060  16.468
  236    HB3  ASN  34           HB2      ASN  34   2.796  14.561  18.025
  237   HD21  ASN  34          HD21      ASN  34   3.651  13.600  14.856
  238   HD22  ASN  34          HD22      ASN  34   3.272  11.923  15.019
  239    H    GLY  35           HN       GLY  35  -0.637  16.847  16.840
  240    HA2  GLY  35           HA1      GLY  35   1.006  19.043  17.901
  241    HA3  GLY  35           HA2      GLY  35  -0.570  19.221  17.144
  242    H    PHE  36           HN       PHE  36   1.145  18.687  20.076
  243    HA   PHE  36           HA       PHE  36  -1.274  18.108  21.588
  244    HB2  PHE  36           HB1      PHE  36   1.653  18.171  22.238
  245    HB3  PHE  36           HB2      PHE  36   0.464  18.229  23.535
  246    HD1  PHE  36           HD1      PHE  36   1.600  16.222  20.638
  247    HD2  PHE  36           HD2      PHE  36  -0.588  16.281  24.288
  248    HE1  PHE  36           HE1      PHE  36   1.400  13.771  20.554
  249    HE2  PHE  36           HE2      PHE  36  -0.791  13.831  24.210
  250    HZ   PHE  36           HZ       PHE  36   0.204  12.572  22.342
  251    H    TRP  37           HN       TRP  37   1.008  20.716  21.056
  252    HA   TRP  37           HA       TRP  37  -0.348  22.404  23.015
  253    HB2  TRP  37           HB1      TRP  37   1.450  24.018  22.566
  254    HB3  TRP  37           HB2      TRP  37   2.102  22.436  22.983
  255    HD1  TRP  37           HD1      TRP  37   3.504  21.164  21.142
  256    HE1  TRP  37           HE1      TRP  37   4.477  21.881  18.870
  257    HE3  TRP  37           HE3      TRP  37   0.941  25.541  20.506
  258    HZ2  TRP  37           HZ2      TRP  37   4.196  24.019  17.049
  259    HZ3  TRP  37           HZ3      TRP  37   1.351  26.863  18.472
  260    HH2  TRP  37           HH2      TRP  37   2.946  26.117  16.781
  Start of MODEL   18
    1    H1   LYS   1           HN       LYS   1   0.171 -12.321  -5.614
    2    HA   LYS   1           HA       LYS   1  -1.282 -11.189  -3.420
    3    HB2  LYS   1           HB1      LYS   1   0.412 -13.693  -3.506
    4    HB3  LYS   1           HB2      LYS   1  -0.760 -13.277  -2.262
    5    HG2  LYS   1           HG1      LYS   1  -1.359 -13.858  -5.155
    6    HG3  LYS   1           HG2      LYS   1  -1.685 -14.914  -3.778
    7    HD2  LYS   1           HD1      LYS   1  -3.194 -13.187  -2.857
    8    HD3  LYS   1           HD2      LYS   1  -2.910 -12.203  -4.295
    9    HE2  LYS   1           HE1      LYS   1  -3.760 -14.135  -5.657
   10    HE3  LYS   1           HE2      LYS   1  -4.231 -14.908  -4.144
   11    HZ1  LYS   1           HZ1      LYS   1  -6.046 -13.670  -5.250
   12    HZ2  LYS   1           HZ2      LYS   1  -5.185 -12.234  -5.010
   13    HZ3  LYS   1           HZ3      LYS   1  -5.728 -13.126  -3.679
   14    H    TYR   2           HN       TYR   2   2.057 -11.409  -4.340
   15    HA   TYR   2           HA       TYR   2   3.038 -10.725  -1.702
   16    HB2  TYR   2           HB1      TYR   2   4.188 -12.161  -3.600
   17    HB3  TYR   2           HB2      TYR   2   4.760 -10.587  -4.139
   18    HD1  TYR   2           HD1      TYR   2   6.197  -9.218  -2.638
   19    HD2  TYR   2           HD2      TYR   2   5.112 -13.217  -1.676
   20    HE1  TYR   2           HE1      TYR   2   8.018  -9.308  -0.988
   21    HE2  TYR   2           HE2      TYR   2   6.929 -13.319  -0.022
   22    HH   TYR   2           HH       TYR   2   9.054 -12.217   0.448
   23    H    TYR   3           HN       TYR   3   3.922  -8.773  -1.088
   24    HA   TYR   3           HA       TYR   3   3.964  -6.557  -2.969
   25    HB2  TYR   3           HB1      TYR   3   1.630  -6.793  -1.836
   26    HB3  TYR   3           HB2      TYR   3   2.443  -6.154  -0.411
   27    HD1  TYR   3           HD1      TYR   3   3.701  -3.917  -0.692
   28    HD2  TYR   3           HD2      TYR   3   0.789  -5.337  -3.450
   29    HE1  TYR   3           HE1      TYR   3   3.393  -1.628  -1.536
   30    HE2  TYR   3           HE2      TYR   3   0.473  -3.052  -4.303
   31    HH   TYR   3           HH       TYR   3   1.260  -0.403  -2.795
   32    H    GLY   4           HN       GLY   4   6.052  -6.030  -2.688
   33    HA2  GLY   4           HA1      GLY   4   7.169  -4.427  -0.969
   34    HA3  GLY   4           HA2      GLY   4   7.117  -5.862   0.044
   35    H    ASN   5           HN       ASN   5   9.372  -5.940   0.215
   36    HA   ASN   5           HA       ASN   5  11.516  -6.436  -0.388
   37    HB2  ASN   5           HB1      ASN   5   9.862  -8.277  -2.100
   38    HB3  ASN   5           HB2      ASN   5  11.622  -8.313  -2.169
   39   HD21  ASN   5          HD21      ASN   5  11.171 -10.552  -1.455
   40   HD22  ASN   5          HD22      ASN   5  11.056 -10.849   0.243
   41    H    GLY   6           HN       GLY   6  11.057  -4.065  -1.381
   42    HA2  GLY   6           HA1      GLY   6  11.196  -3.854  -4.220
   43    HA3  GLY   6           HA2      GLY   6  11.510  -2.565  -3.067
   44    H    VAL   7           HN       VAL   7  12.934  -5.331  -4.721
   45    HA   VAL   7           HA       VAL   7  15.581  -4.941  -3.801
   46    HB   VAL   7           HB       VAL   7  16.253  -6.353  -5.721
   47   HG11  VAL   7          HG11      VAL   7  15.381  -7.278  -3.556
   48   HG12  VAL   7          HG12      VAL   7  13.818  -7.477  -4.351
   49   HG13  VAL   7          HG13      VAL   7  15.229  -8.354  -4.944
   50   HG21  VAL   7          HG21      VAL   7  14.881  -5.833  -7.502
   51   HG22  VAL   7          HG22      VAL   7  14.201  -7.370  -6.968
   52   HG23  VAL   7          HG23      VAL   7  13.417  -5.856  -6.519
   53    H    HIS   8           HN       HIS   8  13.817  -3.766  -6.627
   54    HA   HIS   8           HA       HIS   8  16.077  -2.510  -7.833
   55    HB2  HIS   8           HB1      HIS   8  13.786  -3.235  -8.879
   56    HB3  HIS   8           HB2      HIS   8  13.262  -1.632  -8.369
   57    HD1  HIS   8           HD1      HIS   8  16.365  -0.610  -9.075
   58    HD2  HIS   8           HD2      HIS   8  13.482  -2.274 -11.561
   59    HE1  HIS   8           HE1      HIS   8  16.972   0.133 -11.399
   60    H    LEU   9           HN       LEU   9  13.627  -1.525  -5.540
   61    HA   LEU   9           HA       LEU   9  13.998   1.258  -5.689
   62    HB2  LEU   9           HB1      LEU   9  12.084   0.589  -4.564
   63    HB3  LEU   9           HB2      LEU   9  12.950  -0.607  -3.601
   64    HG   LEU   9           HG       LEU   9  13.602   2.254  -3.145
   65   HD11  LEU   9          HD11      LEU   9  10.944   1.511  -3.210
   66   HD12  LEU   9          HD12      LEU   9  11.622   2.898  -2.359
   67   HD13  LEU   9          HD13      LEU   9  11.376   1.375  -1.505
   68   HD21  LEU   9          HD21      LEU   9  14.725   1.222  -1.526
   69   HD22  LEU   9          HD22      LEU   9  13.895  -0.305  -1.828
   70   HD23  LEU   9          HD23      LEU   9  13.169   0.898  -0.761
   71    H    THR  10           HN       THR  10  15.923  -1.239  -4.318
   72    HA   THR  10           HA       THR  10  17.314   0.293  -2.378
   73    HB   THR  10           HB       THR  10  18.357  -2.139  -3.837
   74    HG1  THR  10           HG1      THR  10  16.388  -2.702  -2.936
   75   HG21  THR  10          HG21      THR  10  20.076  -2.092  -2.413
   76   HG22  THR  10          HG22      THR  10  19.004  -1.882  -1.029
   77   HG23  THR  10          HG23      THR  10  19.549  -0.477  -1.944
   78    H    LYS  11           HN       LYS  11  18.452  -0.912  -5.541
   79    HA   LYS  11           HA       LYS  11  20.714   0.808  -5.582
   80    HB2  LYS  11           HB1      LYS  11  19.396  -1.021  -7.545
   81    HB3  LYS  11           HB2      LYS  11  20.588   0.132  -8.130
   82    HG2  LYS  11           HG1      LYS  11  21.853  -1.758  -7.741
   83    HG3  LYS  11           HG2      LYS  11  22.090  -0.827  -6.260
   84    HD2  LYS  11           HD1      LYS  11  20.189  -2.160  -5.264
   85    HD3  LYS  11           HD2      LYS  11  20.284  -3.199  -6.688
   86    HE2  LYS  11           HE1      LYS  11  22.614  -3.711  -6.161
   87    HE3  LYS  11           HE2      LYS  11  22.532  -2.658  -4.750
   88    HZ1  LYS  11           HZ1      LYS  11  20.626  -4.158  -4.022
   89    HZ2  LYS  11           HZ2      LYS  11  22.193  -4.785  -3.911
   90    HZ3  LYS  11           HZ3      LYS  11  21.185  -5.250  -5.188
   91    H    SER  12           HN       SER  12  17.424   1.103  -6.674
   92    HA   SER  12           HA       SER  12  17.758   3.217  -8.506
   93    HB2  SER  12           HB1      SER  12  15.694   1.928  -8.431
   94    HB3  SER  12           HB2      SER  12  15.371   2.489  -6.791
   95    HG   SER  12           HG       SER  12  14.228   3.874  -7.980
   96    H    GLY  13           HN       GLY  13  17.753   3.112  -5.049
   97    HA2  GLY  13           HA1      GLY  13  18.958   5.372  -4.398
   98    HA3  GLY  13           HA2      GLY  13  17.371   5.999  -4.819
   99    H    LEU  14           HN       LEU  14  18.690   3.289  -2.907
  100    HA   LEU  14           HA       LEU  14  16.559   3.054  -1.141
  101    HB2  LEU  14           HB1      LEU  14  17.934   1.706   0.171
  102    HB3  LEU  14           HB2      LEU  14  18.570   1.522  -1.462
  103    HG   LEU  14           HG       LEU  14  19.774   3.368   0.592
  104   HD11  LEU  14          HD11      LEU  14  19.744   0.619   0.755
  105   HD12  LEU  14          HD12      LEU  14  20.920   1.694   1.511
  106   HD13  LEU  14          HD13      LEU  14  21.271   0.964  -0.056
  107   HD21  LEU  14          HD21      LEU  14  20.769   2.282  -2.039
  108   HD22  LEU  14          HD22      LEU  14  21.727   3.241  -0.910
  109   HD23  LEU  14          HD23      LEU  14  20.312   3.949  -1.691
  110    H    SER  15           HN       SER  15  19.092   5.405  -1.269
  111    HA   SER  15           HA       SER  15  18.905   6.300   1.429
  112    HB2  SER  15           HB1      SER  15  20.091   8.349   0.506
  113    HB3  SER  15           HB2      SER  15  20.917   6.812   0.254
  114    HG   SER  15           HG       SER  15  20.873   7.291  -1.781
  115    H    VAL  16           HN       VAL  16  17.654   7.607  -1.639
  116    HA   VAL  16           HA       VAL  16  16.180   9.704  -0.415
  117    HB   VAL  16           HB       VAL  16  16.874   9.803  -2.768
  118   HG11  VAL  16          HG11      VAL  16  14.944   7.516  -3.071
  119   HG12  VAL  16          HG12      VAL  16  15.482   8.505  -4.431
  120   HG13  VAL  16          HG13      VAL  16  16.652   7.565  -3.503
  121   HG21  VAL  16          HG21      VAL  16  13.871   9.847  -2.503
  122   HG22  VAL  16          HG22      VAL  16  14.945  11.125  -1.935
  123   HG23  VAL  16          HG23      VAL  16  14.848  10.755  -3.656
  124    H    ASN  17           HN       ASN  17  15.538   6.358  -1.018
  125    HA   ASN  17           HA       ASN  17  12.715   6.430  -0.976
  126    HB2  ASN  17           HB1      ASN  17  13.638   4.439  -1.801
  127    HB3  ASN  17           HB2      ASN  17  14.753   4.285  -0.447
  128   HD21  ASN  17          HD21      ASN  17  14.254   2.751   0.924
  129   HD22  ASN  17          HD22      ASN  17  12.665   2.173   1.281
  130    H    TRP  18           HN       TRP  18  15.053   5.643   1.597
  131    HA   TRP  18           HA       TRP  18  13.156   5.382   3.653
  132    HB2  TRP  18           HB1      TRP  18  15.500   4.557   3.774
  133    HB3  TRP  18           HB2      TRP  18  16.050   6.225   3.914
  134    HD1  TRP  18           HD1      TRP  18  13.039   4.725   5.811
  135    HE1  TRP  18           HE1      TRP  18  13.515   4.898   8.334
  136    HE3  TRP  18           HE3      TRP  18  17.827   6.506   5.614
  137    HZ2  TRP  18           HZ2      TRP  18  15.638   5.687  10.018
  138    HZ3  TRP  18           HZ3      TRP  18  19.010   6.944   7.726
  139    HH2  TRP  18           HH2      TRP  18  17.936   6.543   9.882
  140    H    GLY  19           HN       GLY  19  15.288   8.132   2.856
  141    HA2  GLY  19           HA1      GLY  19  14.382   9.910   4.785
  142    HA3  GLY  19           HA2      GLY  19  15.036  10.384   3.224
  143    H    GLU  20           HN       GLU  20  13.021   9.208   1.601
  144    HA   GLU  20           HA       GLU  20  11.119  11.299   1.606
  145    HB2  GLU  20           HB1      GLU  20  11.473   8.762   0.069
  146    HB3  GLU  20           HB2      GLU  20   9.935   9.608  -0.039
  147    HG2  GLU  20           HG1      GLU  20  12.620  10.820  -0.653
  148    HG3  GLU  20           HG2      GLU  20  11.487  10.196  -1.850
  149    H    ALA  21           HN       ALA  21  10.960   7.912   2.622
  150    HA   ALA  21           HA       ALA  21   8.200   7.916   3.260
  151    HB1  ALA  21           HB1      ALA  21   9.896   6.086   4.802
  152    HB2  ALA  21           HB2      ALA  21   8.508   5.751   3.767
  153    HB3  ALA  21           HB3      ALA  21  10.103   5.990   3.053
  154    H    PHE  22           HN       PHE  22  11.108   8.668   5.096
  155    HA   PHE  22           HA       PHE  22   9.862   8.806   7.638
  156    HB2  PHE  22           HB1      PHE  22  12.408   8.714   6.938
  157    HB3  PHE  22           HB2      PHE  22  12.263  10.467   7.002
  158    HD1  PHE  22           HD2      PHE  22  11.427  11.516   9.157
  159    HD2  PHE  22           HD1      PHE  22  12.709   7.467   8.881
  160    HE1  PHE  22           HE2      PHE  22  11.742  11.453  11.596
  161    HE2  PHE  22           HE1      PHE  22  13.025   7.397  11.320
  162    HZ   PHE  22           HZ       PHE  22  12.542   9.393  12.681
  163    H    SER  23           HN       SER  23  10.454  11.166   5.093
  164    HA   SER  23           HA       SER  23   9.876  13.521   6.414
  165    HB2  SER  23           HB1      SER  23   9.026  12.862   3.586
  166    HB3  SER  23           HB2      SER  23   9.331  14.466   4.254
  167    HG   SER  23           HG       SER  23  11.319  14.176   3.674
  168    H    ALA  24           HN       ALA  24   7.704  11.026   5.292
  169    HA   ALA  24           HA       ALA  24   5.283  12.430   5.390
  170    HB1  ALA  24           HB1      ALA  24   6.071   9.816   4.867
  171    HB2  ALA  24           HB2      ALA  24   4.980   9.689   6.248
  172    HB3  ALA  24           HB3      ALA  24   4.437  10.472   4.764
  173    H    GLY  25           HN       GLY  25   7.055  10.679   7.910
  174    HA2  GLY  25           HA1      GLY  25   5.053  11.003   9.911
  175    HA3  GLY  25           HA2      GLY  25   6.727  10.545  10.184
  176    H    VAL  26           HN       VAL  26   8.039  12.771   9.165
  177    HA   VAL  26           HA       VAL  26   8.073  14.501  11.333
  178    HB   VAL  26           HB       VAL  26   8.917  15.111   8.496
  179   HG11  VAL  26          HG11      VAL  26   9.103  17.189   9.348
  180   HG12  VAL  26          HG12      VAL  26   9.090  16.620  11.018
  181   HG13  VAL  26          HG13      VAL  26  10.577  16.544  10.071
  182   HG21  VAL  26          HG21      VAL  26   9.895  13.166  10.184
  183   HG22  VAL  26          HG22      VAL  26  10.755  13.883   8.821
  184   HG23  VAL  26          HG23      VAL  26  10.993  14.521  10.448
  185    H    HIS  27           HN       HIS  27   6.150  14.604   8.408
  186    HA   HIS  27           HA       HIS  27   5.246  17.263   8.602
  187    HB2  HIS  27           HB1      HIS  27   5.016  15.834   6.578
  188    HB3  HIS  27           HB2      HIS  27   3.781  14.898   7.414
  189    HD1  HIS  27           HD1      HIS  27   1.676  15.500   6.243
  190    HD2  HIS  27           HD2      HIS  27   3.979  18.842   7.132
  191    HE1  HIS  27           HE1      HIS  27   0.270  17.479   5.587
  192    H    ARG  28           HN       ARG  28   3.934  14.226   9.868
  193    HA   ARG  28           HA       ARG  28   1.572  15.327  10.953
  194    HB2  ARG  28           HB1      ARG  28   2.115  12.868  10.533
  195    HB3  ARG  28           HB2      ARG  28   3.016  12.916  12.042
  196    HG2  ARG  28           HG1      ARG  28   1.034  13.440  13.281
  197    HG3  ARG  28           HG2      ARG  28   0.100  13.612  11.794
  198    HD2  ARG  28           HD1      ARG  28  -0.399  11.473  12.734
  199    HD3  ARG  28           HD2      ARG  28   0.589  11.218  11.296
  200    HE   ARG  28           HE       ARG  28   2.196  10.288  12.624
  201   HH11  ARG  28          HH11      ARG  28   0.044  12.165  14.616
  202   HH12  ARG  28          HH12      ARG  28   0.764  11.650  16.105
  203   HH21  ARG  28          HH21      ARG  28   3.151   9.602  14.578
  204   HH22  ARG  28          HH22      ARG  28   2.531  10.192  16.083
  205    H    LEU  29           HN       LEU  29   4.835  14.976  12.197
  206    HA   LEU  29           HA       LEU  29   4.316  15.527  14.901
  207    HB2  LEU  29           HB1      LEU  29   6.691  15.656  13.125
  208    HB3  LEU  29           HB2      LEU  29   6.780  16.492  14.674
  209    HG   LEU  29           HG       LEU  29   5.971  14.150  15.590
  210   HD11  LEU  29          HD11      LEU  29   7.036  12.326  14.300
  211   HD12  LEU  29          HD12      LEU  29   7.328  13.466  12.987
  212   HD13  LEU  29          HD13      LEU  29   5.676  13.072  13.460
  213   HD21  LEU  29          HD21      LEU  29   8.255  15.533  15.709
  214   HD22  LEU  29          HD22      LEU  29   8.821  14.134  14.796
  215   HD23  LEU  29          HD23      LEU  29   8.080  13.912  16.382
  216    H    ALA  30           HN       ALA  30   5.329  17.703  12.270
  217    HA   ALA  30           HA       ALA  30   5.242  20.064  13.822
  218    HB1  ALA  30           HB1      ALA  30   6.100  19.414  11.296
  219    HB2  ALA  30           HB2      ALA  30   4.709  20.453  10.985
  220    HB3  ALA  30           HB3      ALA  30   6.042  21.039  11.979
  221    H    ASN  31           HN       ASN  31   2.975  18.896  11.322
  222    HA   ASN  31           HA       ASN  31   0.968  20.795  12.167
  223    HB2  ASN  31           HB1      ASN  31   0.983  18.628  10.062
  224    HB3  ASN  31           HB2      ASN  31  -0.416  19.647  10.387
  225   HD21  ASN  31          HD21      ASN  31   0.022  22.024  10.303
  226   HD22  ASN  31          HD22      ASN  31   1.066  22.588   9.047
  227    H    GLY  32           HN       GLY  32   1.157  19.690  14.405
  228    HA2  GLY  32           HA1      GLY  32  -1.240  18.146  14.761
  229    HA3  GLY  32           HA2      GLY  32   0.217  17.210  15.058
  230    H    GLY  33           HN       GLY  33   0.857  17.144  17.101
  231    HA2  GLY  33           HA1      GLY  33  -0.262  19.032  19.007
  232    HA3  GLY  33           HA2      GLY  33   0.671  17.592  19.388
  233    H    ASN  34           HN       ASN  34   0.917  20.912  18.207
  234    HA   ASN  34           HA       ASN  34   3.512  21.124  19.534
  235    HB2  ASN  34           HB1      ASN  34   4.614  22.094  17.653
  236    HB3  ASN  34           HB2      ASN  34   3.861  20.608  17.082
  237   HD21  ASN  34          HD21      ASN  34   4.563  23.490  16.049
  238   HD22  ASN  34          HD22      ASN  34   3.185  23.869  15.078
  239    H    GLY  35           HN       GLY  35   3.842  23.051  20.521
  240    HA2  GLY  35           HA1      GLY  35   1.726  25.078  20.167
  241    HA3  GLY  35           HA2      GLY  35   2.600  24.803  21.666
  242    H    PHE  36           HN       PHE  36   4.310  24.788  18.649
  243    HA   PHE  36           HA       PHE  36   5.804  27.132  19.508
  244    HB2  PHE  36           HB1      PHE  36   6.731  24.872  18.505
  245    HB3  PHE  36           HB2      PHE  36   6.403  25.670  16.970
  246    HD1  PHE  36           HD1      PHE  36   8.083  26.315  20.235
  247    HD2  PHE  36           HD2      PHE  36   8.050  26.968  16.029
  248    HE1  PHE  36           HE1      PHE  36  10.224  27.515  20.408
  249    HE2  PHE  36           HE2      PHE  36  10.191  28.169  16.195
  250    HZ   PHE  36           HZ       PHE  36  11.281  28.442  18.387
  251    H    TRP  37           HN       TRP  37   4.839  29.007  19.022
  252    HA   TRP  37           HA       TRP  37   3.451  29.319  16.476
  253    HB2  TRP  37           HB1      TRP  37   2.395  30.143  18.566
  254    HB3  TRP  37           HB2      TRP  37   3.730  31.274  18.770
  255    HD1  TRP  37           HD1      TRP  37   3.940  33.222  16.812
  256    HE1  TRP  37           HE1      TRP  37   2.074  34.411  15.497
  257    HE3  TRP  37           HE3      TRP  37   0.143  29.890  17.599
  258    HZ2  TRP  37           HZ2      TRP  37  -0.648  33.992  14.877
  259    HZ3  TRP  37           HZ3      TRP  37  -2.061  30.359  16.611
  260    HH2  TRP  37           HH2      TRP  37  -2.446  32.368  15.279
  Start of MODEL   19
    1    H1   LYS   1           HN       LYS   1  -4.848  -6.194  -1.453
    2    HA   LYS   1           HA       LYS   1  -3.072  -4.759  -0.971
    3    HB2  LYS   1           HB1      LYS   1  -3.050  -6.886   1.174
    4    HB3  LYS   1           HB2      LYS   1  -2.208  -5.348   1.313
    5    HG2  LYS   1           HG1      LYS   1  -4.209  -4.131   1.380
    6    HG3  LYS   1           HG2      LYS   1  -5.156  -5.495   0.783
    7    HD2  LYS   1           HD1      LYS   1  -3.671  -5.708   3.373
    8    HD3  LYS   1           HD2      LYS   1  -5.234  -4.891   3.309
    9    HE2  LYS   1           HE1      LYS   1  -6.054  -7.012   2.107
   10    HE3  LYS   1           HE2      LYS   1  -4.579  -7.759   2.717
   11    HZ1  LYS   1           HZ1      LYS   1  -6.144  -6.306   4.678
   12    HZ2  LYS   1           HZ2      LYS   1  -5.363  -7.801   4.807
   13    HZ3  LYS   1           HZ3      LYS   1  -6.878  -7.701   4.062
   14    H    TYR   2           HN       TYR   2  -2.161  -6.452  -2.971
   15    HA   TYR   2           HA       TYR   2   0.336  -7.648  -2.171
   16    HB2  TYR   2           HB1      TYR   2  -1.184  -7.368  -4.722
   17    HB3  TYR   2           HB2      TYR   2   0.545  -7.683  -4.821
   18    HD1  TYR   2           HD2      TYR   2  -2.650  -8.997  -3.480
   19    HD2  TYR   2           HD1      TYR   2   1.409  -9.847  -4.433
   20    HE1  TYR   2           HE2      TYR   2  -3.073 -11.393  -3.122
   21    HE2  TYR   2           HE1      TYR   2   0.996 -12.245  -4.078
   22    HH   TYR   2           HH       TYR   2  -1.128 -13.527  -2.461
   23    H    TYR   3           HN       TYR   3   1.296  -5.741  -1.219
   24    HA   TYR   3           HA       TYR   3   2.834  -4.247  -3.178
   25    HB2  TYR   3           HB1      TYR   3   0.765  -3.031  -1.416
   26    HB3  TYR   3           HB2      TYR   3   2.269  -2.144  -1.636
   27    HD1  TYR   3           HD2      TYR   3   2.969  -1.489  -3.959
   28    HD2  TYR   3           HD1      TYR   3  -0.886  -3.078  -3.110
   29    HE1  TYR   3           HE2      TYR   3   2.140  -0.606  -6.099
   30    HE2  TYR   3           HE1      TYR   3  -1.725  -2.200  -5.248
   31    HH   TYR   3           HH       TYR   3  -1.073  -1.368  -7.281
   32    H    GLY   4           HN       GLY   4   4.841  -4.679  -2.537
   33    HA2  GLY   4           HA1      GLY   4   5.933  -3.705  -0.156
   34    HA3  GLY   4           HA2      GLY   4   5.571  -5.407   0.091
   35    H    ASN   5           HN       ASN   5   7.860  -3.219  -0.980
   36    HA   ASN   5           HA       ASN   5   9.662  -5.318  -1.735
   37    HB2  ASN   5           HB1      ASN   5   8.406  -3.579  -3.804
   38    HB3  ASN   5           HB2      ASN   5  10.117  -3.956  -3.979
   39   HD21  ASN   5          HD21      ASN   5  10.446  -6.447  -3.325
   40   HD22  ASN   5          HD22      ASN   5   9.451  -7.515  -4.248
   41    H    GLY   6           HN       GLY   6  10.758  -4.392   0.071
   42    HA2  GLY   6           HA1      GLY   6  11.732  -1.657  -0.189
   43    HA3  GLY   6           HA2      GLY   6  11.970  -2.723   1.188
   44    H    VAL   7           HN       VAL   7  12.825  -4.860  -0.825
   45    HA   VAL   7           HA       VAL   7  15.611  -4.439  -0.575
   46    HB   VAL   7           HB       VAL   7  14.688  -6.689  -0.656
   47   HG11  VAL   7          HG11      VAL   7  12.924  -5.974  -2.402
   48   HG12  VAL   7          HG12      VAL   7  14.162  -6.390  -3.589
   49   HG13  VAL   7          HG13      VAL   7  13.567  -7.614  -2.466
   50   HG21  VAL   7          HG21      VAL   7  17.026  -6.133  -1.497
   51   HG22  VAL   7          HG22      VAL   7  16.356  -7.692  -1.979
   52   HG23  VAL   7          HG23      VAL   7  16.373  -6.348  -3.121
   53    H    HIS   8           HN       HIS   8  13.353  -4.069  -3.265
   54    HA   HIS   8           HA       HIS   8  15.361  -3.468  -5.202
   55    HB2  HIS   8           HB1      HIS   8  13.106  -4.351  -5.778
   56    HB3  HIS   8           HB2      HIS   8  12.409  -2.811  -5.282
   57    HD1  HIS   8           HD1      HIS   8  12.982  -0.726  -6.794
   58    HD2  HIS   8           HD2      HIS   8  14.178  -4.401  -8.317
   59    HE1  HIS   8           HE1      HIS   8  13.485  -0.315  -9.223
   60    H    LEU   9           HN       LEU   9  13.541  -1.615  -2.888
   61    HA   LEU   9           HA       LEU   9  13.940   0.944  -4.036
   62    HB2  LEU   9           HB1      LEU   9  12.232   0.838  -2.465
   63    HB3  LEU   9           HB2      LEU   9  13.221  -0.051  -1.309
   64    HG   LEU   9           HG       LEU   9  14.035   2.731  -1.950
   65   HD11  LEU   9          HD11      LEU   9  12.451   3.632  -0.307
   66   HD12  LEU   9          HD12      LEU   9  11.661   2.058  -0.217
   67   HD13  LEU   9          HD13      LEU   9  11.632   2.973  -1.724
   68   HD21  LEU   9          HD21      LEU   9  15.398   2.176  -0.281
   69   HD22  LEU   9          HD22      LEU   9  14.466   0.726   0.093
   70   HD23  LEU   9          HD23      LEU   9  13.997   2.279   0.786
   71    H    THR  10           HN       THR  10  15.901  -1.124  -2.045
   72    HA   THR  10           HA       THR  10  17.718   0.847  -1.114
   73    HB   THR  10           HB       THR  10  18.350  -2.076  -1.530
   74    HG1  THR  10           HG1      THR  10  16.895  -2.465  -0.055
   75   HG21  THR  10          HG21      THR  10  20.274  -1.572  -0.530
   76   HG22  THR  10          HG22      THR  10  19.390  -0.975   0.875
   77   HG23  THR  10          HG23      THR  10  19.792   0.122  -0.445
   78    H    LYS  11           HN       LYS  11  18.199  -1.686  -3.585
   79    HA   LYS  11           HA       LYS  11  20.589  -0.621  -4.602
   80    HB2  LYS  11           HB1      LYS  11  18.551  -2.554  -5.646
   81    HB3  LYS  11           HB2      LYS  11  19.844  -1.998  -6.701
   82    HG2  LYS  11           HG1      LYS  11  21.504  -2.829  -5.121
   83    HG3  LYS  11           HG2      LYS  11  20.213  -3.371  -4.046
   84    HD2  LYS  11           HD1      LYS  11  20.326  -4.310  -6.889
   85    HD3  LYS  11           HD2      LYS  11  21.321  -5.078  -5.650
   86    HE2  LYS  11           HE1      LYS  11  18.340  -4.722  -5.408
   87    HE3  LYS  11           HE2      LYS  11  19.093  -6.166  -6.083
   88    HZ1  LYS  11           HZ1      LYS  11  19.332  -5.128  -3.317
   89    HZ2  LYS  11           HZ2      LYS  11  20.335  -6.342  -3.933
   90    HZ3  LYS  11           HZ3      LYS  11  18.668  -6.601  -3.816
   91    H    SER  12           HN       SER  12  17.240   0.069  -5.313
   92    HA   SER  12           HA       SER  12  17.602   1.412  -7.763
   93    HB2  SER  12           HB1      SER  12  15.388   0.744  -7.161
   94    HB3  SER  12           HB2      SER  12  15.464   1.631  -5.639
   95    HG   SER  12           HG       SER  12  14.895   2.526  -8.179
   96    H    GLY  13           HN       GLY  13  16.840   2.920  -4.618
   97    HA2  GLY  13           HA1      GLY  13  18.947   4.867  -4.938
   98    HA3  GLY  13           HA2      GLY  13  17.337   5.526  -5.186
   99    H    LEU  14           HN       LEU  14  18.970   3.372  -2.856
  100    HA   LEU  14           HA       LEU  14  17.307   3.877  -0.691
  101    HB2  LEU  14           HB1      LEU  14  18.875   2.806   0.623
  102    HB3  LEU  14           HB2      LEU  14  19.206   2.161  -0.983
  103    HG   LEU  14           HG       LEU  14  20.962   4.177  -0.972
  104   HD11  LEU  14          HD11      LEU  14  21.589   4.949   1.029
  105   HD12  LEU  14          HD12      LEU  14  21.472   3.360   1.784
  106   HD13  LEU  14          HD13      LEU  14  20.028   4.353   1.592
  107   HD21  LEU  14          HD21      LEU  14  21.297   1.688  -1.294
  108   HD22  LEU  14          HD22      LEU  14  21.572   1.595   0.446
  109   HD23  LEU  14          HD23      LEU  14  22.640   2.569  -0.566
  110    H    SER  15           HN       SER  15  19.887   5.790  -2.025
  111    HA   SER  15           HA       SER  15  20.265   7.484   0.234
  112    HB2  SER  15           HB1      SER  15  21.922   7.166  -1.635
  113    HB3  SER  15           HB2      SER  15  20.863   8.136  -2.659
  114    HG   SER  15           HG       SER  15  22.016   8.994  -0.210
  115    H    VAL  16           HN       VAL  16  18.531   7.916  -2.847
  116    HA   VAL  16           HA       VAL  16  17.444  10.447  -2.150
  117    HB   VAL  16           HB       VAL  16  17.674   9.749  -4.485
  118   HG11  VAL  16          HG11      VAL  16  17.213   7.409  -4.347
  119   HG12  VAL  16          HG12      VAL  16  15.576   7.711  -3.761
  120   HG13  VAL  16          HG13      VAL  16  16.013   8.132  -5.418
  121   HG21  VAL  16          HG21      VAL  16  15.679  11.222  -3.433
  122   HG22  VAL  16          HG22      VAL  16  15.903  10.976  -5.164
  123   HG23  VAL  16          HG23      VAL  16  14.743   9.988  -4.277
  124    H    ASN  17           HN       ASN  17  16.455   7.159  -1.600
  125    HA   ASN  17           HA       ASN  17  13.724   7.727  -0.999
  126    HB2  ASN  17           HB1      ASN  17  15.530   5.365  -0.579
  127    HB3  ASN  17           HB2      ASN  17  13.935   5.407   0.167
  128   HD21  ASN  17          HD21      ASN  17  12.121   5.917  -1.349
  129   HD22  ASN  17          HD22      ASN  17  12.180   5.195  -2.917
  130    H    TRP  18           HN       TRP  18  16.696   7.838   0.777
  131    HA   TRP  18           HA       TRP  18  15.757   7.604   3.395
  132    HB2  TRP  18           HB1      TRP  18  18.185   7.773   2.496
  133    HB3  TRP  18           HB2      TRP  18  17.958   9.513   2.655
  134    HD1  TRP  18           HD1      TRP  18  17.586  10.464   5.179
  135    HE1  TRP  18           HE1      TRP  18  18.367   9.532   7.448
  136    HE3  TRP  18           HE3      TRP  18  18.634   5.663   3.767
  137    HZ2  TRP  18           HZ2      TRP  18  19.304   7.086   8.499
  138    HZ3  TRP  18           HZ3      TRP  18  19.469   4.091   5.465
  139    HH2  TRP  18           HH2      TRP  18  19.797   4.789   7.781
  140    H    GLY  19           HN       GLY  19  16.373  10.602   1.550
  141    HA2  GLY  19           HA1      GLY  19  15.387  12.408   3.411
  142    HA3  GLY  19           HA2      GLY  19  15.386  12.671   1.674
  143    H    GLU  20           HN       GLU  20  13.617  10.656   0.887
  144    HA   GLU  20           HA       GLU  20  11.139  11.932   1.290
  145    HB2  GLU  20           HB1      GLU  20  11.936   9.293   0.094
  146    HB3  GLU  20           HB2      GLU  20  10.243   9.735   0.257
  147    HG2  GLU  20           HG1      GLU  20  12.323  11.304  -1.250
  148    HG3  GLU  20           HG2      GLU  20  11.117  10.237  -1.967
  149    H    ALA  21           HN       ALA  21  12.601   9.077   2.756
  150    HA   ALA  21           HA       ALA  21  10.306   8.244   4.197
  151    HB1  ALA  21           HB1      ALA  21  12.869   7.583   5.430
  152    HB2  ALA  21           HB2      ALA  21  11.589   6.526   4.834
  153    HB3  ALA  21           HB3      ALA  21  12.783   7.183   3.715
  154    H    PHE  22           HN       PHE  22  12.890  10.514   4.867
  155    HA   PHE  22           HA       PHE  22  12.514  10.805   7.630
  156    HB2  PHE  22           HB1      PHE  22  14.407  11.716   6.142
  157    HB3  PHE  22           HB2      PHE  22  13.328  13.070   5.821
  158    HD1  PHE  22           HD2      PHE  22  14.481  11.130   8.798
  159    HD2  PHE  22           HD1      PHE  22  13.712  14.943   7.071
  160    HE1  PHE  22           HE2      PHE  22  15.238  12.217  10.871
  161    HE2  PHE  22           HE1      PHE  22  14.468  16.037   9.141
  162    HZ   PHE  22           HZ       PHE  22  15.231  14.674  11.045
  163    H    SER  23           HN       SER  23  11.423  13.051   5.080
  164    HA   SER  23           HA       SER  23   9.750  14.587   6.679
  165    HB2  SER  23           HB1      SER  23   9.020  14.047   3.820
  166    HB3  SER  23           HB2      SER  23   8.974  15.566   4.716
  167    HG   SER  23           HG       SER  23  11.098  14.319   3.422
  168    H    ALA  24           HN       ALA  24   9.251  11.446   5.303
  169    HA   ALA  24           HA       ALA  24   6.494  11.246   5.223
  170    HB1  ALA  24           HB1      ALA  24   7.830   8.878   6.318
  171    HB2  ALA  24           HB2      ALA  24   6.852   9.061   4.862
  172    HB3  ALA  24           HB3      ALA  24   8.556   9.515   4.842
  173    H    GLY  25           HN       GLY  25   8.528  10.150   7.952
  174    HA2  GLY  25           HA1      GLY  25   6.324   9.894   9.725
  175    HA3  GLY  25           HA2      GLY  25   8.022   9.874  10.178
  176    H    VAL  26           HN       VAL  26   8.532  12.516   9.008
  177    HA   VAL  26           HA       VAL  26   8.161  14.106  11.262
  178    HB   VAL  26           HB       VAL  26   8.565  15.016   8.409
  179   HG11  VAL  26          HG11      VAL  26   8.103  17.022   9.325
  180   HG12  VAL  26          HG12      VAL  26   8.386  16.454  10.971
  181   HG13  VAL  26          HG13      VAL  26   9.750  16.896   9.943
  182   HG21  VAL  26          HG21      VAL  26  10.239  13.472   9.935
  183   HG22  VAL  26          HG22      VAL  26  10.736  14.501   8.592
  184   HG23  VAL  26          HG23      VAL  26  10.831  15.104  10.247
  185    H    HIS  27           HN       HIS  27   6.106  13.605   8.477
  186    HA   HIS  27           HA       HIS  27   4.397  15.815   8.808
  187    HB2  HIS  27           HB1      HIS  27   4.521  14.336   6.780
  188    HB3  HIS  27           HB2      HIS  27   3.642  13.110   7.689
  189    HD1  HIS  27           HD1      HIS  27   3.015  16.839   7.199
  190    HD2  HIS  27           HD2      HIS  27   1.092  13.176   6.819
  191    HE1  HIS  27           HE1      HIS  27   0.669  17.383   6.475
  192    H    ARG  28           HN       ARG  28   4.365  12.573  10.194
  193    HA   ARG  28           HA       ARG  28   1.824  12.813  11.443
  194    HB2  ARG  28           HB1      ARG  28   3.225  10.687  10.923
  195    HB3  ARG  28           HB2      ARG  28   4.010  11.024  12.460
  196    HG2  ARG  28           HG1      ARG  28   1.043  10.956  12.395
  197    HG3  ARG  28           HG2      ARG  28   1.921   9.428  12.284
  198    HD2  ARG  28           HD1      ARG  28   2.629  11.416  14.403
  199    HD3  ARG  28           HD2      ARG  28   1.230  10.364  14.614
  200    HE   ARG  28           HE       ARG  28   3.963   9.632  14.876
  201   HH11  ARG  28          HH11      ARG  28   0.858   8.446  13.839
  202   HH12  ARG  28          HH12      ARG  28   1.241   6.786  14.154
  203   HH21  ARG  28          HH21      ARG  28   4.479   7.450  15.294
  204   HH22  ARG  28          HH22      ARG  28   3.301   6.221  14.982
  205    H    LEU  29           HN       LEU  29   5.127  13.488  12.458
  206    HA   LEU  29           HA       LEU  29   4.622  13.899  15.192
  207    HB2  LEU  29           HB1      LEU  29   6.755  14.764  13.294
  208    HB3  LEU  29           HB2      LEU  29   6.699  15.469  14.908
  209    HG   LEU  29           HG       LEU  29   6.639  12.920  15.625
  210   HD11  LEU  29          HD11      LEU  29   6.634  11.765  13.630
  211   HD12  LEU  29          HD12      LEU  29   8.352  11.794  14.026
  212   HD13  LEU  29          HD13      LEU  29   7.703  12.920  12.834
  213   HD21  LEU  29          HD21      LEU  29   9.236  14.131  14.718
  214   HD22  LEU  29          HD22      LEU  29   8.938  13.078  16.102
  215   HD23  LEU  29          HD23      LEU  29   8.343  14.739  16.112
  216    H    ALA  30           HN       ALA  30   4.412  16.043  12.407
  217    HA   ALA  30           HA       ALA  30   4.035  18.448  13.846
  218    HB1  ALA  30           HB1      ALA  30   4.503  17.917  11.272
  219    HB2  ALA  30           HB2      ALA  30   2.759  18.171  11.191
  220    HB3  ALA  30           HB3      ALA  30   3.807  19.441  11.822
  221    H    ASN  31           HN       ASN  31   1.925  15.825  13.037
  222    HA   ASN  31           HA       ASN  31  -0.506  17.317  13.489
  223    HB2  ASN  31           HB1      ASN  31  -0.139  15.234  11.956
  224    HB3  ASN  31           HB2      ASN  31  -0.369  14.320  13.444
  225   HD21  ASN  31          HD21      ASN  31  -1.913  15.286  10.804
  226   HD22  ASN  31          HD22      ASN  31  -3.523  15.449  11.409
  227    H    GLY  32           HN       GLY  32   0.035  18.097  15.634
  228    HA2  GLY  32           HA1      GLY  32  -1.204  17.482  17.760
  229    HA3  GLY  32           HA2      GLY  32  -0.222  16.025  17.721
  230    H    GLY  33           HN       GLY  33   2.216  17.214  16.888
  231    HA2  GLY  33           HA1      GLY  33   3.186  18.097  19.420
  232    HA3  GLY  33           HA2      GLY  33   4.110  18.010  17.928
  233    H    ASN  34           HN       ASN  34   1.889  19.741  16.697
  234    HA   ASN  34           HA       ASN  34   1.579  21.943  16.220
  235    HB2  ASN  34           HB1      ASN  34   0.830  21.869  18.666
  236    HB3  ASN  34           HB2      ASN  34   2.405  22.553  19.056
  237   HD21  ASN  34          HD21      ASN  34  -0.672  23.109  17.549
  238   HD22  ASN  34          HD22      ASN  34  -0.523  24.825  17.413
  239    H    GLY  35           HN       GLY  35   4.204  20.726  15.854
  240    HA2  GLY  35           HA1      GLY  35   5.931  23.097  16.191
  241    HA3  GLY  35           HA2      GLY  35   6.521  21.446  16.082
  242    H    PHE  36           HN       PHE  36   5.015  24.066  14.268
  243    HA   PHE  36           HA       PHE  36   5.490  22.731  11.739
  244    HB2  PHE  36           HB1      PHE  36   4.379  25.466  12.394
  245    HB3  PHE  36           HB2      PHE  36   4.520  24.817  10.763
  246    HD1  PHE  36           HD1      PHE  36   3.235  22.732  10.179
  247    HD2  PHE  36           HD2      PHE  36   2.547  24.941  13.751
  248    HE1  PHE  36           HE1      PHE  36   1.033  21.659  10.414
  249    HE2  PHE  36           HE2      PHE  36   0.345  23.872  13.992
  250    HZ   PHE  36           HZ       PHE  36  -0.415  22.228  12.323
  251    H    TRP  37           HN       TRP  37   7.786  22.568  11.848
  252    HA   TRP  37           HA       TRP  37   9.300  25.061  11.788
  253    HB2  TRP  37           HB1      TRP  37  10.347  22.229  11.639
  254    HB3  TRP  37           HB2      TRP  37  11.275  23.688  11.973
  255    HD1  TRP  37           HD1      TRP  37  10.276  20.871  13.803
  256    HE1  TRP  37           HE1      TRP  37   9.795  21.373  16.281
  257    HE3  TRP  37           HE3      TRP  37   9.776  25.951  13.520
  258    HZ2  TRP  37           HZ2      TRP  37   9.272  23.624  17.902
  259    HZ3  TRP  37           HZ3      TRP  37   9.285  27.204  15.580
  260    HH2  TRP  37           HH2      TRP  37   9.038  26.063  17.724
  Start of MODEL   20
    1    H1   LYS   1           HN       LYS   1  -0.058   1.152   4.979
    2    HA   LYS   1           HA       LYS   1  -0.430  -1.692   4.306
    3    HB2  LYS   1           HB1      LYS   1  -1.635   0.580   2.732
    4    HB3  LYS   1           HB2      LYS   1  -1.980  -1.139   2.586
    5    HG2  LYS   1           HG1      LYS   1  -2.673  -0.746   5.153
    6    HG3  LYS   1           HG2      LYS   1  -3.023   0.852   4.489
    7    HD2  LYS   1           HD1      LYS   1  -4.030  -1.730   3.300
    8    HD3  LYS   1           HD2      LYS   1  -4.952  -0.738   4.432
    9    HE2  LYS   1           HE1      LYS   1  -3.824   0.631   2.063
   10    HE3  LYS   1           HE2      LYS   1  -5.149  -0.495   1.772
   11    HZ1  LYS   1           HZ1      LYS   1  -5.408   1.499   3.913
   12    HZ2  LYS   1           HZ2      LYS   1  -6.612   0.771   2.974
   13    HZ3  LYS   1           HZ3      LYS   1  -5.638   1.983   2.308
   14    H    TYR   2           HN       TYR   2   2.080  -0.636   4.434
   15    HA   TYR   2           HA       TYR   2   2.890   0.283   1.812
   16    HB2  TYR   2           HB1      TYR   2   5.097   0.471   2.740
   17    HB3  TYR   2           HB2      TYR   2   3.960   1.092   3.931
   18    HD1  TYR   2           HD2      TYR   2   3.402  -0.283   5.932
   19    HD2  TYR   2           HD1      TYR   2   6.470  -1.414   3.210
   20    HE1  TYR   2           HE2      TYR   2   4.325  -1.818   7.618
   21    HE2  TYR   2           HE1      TYR   2   7.401  -2.952   4.888
   22    HH   TYR   2           HH       TYR   2   7.145  -3.853   6.903
   23    H    TYR   3           HN       TYR   3   4.890  -0.840   0.846
   24    HA   TYR   3           HA       TYR   3   4.951  -3.715   1.187
   25    HB2  TYR   3           HB1      TYR   3   4.531  -4.104  -1.266
   26    HB3  TYR   3           HB2      TYR   3   3.119  -3.596  -0.346
   27    HD1  TYR   3           HD1      TYR   3   2.315  -1.236  -0.537
   28    HD2  TYR   3           HD2      TYR   3   5.355  -2.801  -3.070
   29    HE1  TYR   3           HE1      TYR   3   1.949   0.618  -2.112
   30    HE2  TYR   3           HE2      TYR   3   4.998  -0.952  -4.651
   31    HH   TYR   3           HH       TYR   3   3.837   1.706  -4.143
   32    H    GLY   4           HN       GLY   4   7.020  -4.270   1.136
   33    HA2  GLY   4           HA1      GLY   4   8.939  -2.508  -0.192
   34    HA3  GLY   4           HA2      GLY   4   9.322  -3.780   0.959
   35    H    ASN   5           HN       ASN   5   7.161  -4.379  -1.702
   36    HA   ASN   5           HA       ASN   5   8.746  -6.541  -2.643
   37    HB2  ASN   5           HB1      ASN   5   6.165  -6.142  -2.800
   38    HB3  ASN   5           HB2      ASN   5   6.571  -5.294  -4.290
   39   HD21  ASN   5          HD21      ASN   5   7.391  -8.328  -2.637
   40   HD22  ASN   5          HD22      ASN   5   7.287  -9.320  -4.048
   41    H    GLY   6           HN       GLY   6  10.775  -5.585  -3.132
   42    HA2  GLY   6           HA1      GLY   6  11.041  -4.806  -5.862
   43    HA3  GLY   6           HA2      GLY   6  11.275  -3.433  -4.790
   44    H    VAL   7           HN       VAL   7  12.453  -6.664  -5.582
   45    HA   VAL   7           HA       VAL   7  14.730  -6.596  -3.905
   46    HB   VAL   7           HB       VAL   7  15.597  -8.429  -5.334
   47   HG11  VAL   7          HG11      VAL   7  14.366  -9.422  -3.723
   48   HG12  VAL   7          HG12      VAL   7  12.947  -8.422  -4.040
   49   HG13  VAL   7          HG13      VAL   7  13.300  -9.807  -5.074
   50   HG21  VAL   7          HG21      VAL   7  13.161  -7.778  -6.982
   51   HG22  VAL   7          HG22      VAL   7  14.847  -7.785  -7.500
   52   HG23  VAL   7          HG23      VAL   7  14.040  -9.302  -7.105
   53    H    HIS   8           HN       HIS   8  14.191  -5.659  -7.268
   54    HA   HIS   8           HA       HIS   8  16.931  -5.070  -7.809
   55    HB2  HIS   8           HB1      HIS   8  14.333  -4.600  -9.212
   56    HB3  HIS   8           HB2      HIS   8  15.756  -3.707  -9.740
   57    HD1  HIS   8           HD1      HIS   8  14.035  -6.841 -10.225
   58    HD2  HIS   8           HD2      HIS   8  17.974  -5.538 -10.460
   59    HE1  HIS   8           HE1      HIS   8  15.241  -8.585 -11.577
   60    H    LEU   9           HN       LEU   9  14.224  -3.279  -6.526
   61    HA   LEU   9           HA       LEU   9  15.211  -0.672  -6.892
   62    HB2  LEU   9           HB1      LEU   9  12.959  -0.818  -6.329
   63    HB3  LEU   9           HB2      LEU   9  13.268  -1.920  -4.989
   64    HG   LEU   9           HG       LEU   9  14.349   0.836  -4.769
   65   HD11  LEU   9          HD11      LEU   9  12.320   1.654  -5.379
   66   HD12  LEU   9          HD12      LEU   9  11.965   1.285  -3.692
   67   HD13  LEU   9          HD13      LEU   9  11.468   0.167  -4.962
   68   HD21  LEU   9          HD21      LEU   9  14.764  -0.053  -2.769
   69   HD22  LEU   9          HD22      LEU   9  13.696  -1.424  -3.069
   70   HD23  LEU   9          HD23      LEU   9  13.035   0.092  -2.455
   71    H    THR  10           HN       THR  10  16.080  -3.173  -4.687
   72    HA   THR  10           HA       THR  10  17.201  -1.566  -2.635
   73    HB   THR  10           HB       THR  10  18.053  -4.373  -3.353
   74    HG1  THR  10           HG1      THR  10  16.241  -5.088  -2.474
   75   HG21  THR  10          HG21      THR  10  19.104  -4.438  -1.361
   76   HG22  THR  10          HG22      THR  10  17.828  -3.531  -0.548
   77   HG23  THR  10          HG23      THR  10  19.065  -2.679  -1.472
   78    H    LYS  11           HN       LYS  11  18.846  -3.544  -5.112
   79    HA   LYS  11           HA       LYS  11  21.371  -2.321  -4.684
   80    HB2  LYS  11           HB1      LYS  11  20.227  -4.205  -6.696
   81    HB3  LYS  11           HB2      LYS  11  21.747  -3.405  -7.075
   82    HG2  LYS  11           HG1      LYS  11  22.575  -4.252  -4.826
   83    HG3  LYS  11           HG2      LYS  11  21.144  -5.286  -4.817
   84    HD2  LYS  11           HD1      LYS  11  22.796  -6.646  -5.742
   85    HD3  LYS  11           HD2      LYS  11  21.931  -6.031  -7.153
   86    HE2  LYS  11           HE1      LYS  11  24.157  -5.755  -7.747
   87    HE3  LYS  11           HE2      LYS  11  23.711  -4.161  -7.141
   88    HZ1  LYS  11           HZ1      LYS  11  25.813  -5.708  -6.295
   89    HZ2  LYS  11           HZ2      LYS  11  24.675  -5.833  -5.051
   90    HZ3  LYS  11           HZ3      LYS  11  25.224  -4.311  -5.544
   91    H    SER  12           HN       SER  12  18.659  -1.602  -6.742
   92    HA   SER  12           HA       SER  12  19.963   0.045  -8.620
   93    HB2  SER  12           HB1      SER  12  17.727  -0.775  -9.060
   94    HB3  SER  12           HB2      SER  12  17.099   0.062  -7.640
   95    HG   SER  12           HG       SER  12  16.744   1.632  -8.986
   96    H    GLY  13           HN       GLY  13  18.952   0.575  -5.347
   97    HA2  GLY  13           HA1      GLY  13  20.443   2.646  -4.628
   98    HA3  GLY  13           HA2      GLY  13  19.217   3.472  -5.578
   99    H    LEU  14           HN       LEU  14  19.320   0.955  -3.050
  100    HA   LEU  14           HA       LEU  14  16.793   1.448  -1.995
  101    HB2  LEU  14           HB1      LEU  14  17.382   0.070  -0.234
  102    HB3  LEU  14           HB2      LEU  14  18.446  -0.465  -1.532
  103    HG   LEU  14           HG       LEU  14  20.064   1.312  -0.333
  104   HD11  LEU  14          HD11      LEU  14  18.938   2.029   1.508
  105   HD12  LEU  14          HD12      LEU  14  19.698   0.591   2.188
  106   HD13  LEU  14          HD13      LEU  14  18.014   0.535   1.666
  107   HD21  LEU  14          HD21      LEU  14  20.485  -1.082  -0.868
  108   HD22  LEU  14          HD22      LEU  14  19.688  -1.515   0.645
  109   HD23  LEU  14          HD23      LEU  14  21.172  -0.562   0.670
  110    H    SER  15           HN       SER  15  19.684   3.274  -1.728
  111    HA   SER  15           HA       SER  15  19.246   4.572   0.729
  112    HB2  SER  15           HB1      SER  15  20.569   5.939  -1.598
  113    HB3  SER  15           HB2      SER  15  20.975   6.027   0.116
  114    HG   SER  15           HG       SER  15  21.624   4.083  -1.777
  115    H    VAL  16           HN       VAL  16  17.860   5.012  -2.419
  116    HA   VAL  16           HA       VAL  16  16.885   7.655  -2.053
  117    HB   VAL  16           HB       VAL  16  17.127   6.409  -4.260
  118   HG11  VAL  16          HG11      VAL  16  14.344   5.470  -4.016
  119   HG12  VAL  16          HG12      VAL  16  15.714   4.759  -4.873
  120   HG13  VAL  16          HG13      VAL  16  15.551   4.537  -3.130
  121   HG21  VAL  16          HG21      VAL  16  15.450   8.477  -3.461
  122   HG22  VAL  16          HG22      VAL  16  15.936   8.088  -5.112
  123   HG23  VAL  16          HG23      VAL  16  14.432   7.437  -4.459
  124    H    ASN  17           HN       ASN  17  15.840   4.569  -0.947
  125    HA   ASN  17           HA       ASN  17  13.086   5.164  -0.582
  126    HB2  ASN  17           HB1      ASN  17  14.383   2.869  -0.552
  127    HB3  ASN  17           HB2      ASN  17  14.515   3.204   1.171
  128   HD21  ASN  17          HD21      ASN  17  13.062   2.079   2.230
  129   HD22  ASN  17          HD22      ASN  17  11.413   1.850   1.769
  130    H    TRP  18           HN       TRP  18  15.939   5.427   1.483
  131    HA   TRP  18           HA       TRP  18  14.697   6.036   3.896
  132    HB2  TRP  18           HB1      TRP  18  17.360   6.854   2.744
  133    HB3  TRP  18           HB2      TRP  18  16.861   7.330   4.364
  134    HD1  TRP  18           HD1      TRP  18  18.034   4.316   2.355
  135    HE1  TRP  18           HE1      TRP  18  18.576   2.393   3.977
  136    HE3  TRP  18           HE3      TRP  18  16.208   6.356   6.672
  137    HZ2  TRP  18           HZ2      TRP  18  18.268   1.816   6.723
  138    HZ3  TRP  18           HZ3      TRP  18  16.370   5.053   8.753
  139    HH2  TRP  18           HH2      TRP  18  17.379   2.829   8.776
  140    H    GLY  19           HN       GLY  19  15.913   8.300   1.418
  141    HA2  GLY  19           HA1      GLY  19  15.148  10.678   2.609
  142    HA3  GLY  19           HA2      GLY  19  15.240  10.427   0.872
  143    H    GLU  20           HN       GLU  20  13.203   8.514   0.588
  144    HA   GLU  20           HA       GLU  20  10.937  10.202   0.451
  145    HB2  GLU  20           HB1      GLU  20  11.445   7.299  -0.058
  146    HB3  GLU  20           HB2      GLU  20   9.786   7.873   0.022
  147    HG2  GLU  20           HG1      GLU  20  11.916   8.890  -1.844
  148    HG3  GLU  20           HG2      GLU  20  10.594   7.804  -2.268
  149    H    ALA  21           HN       ALA  21  11.689   7.414   2.528
  150    HA   ALA  21           HA       ALA  21   9.317   7.439   4.018
  151    HB1  ALA  21           HB1      ALA  21  11.690   6.619   5.515
  152    HB2  ALA  21           HB2      ALA  21  10.231   5.713   5.112
  153    HB3  ALA  21           HB3      ALA  21  11.537   5.850   3.935
  154    H    PHE  22           HN       PHE  22  12.319   9.230   4.390
  155    HA   PHE  22           HA       PHE  22  11.864  10.240   6.974
  156    HB2  PHE  22           HB1      PHE  22  14.039  10.314   5.708
  157    HB3  PHE  22           HB2      PHE  22  13.367  11.631   4.752
  158    HD1  PHE  22           HD2      PHE  22  14.426  10.623   8.135
  159    HD2  PHE  22           HD1      PHE  22  13.269  13.838   5.598
  160    HE1  PHE  22           HE2      PHE  22  15.173  12.232   9.839
  161    HE2  PHE  22           HE1      PHE  22  14.015  15.453   7.298
  162    HZ   PHE  22           HZ       PHE  22  14.968  14.650   9.423
  163    H    SER  23           HN       SER  23  11.165  11.637   3.780
  164    HA   SER  23           HA       SER  23  10.045  14.038   4.687
  165    HB2  SER  23           HB1      SER  23  10.628  13.887   2.384
  166    HB3  SER  23           HB2      SER  23   9.630  12.452   2.151
  167    HG   SER  23           HG       SER  23   8.722  14.502   1.395
  168    H    ALA  24           HN       ALA  24   8.709  10.830   4.388
  169    HA   ALA  24           HA       ALA  24   5.977  11.440   4.480
  170    HB1  ALA  24           HB1      ALA  24   7.562   9.117   4.517
  171    HB2  ALA  24           HB2      ALA  24   6.502   9.027   5.925
  172    HB3  ALA  24           HB3      ALA  24   5.813   9.234   4.315
  173    H    GLY  25           HN       GLY  25   8.396  11.221   7.014
  174    HA2  GLY  25           HA1      GLY  25   6.491  11.303   9.166
  175    HA3  GLY  25           HA2      GLY  25   8.234  11.477   9.307
  176    H    VAL  26           HN       VAL  26   8.432  13.668   7.430
  177    HA   VAL  26           HA       VAL  26   8.204  15.835   9.157
  178    HB   VAL  26           HB       VAL  26   8.235  15.888   6.136
  179   HG11  VAL  26          HG11      VAL  26   7.758  18.061   6.495
  180   HG12  VAL  26          HG12      VAL  26   8.256  18.001   8.187
  181   HG13  VAL  26          HG13      VAL  26   9.468  18.161   6.915
  182   HG21  VAL  26          HG21      VAL  26  10.126  14.686   7.289
  183   HG22  VAL  26          HG22      VAL  26  10.600  16.045   6.270
  184   HG23  VAL  26          HG23      VAL  26  10.556  16.231   8.023
  185    H    HIS  27           HN       HIS  27   5.898  14.498   6.888
  186    HA   HIS  27           HA       HIS  27   4.098  16.669   6.824
  187    HB2  HIS  27           HB1      HIS  27   4.235  14.478   5.372
  188    HB3  HIS  27           HB2      HIS  27   3.131  13.846   6.591
  189    HD1  HIS  27           HD1      HIS  27   1.141  15.968   7.030
  190    HD2  HIS  27           HD2      HIS  27   2.745  15.249   3.265
  191    HE1  HIS  27           HE1      HIS  27  -0.521  16.916   5.398
  192    H    ARG  28           HN       ARG  28   4.263  13.784   8.878
  193    HA   ARG  28           HA       ARG  28   1.896  14.281  10.325
  194    HB2  ARG  28           HB1      ARG  28   3.310  12.131  10.203
  195    HB3  ARG  28           HB2      ARG  28   4.291  12.863  11.466
  196    HG2  ARG  28           HG1      ARG  28   2.852  11.662  12.749
  197    HG3  ARG  28           HG2      ARG  28   1.940  13.168  12.627
  198    HD2  ARG  28           HD1      ARG  28   0.489  11.267  12.221
  199    HD3  ARG  28           HD2      ARG  28   0.665  12.228  10.753
  200    HE   ARG  28           HE       ARG  28   2.584  10.193  10.715
  201   HH11  ARG  28          HH11      ARG  28  -0.870  10.589  10.543
  202   HH12  ARG  28          HH12      ARG  28  -1.116   9.169   9.581
  203   HH21  ARG  28          HH21      ARG  28   2.274   8.321   9.449
  204   HH22  ARG  28          HH22      ARG  28   0.673   7.879   8.960
  205    H    LEU  29           HN       LEU  29   5.227  15.317  10.781
  206    HA   LEU  29           HA       LEU  29   4.888  16.407  13.374
  207    HB2  LEU  29           HB1      LEU  29   6.916  16.656  11.209
  208    HB3  LEU  29           HB2      LEU  29   6.941  17.826  12.527
  209    HG   LEU  29           HG       LEU  29   6.962  14.893  13.124
  210   HD11  LEU  29          HD11      LEU  29   9.050  14.563  12.431
  211   HD12  LEU  29          HD12      LEU  29   9.595  16.108  13.085
  212   HD13  LEU  29          HD13      LEU  29   8.866  16.038  11.481
  213   HD21  LEU  29          HD21      LEU  29   6.826  17.086  14.711
  214   HD22  LEU  29          HD22      LEU  29   8.569  16.824  14.648
  215   HD23  LEU  29          HD23      LEU  29   7.503  15.535  15.209
  216    H    ALA  30           HN       ALA  30   4.639  17.774  10.124
  217    HA   ALA  30           HA       ALA  30   4.329  20.464  10.843
  218    HB1  ALA  30           HB1      ALA  30   4.277  18.968   8.474
  219    HB2  ALA  30           HB2      ALA  30   2.742  19.835   8.535
  220    HB3  ALA  30           HB3      ALA  30   4.262  20.724   8.640
  221    H    ASN  31           HN       ASN  31   2.005  17.827  10.641
  222    HA   ASN  31           HA       ASN  31  -0.246  19.567  11.158
  223    HB2  ASN  31           HB1      ASN  31  -0.809  17.757   9.774
  224    HB3  ASN  31           HB2      ASN  31   0.079  16.604  10.766
  225   HD21  ASN  31          HD21      ASN  31  -2.871  18.342  10.339
  226   HD22  ASN  31          HD22      ASN  31  -3.775  17.529  11.567
  227    H    GLY  32           HN       GLY  32   0.891  16.631  12.843
  228    HA2  GLY  32           HA1      GLY  32   0.026  17.886  15.369
  229    HA3  GLY  32           HA2      GLY  32   0.090  16.153  15.081
  230    H    GLY  33           HN       GLY  33   2.057  19.048  15.541
  231    HA2  GLY  33           HA1      GLY  33   4.440  17.415  15.972
  232    HA3  GLY  33           HA2      GLY  33   4.380  19.170  15.905
  233    H    ASN  34           HN       ASN  34   3.216  20.232  17.761
  234    HA   ASN  34           HA       ASN  34   3.327  18.702  20.245
  235    HB2  ASN  34           HB1      ASN  34   5.551  19.997  19.651
  236    HB3  ASN  34           HB2      ASN  34   4.645  21.387  20.243
  237   HD21  ASN  34          HD21      ASN  34   3.900  21.370  22.412
  238   HD22  ASN  34          HD22      ASN  34   4.690  20.401  23.606
  239    H    GLY  35           HN       GLY  35   1.269  18.940  20.882
  240    HA2  GLY  35           HA1      GLY  35  -0.615  19.966  21.704
  241    HA3  GLY  35           HA2      GLY  35   0.338  21.436  21.836
  242    H    PHE  36           HN       PHE  36   0.047  23.044  20.384
  243    HA   PHE  36           HA       PHE  36  -2.145  22.709  18.498
  244    HB2  PHE  36           HB1      PHE  36  -1.956  25.192  18.253
  245    HB3  PHE  36           HB2      PHE  36  -2.269  24.661  19.902
  246    HD1  PHE  36           HD2      PHE  36   0.345  25.904  17.611
  247    HD2  PHE  36           HD1      PHE  36  -0.768  25.150  21.650
  248    HE1  PHE  36           HE2      PHE  36   2.311  27.166  18.385
  249    HE2  PHE  36           HE1      PHE  36   1.195  26.411  22.430
  250    HZ   PHE  36           HZ       PHE  36   2.738  27.420  20.797
  251    H    TRP  37           HN       TRP  37   1.303  23.152  18.537
  252    HA   TRP  37           HA       TRP  37   1.430  23.728  15.693
  253    HB2  TRP  37           HB1      TRP  37   2.988  24.713  17.480
  254    HB3  TRP  37           HB2      TRP  37   3.776  23.138  17.491
  255    HD1  TRP  37           HD1      TRP  37   4.137  22.417  14.556
  256    HE1  TRP  37           HE1      TRP  37   5.558  23.843  12.953
  257    HE3  TRP  37           HE3      TRP  37   4.047  26.844  17.111
  258    HZ2  TRP  37           HZ2      TRP  37   6.515  26.494  12.792
  259    HZ3  TRP  37           HZ3      TRP  37   5.241  28.777  16.165
  260    HH2  TRP  37           HH2      TRP  37   6.449  28.603  14.050