*HEADER    TOXIN                                   27-AUG-07   2RLW              
*TITLE     THREE-DIMENSIONAL STRUCTURE OF THE TWO PEPTIDES THAT                  
*TITLE    2 CONSTITUTE THE TWO-PEPTIDE BACTERIOCIN PLANTARACIN EF                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PLNF;                                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: BACTERIOCIN PEPTIDE PLNF;                                   
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: LACTOBACILLUS PLANTARUM;                        
*SOURCE   3 STRAIN: C11;                                                         
*SOURCE   4 GENE: PLNF;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PGEV2                                      
*KEYWDS    PEPTIDE PLNF, TOXIN                                                   
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    N.FIMLAND, P.ROGNE, G.FIMLAND, J.NISSEN-MEYER, P.KRISTIANSEN          
*REVDAT   1   01-JUL-08 2RLW    0                                                


# 21 ALA  HN     22 ASP  HN      3.63            #peak     1 #SUP  0.77  #QF  0.77
# 28 VAL  HB     29 ARG  HN      3.84            #peak     2 #SUP  0.92  #QF  0.92
#  7 ALA  QB      8 ARG  HN      3.55            #peak     4 #SUP  0.84  #QF  0.84
#  8 ARG  HN      8 ARG  QB      3.14            #peak     5 #SUP  0.70  #QF  0.70
#  3 HIS  HN      4 ALA  HN      3.82            #peak     6 #SUP  0.85  #QF  0.85
# 12 ASN  HN     12 ASN  QB      3.53            #peak     8 #SUP  0.70  #QF  0.70
# 11 ARG  HB3    12 ASN  HN      4.07            #peak     9 #SUP  0.98  #QF  0.98
# 11 ARG  HB2    12 ASN  HN      4.01            #peak    10 #SUP  0.97  #QF  0.97
  2 PHE  HA      2 PHE  QD      3.81            #peak    12 #SUP  1.00
  5 TYR  HA      5 TYR  QD      3.95            #peak    13 #SUP  0.94  #QF  0.94
 14 TYR  HA     14 TYR  QD      3.69            #peak    15 #SUP  0.83  #QF  0.83
 33 HIS  HA     33 HIS  HD2     5.14            #peak    18 #SUP  0.99  #QF  0.99
 29 ARG  HA     33 HIS  HD2     4.71            #peak    21 #SUP  0.44  #QF  0.44
 32 ILE  HB     33 HIS  HD2     5.25            #peak    22 #SUP  0.93  #QF  0.93
 29 ARG  QG     33 HIS  HD2     5.40            #peak    23 #SUP  0.59  #QF  0.59
 32 ILE  QG2    33 HIS  HD2     4.93            #peak    24 #SUP  0.59  #QF  0.59
# 33 HIS  HN     33 HIS  HD2     4.10            #peak    25 #SUP  0.83  #QF  0.83
# 32 ILE  HN     32 ILE  QG2     4.25            #peak    26 #SUP  0.97  #QF  0.88
# 32 ILE  HN     32 ILE  HB      3.72            #peak    28 #SUP  0.95  #QF  0.95
# 31 PHE  QB     32 ILE  HN      3.65            #peak    29 #SUP  0.79  #QF  0.79
# 32 ILE  QG2    33 HIS  HN      4.36            #peak    32 #SUP  0.89  #QF  0.24
# 10 VAL  HN     10 VAL  QG1     3.45            #peak    34 #SUP  0.82  #QF  0.82
# 19 GLY  HN     20 PRO  QD      3.99            #peak    36 #SUP  0.92  #QF  0.85
# 29 ARG  HN     29 ARG  QB      3.45            #peak    37 #SUP  0.94  #QF  0.94
# 26 SER  HA     29 ARG  HN      3.63            #peak    38 #SUP  0.45  #QF  0.45
# 29 ARG  HN     30 GLY  HN      3.71            #peak    39 #SUP  0.71  #QF  0.71
# 24 VAL  HN     24 VAL  QG2     4.67            #peak    44 #SUP  0.95  #QF  0.95
# 24 VAL  HN     24 VAL  HB      4.13            #peak    45 #SUP  0.98  #QF  0.98
# 18 VAL  HN     18 VAL  QG2     3.79            #peak    47 #SUP  0.91  #QF  0.91
 23 TRP  HE3    24 VAL  QG1     5.22            #peak    48 #SUP  0.85  #QF  0.85
 23 TRP  HE3    24 VAL  HA      3.52            #peak    50 #SUP  0.82  #QF  0.82
# 18 VAL  HN     20 PRO  QD      4.51            #peak    51 #SUP  0.92  #QF  0.81
# 16 SER  HA     18 VAL  HN      4.53            #peak    52 #SUP  0.96  #QF  0.49
#  2 PHE  HN      2 PHE  QD      4.38            #peak    55 #SUP  0.99  #QF  0.99
#  1 VAL  HA      2 PHE  HN      3.60            #peak    57 #SUP  0.98  #QF  0.98
#  1 VAL  HB      2 PHE  HN      4.51            #peak    58 #SUP  0.95  #QF  0.95
#  7 ALA  HN      7 ALA  QB      3.84            #peak    62 #SUP  0.99  #QF  0.99
# 21 ALA  HA     22 ASP  HN      3.62            #peak    63 #SUP  0.89  #QF  0.89
# 30 GLY  HN     31 PHE  QB      4.11            #peak    64 #SUP  0.96  #QF  0.35
# 33 HIS  HN     33 HIS  HB3     3.89            #peak    65 #SUP  0.99  #QF  0.99
#  9 GLY  QA     10 VAL  HN      2.93            #peak    68 #SUP  0.90  #QF  0.90
# 18 VAL  HB     19 GLY  HN      4.03            #peak    71 #SUP  0.90  #QF  0.90
#  4 ALA  HN      4 ALA  QB      3.59            #peak    72 #SUP  0.98  #QF  0.98
#  3 HIS  HA      4 ALA  HN      3.63            #peak    73 #SUP  0.97  #QF  0.97
#  4 ALA  HN      5 TYR  HN      4.41            #peak    74 #SUP  0.90  #QF  0.72
#  5 TYR  HN      6 SER  HN      4.73            #peak    74 #SUP  0.90  #QF  0.72
#  2 PHE  QD      3 HIS  HN      5.25            #peak    77 #SUP  0.98  #QF  0.91
#  3 HIS  HN      3 HIS  HD2     5.42            #peak    77 #SUP  0.98  #QF  0.91
# 10 VAL  HN     10 VAL  HB      3.68            #peak    78 #SUP  0.86  #QF  0.86
# 29 ARG  QG     30 GLY  HN      4.78            #peak    79 #SUP  0.62  #QF  0.62
# 31 PHE  HN     31 PHE  QB      3.43            #peak    80 #SUP  1.00
 14 TYR  QD     15 LYS  HA      4.64            #peak    83 #SUP  0.43  #QF  0.43
 31 PHE  HA     31 PHE  QD      3.44            #peak    87 #SUP  0.58  #QF  0.58
 23 TRP  HA     23 TRP  HD1     4.87            #peak    88 #SUP  0.99  #QF  0.99
 20 PRO  QD     23 TRP  HD1     4.81            #peak    89 #SUP  0.38  #QF  0.38
 23 TRP  HB2    23 TRP  HD1     3.90            #peak    90 #SUP  0.97  #QF  0.97
# 23 TRP  HN     23 TRP  HD1     4.31            #peak    93 #SUP  0.93  #QF  0.93
# 17 ALA  HN     18 VAL  HN      4.24            #peak    94 #SUP  0.72  #QF  0.72
# 15 LYS  HN     15 LYS  QG      4.11            #peak   106 #SUP  0.66  #QF  0.66
#  5 TYR  HN      5 TYR  QB      4.00            #peak   108 #SUP  0.97  #QF  0.97
#  4 ALA  QB      5 TYR  HN      4.72            #peak   110 #SUP  1.00
# 24 VAL  HN     24 VAL  QG1     4.67            #peak   111 #SUP  0.79  #QF  0.79
# 11 ARG  HN     11 ARG  HB2     3.78            #peak   115 #SUP  0.83  #QF  0.83
# 10 VAL  QG2    11 ARG  HN      3.84            #peak   116 #SUP  0.60  #QF  0.60
  3 HIS  HD2     4 ALA  QB      5.50            #peak   120 #SUP  0.87  #QF  0.87
 15 LYS  QD     15 LYS  QE      2.89            #peak   121 #SUP  0.56  #QF  0.56
# 18 VAL  HN     18 VAL  QG1     4.00            #peak   123 #SUP  0.90  #QF  0.90
 23 TRP  HE3    24 VAL  QG2     4.92            #peak   124 #SUP  0.98  #QF  0.98
 15 LYS  QD     15 LYS  QZ      4.09            #peak   125 #SUP  0.94  #QF  0.94
# 11 ARG  HG3    12 ASN  HN      4.23            #peak   128 #SUP  0.73  #QF  0.73
# 32 ILE  HB     33 HIS  HN      3.88            #peak   129 #SUP  0.66  #QF  0.66
# 24 VAL  HB     25 ILE  HN      4.38            #peak   130 #SUP  0.91  #QF  0.91
# 12 ASN  QB     13 ASN  HN      3.86            #peak   132 #SUP  0.97  #QF  0.97
# 14 TYR  HN     14 TYR  HB3     4.08            #peak   134 #SUP  0.98  #QF  0.98
#  5 TYR  QB      6 SER  HN      4.08            #peak   136 #SUP  0.88  #QF  0.88
# 23 TRP  HN     23 TRP  HB2     3.93            #peak   138 #SUP  0.75  #QF  0.75
 11 ARG  HA     14 TYR  QD      4.70            #peak   148 #SUP  0.70  #QF  0.70
 28 VAL  HA     31 PHE  QD      4.94            #peak   149 #SUP  0.78  #QF  0.48
  8 ARG  HE     11 ARG  QD      3.52            #peak   151 #SUP  0.21  #QF  0.21
 31 PHE  QD     32 ILE  QD1     3.78            #peak   155 #SUP  0.23  #QF  0.23
 14 TYR  QD     18 VAL  QG1     5.36            #peak   156 #SUP  0.35  #QF  0.35
#  4 ALA  HN      5 TYR  QD      4.61            #peak   158 #SUP  0.89  #QF  0.46
#  5 TYR  QD      6 SER  HN      4.77            #peak   158 #SUP  0.89  #QF  0.46
#  3 HIS  HD2     4 ALA  HN      4.73            #peak   159 #SUP  0.77  #QF  0.77
# 14 TYR  HN     14 TYR  QD      3.74            #peak   160 #SUP  0.79  #QF  0.79
#  5 TYR  HN      5 TYR  QD      3.85            #peak   163 #SUP  0.74  #QF  0.74
 18 VAL  HA     18 VAL  QG2     3.61            #peak   164 #SUP  0.98  #QF  0.98
 18 VAL  HA     18 VAL  QG1     3.65            #peak   165 #SUP  0.92  #QF  0.92
 24 VAL  HA     24 VAL  QG2     4.26            #peak   167 #SUP  0.97  #QF  0.97
 24 VAL  HA     24 VAL  QG1     4.26            #peak   168 #SUP  0.80  #QF  0.80
 29 ARG  HA     29 ARG  QG      3.57            #peak   173 #SUP  0.78  #QF  0.78
 32 ILE  HA     32 ILE  QD1     3.54            #peak   175 #SUP  0.64  #QF  0.64
 32 ILE  HA     32 ILE  QG1     4.24            #peak   176 #SUP  0.99  #QF  0.99
 11 ARG  HB3    11 ARG  QD      3.02            #peak   179 #SUP  0.71  #QF  0.71
 17 ALA  HA     20 PRO  QB      4.52            #peak   180 #SUP  0.95  #QF  0.95
 17 ALA  HA     20 PRO  QG      3.65            #peak   182 #SUP  0.81  #QF  0.81
  7 ALA  HA     10 VAL  HB      4.39            #peak   186 #SUP  0.68  #QF  0.68
  8 ARG  HA      8 ARG  QB      3.05            #peak   189 #SUP  0.91  #QF  0.87
  8 ARG  HA      8 ARG  QG      3.23            #peak   190 #SUP  0.45  #QF  0.45
  7 ALA  HA     10 VAL  QG1     3.74            #peak   197 #SUP  0.35  #QF  0.35
 21 ALA  HA     24 VAL  QG2     4.51            #peak   198 #SUP  0.34  #QF  0.34
 29 ARG  HA     32 ILE  QG2     3.81            #peak   199 #SUP  0.41  #QF  0.41
 18 VAL  QG1    19 GLY  QA      3.59            #peak   200 #SUP  0.70  #QF  0.70
 10 VAL  HA     10 VAL  QG2     3.05            #peak   201 #SUP  0.92  #QF  0.92
 10 VAL  HA     10 VAL  QG1     3.35            #peak   202 #SUP  0.99  #QF  0.99
 15 LYS  HA     15 LYS  QG      4.11            #peak   204 #SUP  0.99  #QF  0.99
 15 LYS  QE     16 SER  HA      3.62            #peak   207 #SUP  0.95  #QF  0.94
 17 ALA  HA     20 PRO  QD      3.79            #peak   210 #SUP  0.83  #QF  0.83
  8 ARG  HA     11 ARG  QD      3.80            #peak   212 #SUP  0.67  #QF  0.67
 26 SER  HA     29 ARG  QD      3.97            #peak   213 #SUP  0.44  #QF  0.44
 18 VAL  HB     19 GLY  QA      4.28            #peak   215 #SUP  0.65  #QF  0.65
 32 ILE  HB     32 ILE  QD1     3.65            #peak   220 #SUP  0.99  #QF  0.99
 10 VAL  QG1    11 ARG  HB3     3.90            #peak   223 #SUP  0.66  #QF  0.66
 18 VAL  QG1    21 ALA  QB      3.66            #peak   226 #SUP  0.69  #QF  0.69
 17 ALA  QB     18 VAL  QG2     3.86            #peak   227 #SUP  0.89  #QF  0.61
 18 VAL  QG2    21 ALA  QB      4.18            #peak   227 #SUP  0.89  #QF  0.61
 10 VAL  QG1    11 ARG  HA      3.75            #peak   228 #SUP  0.55  #QF  0.55
 28 VAL  HA     31 PHE  QB      3.79            #peak   230 #SUP  0.56  #QF  0.56
# 22 ASP  HN     23 TRP  HN      4.17            #peak   238 #SUP  0.94  #QF  0.94
#  7 ALA  HN      8 ARG  HN      4.35            #peak   239 #SUP  0.87  #QF  0.87
 32 ILE  HA     32 ILE  QG2     4.02            #peak   247 #SUP  0.80  #QF  0.80
# 14 TYR  QD     15 LYS  HN      4.06            #peak   256 #SUP  0.88  #QF  0.88
# 28 VAL  QG2    29 ARG  HN      4.41            #peak   257 #SUP  0.64  #QF  0.64
# 28 VAL  QG1    29 ARG  HN      4.41            #peak   258 #SUP  0.76  #QF  0.76
# 15 LYS  HN     15 LYS  QB      3.99            #peak   265 #SUP  0.99  #QF  0.99
# 28 VAL  HN     30 GLY  HN      4.14            #peak   266 #SUP  0.46  #QF  0.46
 22 ASP  HA     25 ILE  HB      4.20            #peak   267 #SUP  0.27  #QF  0.27
# 20 PRO  QD     21 ALA  HN      4.39            #peak   269 #SUP  0.82  #QF  0.53
# 28 VAL  HA     30 GLY  HN      5.03            #peak   270 #SUP  0.65  #QF  0.46
# 28 VAL  HA     31 PHE  HN      5.03            #peak   271 #SUP  0.59  #QF  0.59
 23 TRP  HA     23 TRP  HE3     4.81            #peak   274 #SUP  0.94  #QF  0.94
  3 HIS  HA      5 TYR  QD      5.11            #peak   278 #SUP  0.70  #QF  0.70
# 18 VAL  HN     19 GLY  HN      4.66            #peak   280 #SUP  0.99  #QF  0.98
# 29 ARG  HN     29 ARG  HE      5.26            #peak   280 #SUP  0.99  #QF  0.98
# 23 TRP  HE3    24 VAL  HN      4.67            #peak   281 #SUP  0.94  #QF  0.94
#  6 SER  HN      7 ALA  HN      4.31            #peak   283 #SUP  0.68  #QF  0.68
#  3 HIS  HN      5 TYR  QD      4.53            #peak   287 #SUP  0.42  #QF  0.42
# 23 TRP  HN     23 TRP  HE3     4.90            #peak   288 #SUP  0.70  #QF  0.70
#  2 PHE  HN      3 HIS  HN      4.71            #peak   289 #SUP  0.99  #QF  0.99
 31 PHE  QD     32 ILE  HA      5.50            #peak   291 #SUP  0.95  #QF  0.73
 31 PHE  QE     32 ILE  HA      5.50            #peak   291 #SUP  0.95  #QF  0.73
# 33 HIS  HB3    34 GLY  HN      4.66            #peak   292 #SUP  0.89  #QF  0.89
 #22 ASP  HN     23 TRP  HB3     4.45            #peak   293 #SUP  0.86  #QF  0.86
# 25 ILE  HA     29 ARG  HN      4.94            #peak   294 #SUP  0.92  #QF  0.92
# 29 ARG  HN     29 ARG  QD      4.39            #peak   295 #SUP  0.94  #QF  0.94
 23 TRP  HH2    24 VAL  HA      4.89            #peak   296 #SUP  0.85  #QF  0.85
 14 TYR  HA     18 VAL  QG2     4.50            #peak   297 #SUP  0.55  #QF  0.55
 31 PHE  QB     32 ILE  HA      4.73            #peak   300 #SUP  0.78  #QF  0.78
 29 ARG  HA     29 ARG  QD      4.63            #peak   301 #SUP  0.78  #QF  0.78
 11 ARG  HA     14 TYR  HB3     4.79            #peak   302 #SUP  0.86  #QF  0.86
 21 ALA  HA     24 VAL  HA      5.50            #peak   303 #SUP  0.92  #QF  0.92
 29 ARG  HA     32 ILE  QG1     4.97            #peak   305 #SUP  0.65  #QF  0.65
 21 ALA  QB     22 ASP  HA      5.29            #peak   307 #SUP  0.86  #QF  0.86
 19 GLY  QA     21 ALA  QB      4.31            #peak   308 #SUP  0.74  #QF  0.74
# 29 ARG  HN     29 ARG  QG      4.52            #peak   316 #SUP  0.82  #QF  0.82
# 11 ARG  HG2    12 ASN  HN      4.23            #peak   317 #SUP  0.72  #QF  0.72
 29 ARG  QB     29 ARG  HE      4.60            #peak   319 #SUP  0.95  #QF  0.95
# 29 ARG  HN     31 PHE  QB      4.84            #peak   322 #SUP  0.82  #QF  0.82
# 23 TRP  HD1    24 VAL  HN      4.98            #peak   324 #SUP  0.91  #QF  0.91
 24 VAL  HB     25 ILE  HA      5.50            #peak   326 #SUP  0.89  #QF  0.89
# 20 PRO  QD     22 ASP  HN      5.12            #peak   329 #SUP  0.73  #QF  0.73
# 22 ASP  HN     23 TRP  HA      5.50            #peak   337 #SUP  0.99  #QF  0.99
 29 ARG  HA     29 ARG  HE      5.50            #peak   342 #SUP  0.95  #QF  0.95
# 29 ARG  HN     32 ILE  QG2     5.50            #peak   347 #SUP  0.79  #QF  0.79
 23 TRP  HE3    24 VAL  HB      5.50            #peak   350 #SUP  0.94  #QF  0.94
 10 VAL  HA     12 ASN  QB      5.23            #peak   355 #SUP  0.53  #QF  0.53
  9 GLY  QA     12 ASN  QB      4.90            #peak   356 #SUP  0.44  #QF  0.44
  3 HIS  HA      4 ALA  QB      5.50            #peak   358 #SUP  0.87  #QF  0.87
 28 VAL  HA     32 ILE  QG2     6.00            #peak   360 #SUP  0.21  #QF  0.21
 33 HIS  HB2    34 GLY  QA      4.80            #peak   361 #SUP  0.52  #QF  0.52
 25 ILE  HA     26 SER  HA      5.50            #peak   362 #SUP  0.69  #QF  0.69
 11 ARG  HB2    14 TYR  HB3     4.82            #peak   363 #SUP  0.63  #QF  0.63
 32 ILE  QG2    32 ILE  QG1     3.19            #peak   365 #SUP  0.83  #QF  0.83
 28 VAL  QG2    31 PHE  QD      5.50            #peak   366 #SUP  0.89  #QF  0.62
 28 VAL  QG1    31 PHE  QD      5.50            #peak   367 #SUP  0.98  #QF  0.92
 32 ILE  HB     33 HIS  HB3     5.50            #peak   370 #SUP  0.65  #QF  0.65
 22 ASP  HN     23 TRP  HD1     5.50            #peak   374 #SUP  0.96  #QF  0.96
# 22 ASP  HA     25 ILE  QG2     5.28            #peak   377 #SUP  0.83  #QF  0.36
 25 ILE  HA     25 ILE  QG2     3.32            #peak   386 #SUP  1.00
 25 ILE  HA     28 VAL  HB      4.04            #peak   387 #SUP  0.81  #QF  0.81
 21 ALA  HA     24 VAL  QG1     4.51            #peak   389 #SUP  0.81  #QF  0.81
 21 ALA  HA     24 VAL  HB      3.79            #peak   391 #SUP  0.76  #QF  0.76
# 28 VAL  HN     28 VAL  HB      3.75            #peak   392 #SUP  0.88  #QF  0.88
# 25 ILE  HN     25 ILE  HB      3.53            #peak   396 #SUP  0.78  #QF  0.78
 10 VAL  QG1    11 ARG  HB2     5.14            #peak   397 #SUP  0.71  #QF  0.47
 18 VAL  HA     21 ALA  QB      3.74            #peak   398 #SUP  0.97  #QF  0.69
# 21 ALA  HN     21 ALA  QB      3.27            #peak   399 #SUP  0.88  #QF  0.88
# 17 ALA  HN     17 ALA  QB      3.36            #peak   401 #SUP  0.93  #QF  0.93
# 17 ALA  QB     18 VAL  HN      5.12            #peak   402 #SUP  0.98  #QF  0.92
 14 TYR  QD     18 VAL  QG2     4.80            #peak   405 #SUP  0.82  #QF  0.82
  1 VAL  HA      2 PHE  QB      5.10            #peak   369
#  1 VAL  QQG     2 PHE  HN      5.44            #peak   348
#  2 PHE  QB      3 HIS  HN      4.13            #peak    43
#  3 HIS  HN      3 HIS  QB      3.56            #peak    42
#  6 SER  QB      7 ALA  HN      3.83            #peak    59
  8 ARG  HA     11 ARG  QG      3.30            #peak   191
# 11 ARG  HN     11 ARG  QG      3.60            #peak   114
 11 ARG  QG     11 ARG  HE      3.66            #peak   152
# 11 ARG  QG     12 ASN  HN      3.43            #peak   128
# 12 ASN  HN     12 ASN  QD2     4.27            #peak   282
 21 ALA  HA     24 VAL  QQG     3.15            #peak   198
 21 ALA  QB     24 VAL  QQG     4.59            #peak   262
 22 ASP  HA     24 VAL  QQG     5.44            #peak   378
 23 TRP  HE3    24 VAL  QQG     4.18            #peak    48
 23 TRP  HH2    24 VAL  QQG     5.44            #peak   368
# 24 VAL  HN     24 VAL  QQG     3.77            #peak    44
# 24 VAL  QQG    25 ILE  HN      5.44            #peak   332
 25 ILE  HA     28 VAL  QQG     4.08            #peak   166
# 28 VAL  HN     28 VAL  QQG     3.71            #peak     7
 28 VAL  HA     28 VAL  QQG     3.13            #peak   385
# 28 VAL  QQG    29 ARG  HN      3.65            #peak   258
 28 VAL  QQG    29 ARG  QB      5.44            #peak   397
# 28 VAL  QQG    31 PHE  HN      5.44            #peak   349
 28 VAL  QQG    31 PHE  QB      5.44            #peak   364
 28 VAL  QQG    31 PHE  QE      5.44            #peak   366
  1 VAL  HA      2 PHE  HN      3.07            #peak     1 #SUP  0.90  #QF  0.90
  2 PHE  HA      3 HIS  HN      3.29            #peak     5 #SUP  0.90  #QF  0.90
  2 PHE  HN      3 HIS  HN      3.76            #peak     6 #SUP  0.99  #QF  0.99
  3 HIS  HN      4 ALA  HN      3.47            #peak     7 #SUP  0.99  #QF  0.99
  3 HIS  HN      5 TYR  QD      3.92            #peak    10 #SUP  0.68  #QF  0.68
  4 ALA  HN      4 ALA  QB      2.92            #peak    13 #SUP  0.99  #QF  0.99
 16 SER  HN     16 SER  HA      2.89            #peak    15 #SUP  0.89  #QF  0.89
 16 SER  HN     16 SER  QB      3.19            #peak    16 #SUP  0.77  #QF  0.77
  5 TYR  HN      5 TYR  QB      3.13            #peak    18 #SUP  0.97  #QF  0.97
  5 TYR  HA      6 SER  HN      3.13            #peak    21 #SUP  0.96  #QF  0.61
  6 SER  HN      6 SER  HB3     3.95            #peak    22 #SUP  0.94  #QF  0.94
  6 SER  HN      6 SER  HB2     3.95            #peak    23 #SUP  0.99  #QF  0.99
 32 ILE  HN     32 ILE  QG2     3.15            #peak    25 #SUP  0.95  #QF  0.95
 32 ILE  HN     32 ILE  HB      3.29            #peak    26 #SUP  0.97  #QF  0.97
 10 VAL  HN     10 VAL  HB      3.04            #peak    28 #SUP  0.97  #QF  0.97
 10 VAL  HN     10 VAL  QG2     3.68            #peak    29 #SUP  1.00
 10 VAL  HN     10 VAL  HA      2.92            #peak    30 #SUP  0.99  #QF  0.99
 33 HIS  HN     33 HIS  HB2     3.60            #peak    34 #SUP  0.90  #QF  0.90
 34 GLY  HN     34 GLY  QA      2.50            #peak    35 #SUP  1.00
 32 ILE  HA     33 HIS  HN      3.61            #peak    38 #SUP  0.94  #QF  0.94
 33 HIS  HA     34 GLY  HN      3.41            #peak    39 #SUP  0.98  #QF  0.98
 32 ILE  HN     33 HIS  HN      2.76            #peak    40 #SUP  0.80  #QF  0.80
 33 HIS  HN     34 GLY  HN      2.98            #peak    41 #SUP  0.94  #QF  0.94
 14 TYR  HB2    15 LYS  HN      4.09            #peak    42 #SUP  0.99  #QF  0.99
 29 ARG  QD     30 GLY  HN      4.18            #peak    43 #SUP  0.98  #QF  0.98
 26 SER  HN     26 SER  QB      2.71            #peak    45 #SUP  0.35  #QF  0.35
 31 PHE  HN     31 PHE  QB      2.94            #peak    46 #SUP  0.89  #QF  0.89
 30 GLY  HN     31 PHE  HN      3.28            #peak    47 #SUP  0.85  #QF  0.85
  8 ARG  HN      8 ARG  QB      2.84            #peak    50 #SUP  0.81  #QF  0.81
  8 ARG  HN      8 ARG  QG      4.04            #peak    51 #SUP  0.98  #QF  0.98
  7 ALA  HN      8 ARG  HN      3.53            #peak    53 #SUP  0.94  #QF  0.94
  7 ALA  HN      7 ALA  QB      3.17            #peak    55 #SUP  0.95  #QF  0.95
  6 SER  HN      7 ALA  HN      4.22            #peak    56 #SUP  0.99  #QF  0.99
  6 SER  HA      7 ALA  HN      3.29            #peak    57 #SUP  0.94  #QF  0.94
  6 SER  HB3     7 ALA  HN      4.62            #peak    58 #SUP  0.99  #QF  0.99
  6 SER  HB2     7 ALA  HN      4.62            #peak    59 #SUP  0.99  #QF  0.99
  7 ALA  QB      8 ARG  HN      3.16            #peak    60 #SUP  0.79  #QF  0.79
  9 GLY  HN      9 GLY  QA      2.68            #peak    63 #SUP  0.95  #QF  0.95
  9 GLY  HN     10 VAL  HB      4.53            #peak    66 #SUP  0.93  #QF  0.93
  8 ARG  QB      9 GLY  HN      3.23            #peak    68 #SUP  0.77  #QF  0.77
  7 ALA  QB      9 GLY  HN      4.40            #peak    70 #SUP  0.87  #QF  0.87
  7 ALA  HA      9 GLY  HN      3.74            #peak    71 #SUP  0.33  #QF  0.33
  6 SER  HA      9 GLY  HN      4.67            #peak    72 #SUP  0.71  #QF  0.71
  4 ALA  HN      5 TYR  HN      3.26            #peak    73 #SUP  0.90  #QF  0.90
  4 ALA  HA      5 TYR  HN      3.63            #peak    74 #SUP  0.99  #QF  0.99
  4 ALA  QB      5 TYR  HN      3.26            #peak    75 #SUP  0.95  #QF  0.95
  5 TYR  HN      5 TYR  QD      3.40            #peak    76 #SUP  0.94  #QF  0.94
  5 TYR  QB      6 SER  HN      3.32            #peak    78 #SUP  0.93  #QF  0.93
 17 ALA  HN     17 ALA  QB      2.97            #peak    80 #SUP  1.00
 16 SER  QB     17 ALA  HN      3.60            #peak    82 #SUP  0.71  #QF  0.71
 17 ALA  HN     18 VAL  HN      3.55            #peak    83 #SUP  0.99  #QF  0.99
 18 VAL  HN     18 VAL  HB      3.24            #peak    84 #SUP  0.97  #QF  0.97
 17 ALA  HA     18 VAL  HN      3.56            #peak    85 #SUP  0.99  #QF  0.99
 16 SER  QB     18 VAL  HN      5.01            #peak    86 #SUP  0.99  #QF  0.95
 18 VAL  HN     19 GLY  QA      5.41            #peak    86 #SUP  0.99  #QF  0.95
 18 VAL  HN     19 GLY  HN      4.01            #peak    87 #SUP  0.99  #QF  0.99
 16 SER  HA     19 GLY  HN      3.92            #peak    88 #SUP  0.64  #QF  0.64
 18 VAL  HB     19 GLY  HN      3.48            #peak    91 #SUP  0.84  #QF  0.84
 18 VAL  QG2    19 GLY  HN      4.28            #peak    92 #SUP  0.99  #QF  0.99
 18 VAL  QG1    19 GLY  HN      3.95            #peak    93 #SUP  0.99  #QF  0.99
 14 TYR  HN     15 LYS  HN      3.32            #peak    95 #SUP  0.62  #QF  0.62
  6 SER  HA      8 ARG  HN      3.48            #peak    98 #SUP  0.38  #QF  0.38
 18 VAL  HN     18 VAL  QG2     3.50            #peak    99 #SUP  0.94  #QF  0.94
 18 VAL  HN     20 PRO  QD      3.95            #peak   100 #SUP  1.00
 25 ILE  HN     26 SER  HN      3.60            #peak   101 #SUP  0.95  #QF  0.95
 32 ILE  QG2    33 HIS  HN      3.22            #peak   103 #SUP  0.91  #QF  0.91
 32 ILE  HB     33 HIS  HN      3.92            #peak   104 #SUP  0.99  #QF  0.99
 32 ILE  QG1    33 HIS  HN      4.55            #peak   106 #SUP  0.94  #QF  0.94
 32 ILE  HN     32 ILE  QG1     3.82            #peak   107 #SUP  0.99  #QF  0.99
 22 ASP  HN     22 ASP  QB      3.61            #peak   108 #SUP  1.00
 21 ALA  HN     22 ASP  HN      3.69            #peak   110 #SUP  0.96  #QF  0.96
 26 SER  QB     27 ALA  HN      3.25            #peak   112 #SUP  0.98  #QF  0.48
 30 GLY  QA     31 PHE  HN      3.29            #peak   115 #SUP  0.98  #QF  0.98
 29 ARG  QB     30 GLY  HN      3.67            #peak   116 #SUP  0.98  #QF  0.98
 28 VAL  QG1    30 GLY  HN      5.11            #peak   117 #SUP  1.00
 27 ALA  HN     29 ARG  HN      4.58            #peak   118 #SUP  0.97  #QF  0.97
 17 ALA  HA     21 ALA  HN      4.56            #peak   126 #SUP  0.58  #QF  0.58
 23 TRP  HN     24 VAL  HN      3.51            #peak   128 #SUP  0.97  #QF  0.97
 15 LYS  HN     16 SER  HN      3.50            #peak   129 #SUP  0.91  #QF  0.91
 13 ASN  HN     13 ASN  QB      3.36            #peak   134 #SUP  0.99  #QF  0.99
 12 ASN  QB     13 ASN  HN      3.20            #peak   135 #SUP  0.87  #QF  0.87
 13 ASN  QB     14 TYR  HN      3.85            #peak   137 #SUP  0.94  #QF  0.94
 12 ASN  HN     12 ASN  QB      3.10            #peak   139 #SUP  0.90  #QF  0.90
 10 VAL  HN     11 ARG  HN      3.57            #peak   142 #SUP  0.97  #QF  0.97
 10 VAL  HB     11 ARG  HN      3.51            #peak   146 #SUP  0.90  #QF  0.90
 11 ARG  HN     11 ARG  QD      3.76            #peak   147 #SUP  0.99  #QF  0.99
 11 ARG  HN     11 ARG  HB3     3.64            #peak   148 #SUP  0.98  #QF  0.98
  8 ARG  HA     11 ARG  HE      4.78            #peak   153 #SUP  0.47  #QF  0.47
 11 ARG  QD     11 ARG  HE      2.87            #peak   154 #SUP  0.98  #QF  0.98
 11 ARG  QG     11 ARG  HE      3.55            #peak   155 #SUP  0.96  #QF  0.96
 29 ARG  HN     29 ARG  HE      4.42            #peak   157 #SUP  0.86  #QF  0.86
 26 SER  HA     29 ARG  HE      4.62            #peak   158 #SUP  0.79  #QF  0.79
 29 ARG  HA     29 ARG  HE      4.68            #peak   159 #SUP  0.94  #QF  0.94
 29 ARG  QD     29 ARG  HE      2.81            #peak   160 #SUP  0.96  #QF  0.96
 29 ARG  QB     29 ARG  HE      2.88            #peak   161 #SUP  0.48  #QF  0.48
 29 ARG  QG     29 ARG  HE      3.38            #peak   162 #SUP  0.98  #QF  0.98
 25 ILE  QG2    29 ARG  HE      4.05            #peak   163 #SUP  0.35  #QF  0.35
  8 ARG  HA      8 ARG  HE      4.25            #peak   165 #SUP  0.94  #QF  0.94
  8 ARG  HE     11 ARG  QD      2.81            #peak   166 #SUP  0.21  #QF  0.21
  8 ARG  QB      8 ARG  HE      3.43            #peak   167 #SUP  0.83  #QF  0.83
  8 ARG  QG      8 ARG  HE      3.40            #peak   168 #SUP  0.98  #QF  0.98
 28 VAL  HA     31 PHE  HN      3.79            #peak   173 #SUP  0.81  #QF  0.81
 31 PHE  HN     32 ILE  HB      4.39            #peak   174 #SUP  0.86  #QF  0.86
 31 PHE  HN     32 ILE  QG2     4.45            #peak   175 #SUP  0.93  #QF  0.93
  8 ARG  HN     11 ARG  QD      4.18            #peak   176 #SUP  0.72  #QF  0.72
  9 GLY  HN     10 VAL  QG1     4.69            #peak   177 #SUP  0.97  #QF  0.97
  7 ALA  HA     10 VAL  HN      3.90            #peak   179 #SUP  0.81  #QF  0.81
  9 GLY  HN     10 VAL  HN      3.31            #peak   184 #SUP  0.92  #QF  0.47
 29 ARG  HN     30 GLY  HN      3.46            #peak   185 #SUP  0.99  #QF  0.99
 28 VAL  HN     29 ARG  HN      3.39            #peak   186 #SUP  0.95  #QF  0.95
 26 SER  HA     29 ARG  HN      3.92            #peak   187 #SUP  0.79  #QF  0.79
 14 TYR  HN     14 TYR  HB2     3.32            #peak   188 #SUP  0.96  #QF  0.96
 11 ARG  HN     11 ARG  HB2     3.64            #peak   189 #SUP  0.98  #QF  0.98
 10 VAL  QG1    11 ARG  HN      3.44            #peak   190 #SUP  0.74  #QF  0.74
 12 ASN  HA     12 ASN  HD22    4.28            #peak   192 #SUP  0.92  #QF  0.92
 12 ASN  HA     12 ASN  HD21    4.23            #peak   193 #SUP  0.99  #QF  0.99
 12 ASN  HN     12 ASN  HD22    4.41            #peak   196 #SUP  0.84  #QF  0.84
 12 ASN  QB     13 ASN  HD22    4.16            #peak   201 #SUP  0.56  #QF  0.56
 12 ASN  QB     13 ASN  HD21    4.16            #peak   202 #SUP  0.53  #QF  0.53
 13 ASN  QB     13 ASN  HD21    4.01            #peak   203 #SUP  0.93  #QF  0.93
  1 VAL  QQG     2 PHE  HN      3.44            #peak   204 #SUP  0.98  #QF  0.98
  1 VAL  HB      2 PHE  HN      3.52            #peak   205 #SUP  0.96  #QF  0.96
  1 VAL  QQG     3 HIS  HN      3.77            #peak   206 #SUP  0.93  #QF  0.93
  3 HIS  HN      4 ALA  QB      4.07            #peak   207 #SUP  0.90  #QF  0.90
  1 VAL  HB      3 HIS  HN      3.82            #peak   208 #SUP  0.24  #QF  0.24
  1 VAL  HA      3 HIS  HN      4.77            #peak   209 #SUP  0.98  #QF  0.98
  3 HIS  HN      5 TYR  HN      4.67            #peak   210 #SUP  1.00
  4 ALA  HN      5 TYR  QD      4.24            #peak   212 #SUP  0.92  #QF  0.92
  1 VAL  QQG     4 ALA  HN      4.35            #peak   214 #SUP  0.90  #QF  0.90
  5 TYR  HN      5 TYR  QE      4.71            #peak   215 #SUP  1.00
  5 TYR  QD      6 SER  HN      3.78            #peak   217 #SUP  0.94  #QF  0.94
  7 ALA  HN      8 ARG  QB      4.45            #peak   224 #SUP  0.84  #QF  0.84
 25 ILE  HA     28 VAL  HN      3.43            #peak   225 #SUP  0.31  #QF  0.31
  7 ALA  HN      9 GLY  HN      4.94            #peak   226 #SUP  0.97  #QF  0.97
  9 GLY  HN     11 ARG  QD      5.27            #peak   227 #SUP  0.66  #QF  0.66
  9 GLY  HN     12 ASN  QB      4.81            #peak   228 #SUP  0.61  #QF  0.61
 11 ARG  HN     12 ASN  QB      4.41            #peak   229 #SUP  0.85  #QF  0.85
 10 VAL  HN     11 ARG  QG      4.05            #peak   231 #SUP  0.47  #QF  0.47
  7 ALA  QB     10 VAL  HN      4.28            #peak   232 #SUP  0.89  #QF  0.89
 10 VAL  HN     10 VAL  QG1     3.05            #peak   233 #SUP  0.96  #QF  0.96
 11 ARG  HN     11 ARG  QG      3.71            #peak   234 #SUP  0.96  #QF  0.96
 11 ARG  HN     12 ASN  HN      4.36            #peak   235 #SUP  0.96  #QF  0.96
 11 ARG  HA     12 ASN  HN      3.63            #peak   236 #SUP  1.00
 11 ARG  HB2    12 ASN  HN      3.95            #peak   237 #SUP  0.98  #QF  0.98
 11 ARG  HB3    12 ASN  HN      3.95            #peak   238 #SUP  0.91  #QF  0.91
 11 ARG  QG     12 ASN  HN      4.11            #peak   239 #SUP  1.00
 10 VAL  HA     12 ASN  HN      4.62            #peak   240 #SUP  0.98  #QF  0.98
 12 ASN  HN     13 ASN  HN      3.47            #peak   241 #SUP  0.92  #QF  0.92
 13 ASN  HN     13 ASN  HD22    4.14            #peak   242 #SUP  0.86  #QF  0.86
 10 VAL  HA     13 ASN  HN      4.09            #peak   243 #SUP  0.74  #QF  0.74
 12 ASN  QB     12 ASN  HD21    3.37            #peak   244 #SUP  0.96  #QF  0.96
 12 ASN  QB     12 ASN  HD22    3.52            #peak   245 #SUP  0.98  #QF  0.98
 11 ARG  QD     12 ASN  HD22    5.50            #peak   246 #SUP  0.94  #QF  0.94
  8 ARG  QG     12 ASN  HD21    4.62            #peak   247 #SUP  0.86  #QF  0.86
  8 ARG  QG     12 ASN  HD22    4.37            #peak   248 #SUP  0.85  #QF  0.85
  8 ARG  QB     12 ASN  HD22    4.89            #peak   249 #SUP  0.91  #QF  0.91
 10 VAL  QG2    13 ASN  HN      5.05            #peak   251 #SUP  0.96  #QF  0.96
 11 ARG  HA     13 ASN  HN      4.72            #peak   252 #SUP  0.88  #QF  0.88
 13 ASN  HN     13 ASN  HD21    4.14            #peak   253 #SUP  0.96  #QF  0.96
 13 ASN  HN     14 TYR  HB3     4.22            #peak   254 #SUP  0.71  #QF  0.71
 13 ASN  QB     13 ASN  HD22    4.01            #peak   255 #SUP  0.90  #QF  0.90
 14 TYR  HN     14 TYR  QD      3.71            #peak   257 #SUP  0.98  #QF  0.98
 12 ASN  HA     14 TYR  HN      4.52            #peak   258 #SUP  0.78  #QF  0.78
 14 TYR  HB3    15 LYS  HN      4.14            #peak   260 #SUP  0.99  #QF  0.99
 15 LYS  HN     15 LYS  QB      3.12            #peak   261 #SUP  0.95  #QF  0.95
 15 LYS  HN     15 LYS  QG      3.49            #peak   262 #SUP  0.95  #QF  0.95
 14 TYR  QD     15 LYS  HN      3.19            #peak   263 #SUP  0.68  #QF  0.68
 13 ASN  HA     15 LYS  HN      5.02            #peak   264 #SUP  0.98  #QF  0.98
 12 ASN  HA     15 LYS  HN      4.89            #peak   265 #SUP  0.84  #QF  0.84
 12 ASN  QB     15 LYS  HN      5.18            #peak   266 #SUP  0.95  #QF  0.95
 23 TRP  HA     26 SER  HN      4.10            #peak   268 #SUP  0.75  #QF  0.75
 16 SER  HN     17 ALA  QB      4.40            #peak   269 #SUP  0.95  #QF  0.95
 15 LYS  QG     16 SER  HN      3.40            #peak   270 #SUP  0.69  #QF  0.69
 16 SER  HN     17 ALA  HN      4.22            #peak   271 #SUP  0.98  #QF  0.79
 17 ALA  HN     18 VAL  HB      4.58            #peak   273 #SUP  0.98  #QF  0.98
 17 ALA  HN     20 PRO  QD      4.30            #peak   274 #SUP  0.61  #QF  0.61
 18 VAL  HN     18 VAL  QG1     3.57            #peak   275 #SUP  0.98  #QF  0.98
 17 ALA  HN     18 VAL  QG2     4.81            #peak   278 #SUP  0.94  #QF  0.94
 18 VAL  HA     21 ALA  HN      5.50            #peak   280 #SUP  0.67  #QF  0.67
 21 ALA  HN     22 ASP  QB      4.41            #peak   281 #SUP  0.69  #QF  0.69
 20 PRO  QB     21 ALA  HN      3.68            #peak   282 #SUP  0.93  #QF  0.93
 22 ASP  HN     23 TRP  HN      3.81            #peak   285 #SUP  0.99  #QF  0.99
 22 ASP  HN     23 TRP  HA      5.14            #peak   286 #SUP  0.93  #QF  0.93
 23 TRP  HN     23 TRP  HB2     4.03            #peak   288 #SUP  0.91  #QF  0.91
 22 ASP  HN     25 ILE  QG2     4.29            #peak   289 #SUP  0.75  #QF  0.75
 22 ASP  HN     25 ILE  HB      5.39            #peak   290 #SUP  0.95  #QF  0.95
 31 PHE  HA     34 GLY  HN      4.01            #peak   291 #SUP  0.73  #QF  0.73
 32 ILE  HA     34 GLY  HN      4.07            #peak   292 #SUP  0.81  #QF  0.81
 33 HIS  HB3    34 GLY  HN      4.28            #peak   293 #SUP  0.95  #QF  0.95
 33 HIS  HB2    34 GLY  HN      4.28            #peak   294 #SUP  0.98  #QF  0.98
 32 ILE  QG1    34 GLY  HN      5.24            #peak   297 #SUP  0.99  #QF  0.99
 32 ILE  QG2    34 GLY  HN      4.49            #peak   298 #SUP  0.97  #QF  0.97
 31 PHE  HA     33 HIS  HN      4.23            #peak   299 #SUP  0.94  #QF  0.94
 33 HIS  HN     34 GLY  QA      4.60            #peak   300 #SUP  0.96  #QF  0.96
 30 GLY  QA     33 HIS  HN      3.80            #peak   301 #SUP  0.31  #QF  0.31
 28 VAL  HA     32 ILE  HN      4.36            #peak   305 #SUP  0.85  #QF  0.85
 31 PHE  QB     32 ILE  HN      3.28            #peak   306 #SUP  0.86  #QF  0.86
 28 VAL  QG1    32 ILE  HN      4.33            #peak   307 #SUP  0.79  #QF  0.79
 29 ARG  HN     29 ARG  QG      3.72            #peak   308 #SUP  0.89  #QF  0.89
 29 ARG  QG     31 PHE  HN      4.50            #peak   310 #SUP  0.81  #QF  0.81
 28 VAL  HN     30 GLY  HN      4.30            #peak   313 #SUP  0.94  #QF  0.94
 30 GLY  HN     31 PHE  QD      5.50            #peak   314 #SUP  0.99  #QF  0.99
 30 GLY  HN     31 PHE  HA      5.45            #peak   315 #SUP  0.99  #QF  0.99
 26 SER  HA     30 GLY  HN      4.25            #peak   316 #SUP  0.69  #QF  0.69
 28 VAL  HA     30 GLY  HN      4.48            #peak   317 #SUP  0.64  #QF  0.64
 28 VAL  HB     30 GLY  HN      4.76            #peak   318 #SUP  0.99  #QF  0.99
 29 ARG  QG     30 GLY  HN      4.32            #peak   319 #SUP  0.97  #QF  0.97
 30 GLY  HN     32 ILE  QG2     4.75     #       #peak   320 #SUP  0.73  #QF  0.73
 29 ARG  HN     29 ARG  QD      3.54            #peak   322 #SUP  0.97  #QF  0.97
 29 ARG  HN     29 ARG  QB      3.03            #peak   323 #SUP  0.92  #QF  0.92
 22 ASP  HA     26 SER  HN      4.08            #peak   324 #SUP  0.47  #QF  0.47
 24 VAL  HA     26 SER  HN      4.80            #peak   327 #SUP  0.97  #QF  0.97
 23 TRP  HN     23 TRP  HE3     5.01            #peak   328 #SUP  0.99  #QF  0.99
 23 TRP  HN     23 TRP  HD1     4.13            #peak   329 #SUP  0.93  #QF  0.93
 21 ALA  HA     23 TRP  HN      4.34            #peak   330 #SUP  0.89  #QF  0.89
 23 TRP  HN     23 TRP  HB3     4.03            #peak   331 #SUP  1.00
 22 ASP  QB     23 TRP  HN      3.84            #peak   332 #SUP  0.94  #QF  0.94
 23 TRP  HN     24 VAL  QG1     4.63            #peak   333 #SUP  0.95  #QF  0.95
 23 TRP  HN     25 ILE  QG2     4.28            #peak   334 #SUP  0.51  #QF  0.51
 23 TRP  HA     27 ALA  HN      4.55            #peak   335 #SUP  0.71  #QF  0.71
 24 VAL  HA     27 ALA  HN      4.00            #peak   337 #SUP  0.74  #QF  0.74
 27 ALA  HN     28 VAL  HB      4.62            #peak   338 #SUP  0.97  #QF  0.97
 21 ALA  HA     24 VAL  HN      3.91            #peak   345 #SUP  0.50  #QF  0.50
 24 VAL  QG1    25 ILE  HN      3.92            #peak   346 #SUP  0.91  #QF  0.91
 23 TRP  HN     23 TRP  HE1     5.45            #peak   356 #SUP  0.98  #QF  0.98
 23 TRP  HE3    24 VAL  HN      4.11            #peak   357 #SUP  0.84  #QF  0.84
 14 TYR  QD     17 ALA  HN      5.45            #peak   370 #SUP  0.58  #QF  0.58
 15 LYS  QE     17 ALA  HN      5.50            #peak   371 #SUP  0.79  #QF  0.79
 28 VAL  HN     31 PHE  HN      4.98            #peak   372 #SUP  0.84  #QF  0.84
 29 ARG  HN     31 PHE  HN      4.82            #peak   373 #SUP  0.99  #QF  0.99
 12 ASN  HN     12 ASN  HD21    4.17            #peak   377 #SUP  0.99  #QF  0.99
 12 ASN  HN     13 ASN  HD22    5.50            #peak   378 #SUP  0.63  #QF  0.29
 12 ASN  HN     14 TYR  QD      5.50            #peak   378 #SUP  0.63  #QF  0.29
 11 ARG  QD     12 ASN  HN      4.66            #peak   380 #SUP  1.00
 10 VAL  QG2    12 ASN  HN      5.50            #peak   381 #SUP  1.00
 10 VAL  QG1    12 ASN  HN      4.38            #peak   382 #SUP  0.96  #QF  0.96
  3 HIS  HN      5 TYR  QE      5.18            #peak   384 #SUP  0.92  #QF  0.92
  2 PHE  HN      5 TYR  HN      4.77            #peak   385 #SUP  0.66  #QF  0.66
  1 VAL  QQG     5 TYR  HN      4.59            #peak   386 #SUP  0.91  #QF  0.91
  2 PHE  HN      4 ALA  HN      5.14            #peak   389 #SUP  0.93  #QF  0.93
  4 ALA  HN      5 TYR  QE      5.50            #peak   391 #SUP  0.96  #QF  0.96
  5 TYR  QE      6 SER  HN      5.50            #peak   392 #SUP  0.99  #QF  0.99
  7 ALA  HN     10 VAL  QG1     5.50            #peak   393 #SUP  0.79  #QF  0.79
  8 ARG  HN      8 ARG  HE      3.97            #peak   394 #SUP  0.68  #QF  0.68
 28 VAL  HN     28 VAL  QG2     3.01            #peak   395 #SUP  0.70  #QF  0.70
  7 ALA  HN     10 VAL  HN      5.43            #peak   397 #SUP  0.96  #QF  0.96
 14 TYR  HN     14 TYR  HB3     3.35            #peak   398 #SUP  0.98  #QF  0.98
 11 ARG  HN     14 TYR  QD      4.93            #peak   399 #SUP  0.32  #QF  0.32
 11 ARG  HN     12 ASN  HA      5.35            #peak   400 #SUP  0.97  #QF  0.97
  7 ALA  QB     11 ARG  HN      4.40            #peak   401 #SUP  0.69  #QF  0.69
 12 ASN  HN     13 ASN  HA      5.44            #peak   402 #SUP  0.99  #QF  0.99
 10 VAL  HB     12 ASN  HN      5.50            #peak   403 #SUP  0.98  #QF  0.98
 10 VAL  QG1    13 ASN  HN      4.98            #peak   404 #SUP  0.94  #QF  0.94
 13 ASN  HN     14 TYR  HA      5.04            #peak   405 #SUP  0.89  #QF  0.89
 13 ASN  QB     15 LYS  HN      5.36            #peak   410 #SUP  0.84  #QF  0.84
 15 LYS  HN     18 VAL  HN      5.08            #peak   411 #SUP  0.44  #QF  0.44
 16 SER  HN     19 GLY  HN      5.10            #peak   412 #SUP  0.86  #QF  0.86
 16 SER  HN     18 VAL  HN      4.40            #peak   413 #SUP  0.96  #QF  0.96
 14 TYR  QD     16 SER  HN      5.11            #peak   414 #SUP  0.97  #QF  0.97
 13 ASN  HA     16 SER  HN      4.88            #peak   415 #SUP  0.69  #QF  0.69
 14 TYR  HB3    16 SER  HN      4.98            #peak   416 #SUP  0.91  #QF  0.91
 15 LYS  QE     16 SER  HN      3.35            #peak   417 #SUP  0.70  #QF  0.70
 15 LYS  QB     16 SER  HN      3.75            #peak   418 #SUP  0.77  #QF  0.77
 16 SER  HN     18 VAL  HB      4.44            #peak   419 #SUP  0.91  #QF  0.91
 15 LYS  HA     18 VAL  HN      4.42            #peak   420 #SUP  0.72  #QF  0.72
 19 GLY  HN     21 ALA  HN      4.60            #peak   421 #SUP  0.99  #QF  0.99
 19 GLY  HN     20 PRO  QB      5.50            #peak   423 #SUP  0.99  #QF  0.99
 18 VAL  HN     21 ALA  HN      4.49            #peak   424 #SUP  0.96  #QF  0.96
 28 VAL  HB     31 PHE  HN      5.50            #peak   431 #SUP  0.96  #QF  0.96
 29 ARG  HE     30 GLY  HN      6.00            #peak   432 #SUP  0.91  #QF  0.91
 30 GLY  HN     31 PHE  QB      4.23            #peak   434 #SUP  0.91  #QF  0.91
 22 ASP  HN     24 VAL  HN      4.34            #peak   443 #SUP  0.52  #QF  0.52
 23 TRP  HH2    24 VAL  HN      5.50            #peak   444 #SUP  0.81  #QF  0.81
 24 VAL  HN     25 ILE  HA      5.50            #peak   446 #SUP  0.92  #QF  0.92
 24 VAL  HN     24 VAL  HB      3.57            #peak   447 #SUP  0.97  #QF  0.97
 15 LYS  QD     15 LYS  QZ      3.69            #peak   455 #SUP  0.93  #QF  0.93
 25 ILE  HA     29 ARG  HE      5.50            #peak   458 #SUP  0.91  #QF  0.91
 28 VAL  HB     29 ARG  HE      5.19            #peak   460 #SUP  0.54  #QF  0.54
 11 ARG  HN     11 ARG  HE      5.06            #peak   466 #SUP  0.99  #QF  0.99
  7 ALA  QB     11 ARG  HE      5.50            #peak   468 #SUP  0.53  #QF  0.53
  6 SER  HA      8 ARG  HE      5.50            #peak   469 #SUP  0.76  #QF  0.76
  7 ALA  QB      8 ARG  HE      5.13            #peak   470 #SUP  0.70  #QF  0.70
 15 LYS  HN     15 LYS  QD      4.20            #peak   473 #SUP  0.96  #QF  0.96
  8 ARG  HE     12 ASN  HD21    5.50            #peak   474 #SUP  0.83  #QF  0.83
 23 TRP  HE3    27 ALA  HN      4.79            #peak   475 #SUP  0.69  #QF  0.69
 24 VAL  HN     24 VAL  QG1     3.29            #peak   479 #SUP  0.91  #QF  0.91
 24 VAL  HB     25 ILE  HN      3.96            #peak   480 #SUP  0.95  #QF  0.95
 23 TRP  HE3    25 ILE  HN      5.38            #peak   483 #SUP  0.83  #QF  0.83
 24 VAL  HB     27 ALA  HN      5.50            #peak   485 #SUP  0.96  #QF  0.96
 24 VAL  HB     26 SER  HN      5.50            #peak   488 #SUP  0.99  #QF  0.99
 19 GLY  HN     20 PRO  QD      3.26            #peak   493 #SUP  0.86  #QF  0.86
 17 ALA  HN     19 GLY  HN      4.65            #peak   494 #SUP  0.97  #QF  0.97
 19 GLY  HN     22 ASP  HN      5.50            #peak   495 #SUP  1.00
 22 ASP  HN     24 VAL  HB      5.37            #peak   497 #SUP  0.67  #QF  0.67
 21 ALA  HA     23 TRP  HE1     5.27            #peak   500 #SUP  0.52  #QF  0.52
 29 ARG  HN     32 ILE  HN      5.05            #peak   501 #SUP  0.91  #QF  0.91
 23 TRP  HD1    24 VAL  HN      5.10            #peak   502 #SUP  0.89  #QF  0.89
 18 VAL  QG1    22 ASP  HN      4.32            #peak   503 #SUP  0.33  #QF  0.33
  2 PHE  QD      3 HIS  HN      5.19            #peak   505 #SUP  0.93  #QF  0.50
  3 HIS  HN      3 HIS  HD2     5.43            #peak   505 #SUP  0.93  #QF  0.50
 12 ASN  HN     13 ASN  HD21    5.50            #peak   508 #SUP  0.99  #QF  0.99
  8 ARG  HA     12 ASN  HD22    4.68            #peak   509 #SUP  0.72  #QF  0.72
 11 ARG  HA     12 ASN  HD21    5.42            #peak   510 #SUP  0.68  #QF  0.68
  9 GLY  QA     12 ASN  HD21    4.64            #peak   511 #SUP  0.88  #QF  0.88
  9 GLY  QA     12 ASN  HD22    4.80            #peak   512 #SUP  0.90  #QF  0.90
 11 ARG  QD     12 ASN  HD21    4.79            #peak   513 #SUP  0.94  #QF  0.94
  8 ARG  QB     12 ASN  HD21    4.36            #peak   514 #SUP  0.86  #QF  0.86
 14 TYR  QE     15 LYS  HN      4.33            #peak   516 #SUP  0.94  #QF  0.94
 19 GLY  HN     20 PRO  QG      4.46            #peak   518 #SUP  0.99  #QF  0.99
 24 VAL  HN     24 VAL  QG2     3.57            #peak   520 #SUP  0.76  #QF  0.76
 26 SER  HN     29 ARG  QD      4.44            #peak   522 #SUP  0.37  #QF  0.37
 24 VAL  HN     25 ILE  HB      5.50            #peak   526 #SUP  0.59  #QF  0.59
 12 ASN  QB     14 TYR  HN      4.51            #peak   533 #SUP  0.86  #QF  0.86
 20 PRO  QG     21 ALA  HN      4.24            #peak   535 #SUP  0.87  #QF  0.87
 18 VAL  QG2    21 ALA  HN      4.80            #peak   537 #SUP  0.82  #QF  0.82
 20 PRO  QD     21 ALA  HN      3.71            #peak   538 #SUP  0.98  #QF  0.77
 19 GLY  HN     22 ASP  QB      5.50            #peak   540 #SUP  0.80  #QF  0.80
 26 SER  HN     28 VAL  HB      5.14            #peak   543 #SUP  0.56  #QF  0.56
 25 ILE  HN     26 SER  QB      5.50            #peak   544 #SUP  0.80  #QF  0.80
 33 HIS  HN     33 HIS  HB3     3.30            #peak   605 #SUP  0.95  #QF  0.95
 11 ARG  HN     12 ASN  HD21    5.50            #peak   632 #SUP  0.99  #QF  0.99
 30 GLY  HN     30 GLY  QA      2.59            #peak   660 #SUP  0.61  #QF  0.61
 31 PHE  HN     31 PHE  QD      3.65            #peak   662 #SUP  0.96  #QF  0.96
  2 PHE  HN      2 PHE  QD      3.83            #peak   663 #SUP  0.92  #QF  0.92
  3 HIS  HD2     4 ALA  HN      4.27            #peak   664 #SUP  0.93  #QF  0.93
 33 HIS  HN     33 HIS  HD2     3.94            #peak   667 #SUP  0.90  #QF  0.90
 31 PHE  QD     33 HIS  HN      5.50            #peak   668 #SUP  0.93  #QF  0.93
 31 PHE  QD     32 ILE  HN      3.74            #peak   669 #SUP  0.91  #QF  0.91
 32 ILE  HN     33 HIS  HD2     5.49            #peak   671 #SUP  0.51  #QF  0.51
 31 PHE  QD     34 GLY  HN      4.97            #peak   673 #SUP  0.60  #QF  0.60
 29 ARG  HN     31 PHE  QD      5.50            #peak   676 #SUP  0.80  #QF  0.80
  3 HIS  HD2     5 TYR  HN      5.04            #peak   681 #SUP  0.84  #QF  0.84
  2 PHE  HN      5 TYR  QD      5.20            #peak   683 #SUP  0.87  #QF  0.87
  3 HIS  HN      4 ALA  HA      4.59            #peak   692 #SUP  0.84  #QF  0.84
 28 VAL  HB     29 ARG  HN      3.49            #peak   702 #SUP  0.98  #QF  0.98
 26 SER  HN     27 ALA  HN      5.03            #peak   703 #SUP  0.80  #QF  0.80
 23 TRP  HE3    26 SER  HN      5.15            #peak   705 #SUP  0.93  #QF  0.93
 28 VAL  QG1    29 ARG  HN      3.33            #peak   724 #SUP  0.96  #QF  0.96
 28 VAL  QG2    29 ARG  HN      3.88            #peak   725 #SUP  0.99  #QF  0.99
 25 ILE  HA     29 ARG  HN      4.05            #peak   726 #SUP  0.75  #QF  0.75
 25 ILE  HB     26 SER  HN      3.65            #peak   727 #SUP  0.94  #QF  0.94
 24 VAL  HN     26 SER  HN      4.26            #peak   728 #SUP  0.87  #QF  0.87
 25 ILE  QG2    26 SER  HN      3.16            #peak   729 #SUP  0.82  #QF  0.82
 25 ILE  HN     25 ILE  QG2     3.53            #peak   731 #SUP  0.76  #QF  0.76
 24 VAL  HN     25 ILE  HN      5.31            #peak   734 #SUP  0.99  #QF  0.99
 28 VAL  HN     28 VAL  HB      3.28            #peak   735 #SUP  0.93  #QF  0.93
 23 TRP  HN     24 VAL  HB      4.47            #peak   737 #SUP  0.93  #QF  0.93
 22 ASP  HA     25 ILE  HN      3.99            #peak   739 #SUP  0.46  #QF  0.46
 25 ILE  HN     25 ILE  HB      2.79            #peak   740 #SUP  0.53  #QF  0.53
 27 ALA  HN     28 VAL  HN      3.37            #peak   745 #SUP  0.89  #QF  0.89
 27 ALA  HN     28 VAL  HA      5.07            #peak   750 #SUP  0.95  #QF  0.95
 25 ILE  HA     27 ALA  HN      4.55            #peak   751 #SUP  0.92  #QF  0.92
 24 VAL  QG1    27 ALA  HN      4.65            #peak   755 #SUP  0.71  #QF  0.71
 25 ILE  QG2    27 ALA  HN      4.30            #peak   756 #SUP  0.45  #QF  0.45
 17 ALA  QB     18 VAL  HN      3.43            #peak   758 #SUP  0.98  #QF  0.98
 19 GLY  HN     21 ALA  QB      4.45            #peak   759 #SUP  0.76  #QF  0.76
 21 ALA  HN     21 ALA  QB      3.01            #peak   760 #SUP  1.00
 20 PRO  QD     22 ASP  HN      4.31            #peak   763 #SUP  0.53  #QF  0.53
 18 VAL  QG1    21 ALA  HN      4.37            #peak   764 #SUP  0.78  #QF  0.78
 13 ASN  HN     14 TYR  HB2     5.50            #peak   771 #SUP  0.94  #QF  0.94
  2 PHE  HN      2 PHE  QB      3.21            #peak   699
  2 PHE  HN      3 HIS  QB      4.61            #peak   698
  3 HIS  HN      3 HIS  QB      3.11            #peak   701
  3 HIS  QB      4 ALA  HN      2.96            #peak   213
  6 SER  HN      6 SER  QB      3.34            #peak    22
  6 SER  QB      7 ALA  HN      3.92            #peak    59
  6 SER  QB      8 ARG  HN      3.66            #peak   742
  6 SER  QB      8 ARG  HE      5.34            #peak   462
 10 VAL  HA     13 ASN  QD2     4.17            #peak   639
 11 ARG  HN     11 ARG  QB      3.16            #peak   148
 11 ARG  QB     11 ARG  HE      5.34            #peak   472
 11 ARG  QB     12 ASN  HN      3.43            #peak   238
 11 ARG  QB     13 ASN  HN      5.30            #peak   250
 12 ASN  QB     13 ASN  QD2     3.53            #peak   202
 13 ASN  HN     13 ASN  QD2     3.61            #peak   242
 13 ASN  QD2    14 TYR  HN      5.21            #peak   408
 23 TRP  HN     23 TRP  QB      3.33            #peak   288
 33 HIS  HN     33 HIS  QB      2.81            #peak    34
   2 PHE   HN   HA       5.80    2.00
   3 HIS   HN   HA       6.30    2.00
   4 ALA   HN   HA       4.90    2.00
   5 TYR   HN   HA       6.30    2.00
   7 ALA   HN   HA       6.10    2.00
   8 ARG   HN   HA       3.60    2.00
  10 VAL   HN   HA       3.60    2.00
  11 ARG   HN   HA       5.10    2.00
  12 ASN   HN   HA       6.00    2.00
  15 LYS   HN   HA       3.20    2.00
  16 SER   HN   HA       4.10    2.00
  17 ALA   HN   HA       6.90    2.00
  18 VAL   HN   HA       5.60    2.00
  21 ALA   HN   HA       5.10    2.00
  22 ASP   HN   HA       4.00    2.00
  23 TRP   HN   HA       4.10    2.00
  24 VAL   HN   HA       6.00    2.00
  26 SER   HN   HA       3.60    2.00
  27 ALA   HN   HA       4.60    2.00
  29 ARG   HN   HA       3.30    2.00
  31 PHE   HN   HA       5.50    2.00
  32 ILE   HN   HA       5.80    2.00
  33 HIS   HN   HA       6.70    2.00
   4 ALA   PHI    -106.6   -39.3
   7 ALA   PHI     -71.7   -54.7
  10 VAL   PHI     -75.7   -50.7
  11 ARG   PHI     -77.5   -47.1
  12 ASN   PHI    -108.3   -41.4
  14 TYR   PHI     -80.5   -48.0
  15 LYS   PHI     -75.5   -50.4
  16 SER   PHI     -74.9   -51.8
  17 ALA   PHI     -77.7   -55.1
  18 VAL   PHI     -75.2   -55.0
  21 ALA   PHI     -74.9   -46.6
  22 ASP   PHI    -106.5   -33.2
  23 TRP   PHI     -71.9   -54.0
  24 VAL   PHI     -74.0   -56.9
  25 ILE   PHI     -74.3   -50.4
  26 SER   PHI     -69.7   -54.9
  27 ALA   PHI     -68.8   -56.3
  28 VAL   PHI     -68.8   -61.2
  29 ARG   PHI     -70.2   -51.9
  31 PHE   PHI     -77.8   -47.7
  32 ILE   PHI     -83.1   -44.7
  33 HIS   PHI    -128.0   -60.1
   4 ALA   PSI     -80.1    34.7
   7 ALA   PSI     -51.0   -34.4
  10 VAL   PSI     -52.7   -25.2
  11 ARG   PSI     -60.5   -31.1
  12 ASN   PSI     -86.0    24.8
  14 TYR   PSI     -51.6   -32.0
  15 LYS   PSI     -57.4    -5.8
  16 SER   PSI     -59.0   -18.2
  17 ALA   PSI     -58.2   -11.7
  18 VAL   PSI     -47.9   -28.2
  21 ALA   PSI     -63.0    -7.9
  22 ASP   PSI     -71.1     3.5
  23 TRP   PSI     -55.5   -35.5
  24 VAL   PSI     -58.2   -29.7
  25 ILE   PSI     -55.1   -27.6
  26 SER   PSI     -45.3   -36.6
  27 ALA   PSI     -57.0   -30.9
  28 VAL   PSI     -48.4   -35.6
  29 ARG   PSI     -57.9   -27.1
  31 PHE   PSI     -57.3   -27.2
  32 ILE   PSI     -57.3   -20.9
  33 HIS   PSI     -53.1    28.8

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   VAL   1           HN       VAL   1   1.884   0.000   0.829
    2    HA   VAL   1           HA       VAL   1   1.579  -0.693  -1.926
    3    HB   VAL   1           HB       VAL   1   2.781   2.009  -1.373
    4   HG11  VAL   1          1HG1      VAL   1   1.836   0.537  -3.845
    5   HG12  VAL   1          2HG1      VAL   1   2.172   2.285  -3.834
    6   HG13  VAL   1          3HG1      VAL   1   3.471   1.127  -3.463
    7   HG21  VAL   1          3HG2      VAL   1   0.367   2.545  -2.602
    8   HG22  VAL   1          1HG2      VAL   1  -0.065   1.287  -1.419
    9   HG23  VAL   1          2HG2      VAL   1   0.732   2.783  -0.876
   10    H    PHE   2           HN       PHE   2   3.828  -0.755  -2.996
   11    HA   PHE   2           HA       PHE   2   6.037  -0.750  -1.168
   12    HB2  PHE   2           2HB      PHE   2   6.467  -3.187  -1.461
   13    HB3  PHE   2           3HB      PHE   2   4.865  -2.970  -0.784
   14    HD1  PHE   2           HD2      PHE   2   2.964  -2.703  -2.678
   15    HD2  PHE   2           HD1      PHE   2   6.672  -4.706  -3.176
   16    HE1  PHE   2           HE2      PHE   2   1.986  -4.047  -4.559
   17    HE2  PHE   2           HE1      PHE   2   5.694  -6.049  -5.057
   18    HZ   PHE   2           HZ       PHE   2   3.362  -5.704  -5.726
   19    H    HIS   3           HN       HIS   3   5.829   0.906  -3.274
   20    HA   HIS   3           HA       HIS   3   8.023   0.244  -4.831
   21    HB2  HIS   3           2HB      HIS   3   6.983  -1.273  -6.178
   22    HB3  HIS   3           3HB      HIS   3   5.393  -0.574  -5.948
   23    HD1  HIS   3           HD1      HIS   3   7.896  -0.954  -8.474
   24    HD2  HIS   3           HD2      HIS   3   5.268   2.130  -7.390
   25    HE1  HIS   3           HE1      HIS   3   7.716   0.579 -10.505
   26    H    ALA   4           HN       ALA   4   4.917   2.010  -4.510
   27    HA   ALA   4           HA       ALA   4   5.690   4.215  -6.083
   28    HB1  ALA   4           1HB      ALA   4   3.349   3.586  -5.491
   29    HB2  ALA   4           2HB      ALA   4   3.679   4.045  -3.803
   30    HB3  ALA   4           3HB      ALA   4   3.728   5.277  -5.086
   31    H    TYR   5           HN       TYR   5   6.687   3.064  -2.976
   32    HA   TYR   5           HA       TYR   5   7.242   5.604  -1.813
   33    HB2  TYR   5           2HB      TYR   5   7.918   2.650  -1.416
   34    HB3  TYR   5           3HB      TYR   5   8.794   3.836  -0.467
   35    HD1  TYR   5           HD2      TYR   5   5.374   2.565  -1.222
   36    HD2  TYR   5           HD1      TYR   5   7.831   4.803   1.473
   37    HE1  TYR   5           HE2      TYR   5   3.479   2.621   0.472
   38    HE2  TYR   5           HE1      TYR   5   5.927   4.851   3.158
   39    HH   TYR   5           HH       TYR   5   3.613   4.641   3.262
   40    H    SER   6           HN       SER   6   9.702   5.831  -0.947
   41    HA   SER   6           HA       SER   6  11.533   5.177  -3.071
   42    HB2  SER   6           2HB      SER   6  10.976   8.043  -2.187
   43    HB3  SER   6           3HB      SER   6  12.351   7.571  -3.165
   44    HG   SER   6           HG       SER   6  10.704   8.274  -4.567
   45    H    ALA   7           HN       ALA   7  12.757   3.897  -1.639
   46    HA   ALA   7           HA       ALA   7  13.284   4.559   1.011
   47    HB1  ALA   7           1HB      ALA   7  13.627   2.322   0.438
   48    HB2  ALA   7           2HB      ALA   7  14.504   2.731  -1.056
   49    HB3  ALA   7           3HB      ALA   7  15.296   2.934   0.525
   50    H    ARG   8           HN       ARG   8  14.850   5.486  -2.064
   51    HA   ARG   8           HA       ARG   8  17.190   6.438  -0.921
   52    HB2  ARG   8           2HB      ARG   8  15.807   6.584  -3.538
   53    HB3  ARG   8           3HB      ARG   8  16.759   8.016  -3.204
   54    HG2  ARG   8           2HG      ARG   8  18.415   6.691  -4.146
   55    HG3  ARG   8           3HG      ARG   8  18.610   6.224  -2.469
   56    HD2  ARG   8           2HD      ARG   8  16.829   4.718  -4.445
   57    HD3  ARG   8           3HD      ARG   8  18.487   4.270  -4.097
   58    HE   ARG   8           HE       ARG   8  16.801   4.539  -1.704
   59   HH11  ARG   8          2HH2      ARG   8  17.967   2.328  -4.215
   60   HH12  ARG   8          1HH2      ARG   8  17.664   0.904  -3.277
   61   HH22  ARG   8          HH1       ARG   8  16.743   1.123  -1.075
   62    H    GLY   9           HN       GLY   9  13.950   7.562  -0.725
   63    HA2  GLY   9           1HA      GLY   9  14.780  10.350  -0.243
   64    HA3  GLY   9           2HA      GLY   9  13.157   9.796  -0.607
   65    H    VAL  10           HN       VAL  10  13.303   7.418   1.203
   66    HA   VAL  10           HA       VAL  10  12.365   8.680   3.535
   67    HB   VAL  10           HB       VAL  10  11.941   6.326   2.407
   68   HG11  VAL  10          1HG1      VAL  10  13.012   4.518   3.764
   69   HG12  VAL  10          2HG1      VAL  10  14.147   5.397   2.711
   70   HG13  VAL  10          3HG1      VAL  10  14.102   5.742   4.457
   71   HG21  VAL  10          3HG2      VAL  10  10.400   6.650   4.019
   72   HG22  VAL  10          1HG2      VAL  10  11.452   5.610   5.009
   73   HG23  VAL  10          2HG2      VAL  10  11.577   7.381   5.136
   74    H    ARG  11           HN       ARG  11  15.411   6.873   2.758
   75    HA   ARG  11           HA       ARG  11  16.462   7.194   5.309
   76    HB2  ARG  11           2HB      ARG  11  18.625   6.529   4.237
   77    HB3  ARG  11           3HB      ARG  11  17.306   5.491   3.733
   78    HG2  ARG  11           2HG      ARG  11  17.078   7.269   1.747
   79    HG3  ARG  11           3HG      ARG  11  18.742   7.634   2.157
   80    HD2  ARG  11           2HD      ARG  11  17.585   4.994   1.189
   81    HD3  ARG  11           3HD      ARG  11  18.883   5.933   0.477
   82    HE   ARG  11           HE       ARG  11  19.130   4.008   2.641
   83   HH11  ARG  11          2HH2      ARG  11  20.553   6.971   1.320
   84   HH12  ARG  11          1HH2      ARG  11  22.111   6.683   2.019
   85   HH22  ARG  11          HH1       ARG  11  22.460   4.711   3.335
   86    H    ASN  12           HN       ASN  12  16.686   9.108   2.264
   87    HA   ASN  12           HA       ASN  12  18.707  10.797   3.024
   88    HB2  ASN  12           2HB      ASN  12  16.452  10.840   1.058
   89    HB3  ASN  12           3HB      ASN  12  17.068  12.425   1.485
   90   HD21  ASN  12          1HD2      ASN  12  18.325   9.157   0.810
   91   HD22  ASN  12          2HD2      ASN  12  19.616   9.632  -0.243
   92    H    ASN  13           HN       ASN  13  15.380  10.497   4.096
   93    HA   ASN  13           HA       ASN  13  15.268  13.201   5.057
   94    HB2  ASN  13           2HB      ASN  13  13.371  10.845   4.930
   95    HB3  ASN  13           3HB      ASN  13  13.046  12.089   6.121
   96   HD21  ASN  13          1HD2      ASN  13  14.481  12.314   2.881
   97   HD22  ASN  13          2HD2      ASN  13  13.302  13.375   2.185
   98    H    TYR  14           HN       TYR  14  16.350  10.055   6.042
   99    HA   TYR  14           HA       TYR  14  15.828  10.385   8.849
  100    HB2  TYR  14           2HB      TYR  14  16.236   8.109   8.627
  101    HB3  TYR  14           3HB      TYR  14  16.552   8.371   6.923
  102    HD1  TYR  14           HD1      TYR  14  18.356   8.901  10.182
  103    HD2  TYR  14           HD2      TYR  14  18.561   7.544   6.130
  104    HE1  TYR  14           HE1      TYR  14  20.784   8.227  10.523
  105    HE2  TYR  14           HE2      TYR  14  20.988   6.875   6.484
  106    HH   TYR  14           HH       TYR  14  22.804   7.373   7.880
  107    H    LYS  15           HN       LYS  15  18.662  10.626   6.615
  108    HA   LYS  15           HA       LYS  15  20.589  11.022   8.567
  109    HB2  LYS  15           2HB      LYS  15  21.794  12.221   6.633
  110    HB3  LYS  15           3HB      LYS  15  21.386  10.529   6.440
  111    HG2  LYS  15           2HG      LYS  15  19.860  10.946   4.774
  112    HG3  LYS  15           3HG      LYS  15  19.229  12.376   5.567
  113    HD2  LYS  15           2HD      LYS  15  22.022  12.618   4.522
  114    HD3  LYS  15           3HD      LYS  15  20.777  12.441   3.302
  115    HE2  LYS  15           2HE      LYS  15  19.815  14.495   3.774
  116    HE3  LYS  15           3HE      LYS  15  20.154  14.384   5.490
  117    HZ1  LYS  15           2HZ      LYS  15  21.700  15.945   4.854
  118    HZ3  LYS  15           1HZ      LYS  15  21.906  15.350   3.352
  119    H    SER  16           HN       SER  16  17.930  13.020   7.582
  120    HA   SER  16           HA       SER  16  19.143  15.483   8.216
  121    HB2  SER  16           2HB      SER  16  17.323  15.942   6.911
  122    HB3  SER  16           3HB      SER  16  16.472  14.493   7.411
  123    HG   SER  16           HG       SER  16  15.246  15.916   8.470
  124    H    ALA  17           HN       ALA  17  16.811  13.269   9.906
  125    HA   ALA  17           HA       ALA  17  16.626  14.825  12.233
  126    HB1  ALA  17           1HB      ALA  17  15.146  12.885  11.318
  127    HB2  ALA  17           2HB      ALA  17  16.308  11.819  12.143
  128    HB3  ALA  17           3HB      ALA  17  15.381  13.018  13.077
  129    H    VAL  18           HN       VAL  18  19.222  13.018  10.897
  130    HA   VAL  18           HA       VAL  18  20.351  12.178  13.390
  131    HB   VAL  18           HB       VAL  18  21.132  12.160  10.503
  132   HG11  VAL  18          1HG1      VAL  18  23.281  12.573  11.049
  133   HG12  VAL  18          2HG1      VAL  18  23.005  12.274  12.782
  134   HG13  VAL  18          3HG1      VAL  18  23.265  10.906  11.673
  135   HG21  VAL  18          3HG2      VAL  18  20.205  10.136  10.762
  136   HG22  VAL  18          1HG2      VAL  18  21.675   9.698  11.665
  137   HG23  VAL  18          2HG2      VAL  18  20.230  10.262  12.538
  138    H    GLY  19           HN       GLY  19  20.450  15.029  11.274
  139    HA2  GLY  19           1HA      GLY  19  22.815  16.217  12.075
  140    HA3  GLY  19           2HA      GLY  19  21.366  17.060  11.564
  141    HA   PRO  20           HA       PRO  20  20.469  18.166  15.678
  142    HB2  PRO  20           2HB      PRO  20  17.847  17.560  16.157
  143    HB3  PRO  20           3HB      PRO  20  18.354  18.953  15.221
  144    HG2  PRO  20           2HG      PRO  20  17.199  16.403  14.271
  145    HG3  PRO  20           3HG      PRO  20  17.313  17.936  13.431
  146    HD2  PRO  20           2HD      PRO  20  18.961  15.625  13.016
  147    HD3  PRO  20           3HD      PRO  20  19.148  17.195  12.260
  148    H    ALA  21           HN       ALA  21  19.828  14.857  14.991
  149    HA   ALA  21           HA       ALA  21  19.343  13.915  17.529
  150    HB1  ALA  21           1HB      ALA  21  20.347  11.785  16.621
  151    HB2  ALA  21           2HB      ALA  21  19.121  12.524  15.563
  152    HB3  ALA  21           3HB      ALA  21  20.851  12.702  15.181
  153    H    ASP  22           HN       ASP  22  22.267  15.280  16.128
  154    HA   ASP  22           HA       ASP  22  24.061  14.052  17.888
  155    HB2  ASP  22           2HB      ASP  22  24.290  15.594  15.640
  156    HB3  ASP  22           3HB      ASP  22  24.641  16.807  16.854
  157    HD2  ASP  22           HD2      ASP  22  25.811  13.580  15.902
  158    H    TRP  23           HN       TRP  23  22.004  16.984  17.924
  159    HA   TRP  23           HA       TRP  23  23.259  18.188  20.171
  160    HB2  TRP  23           2HB      TRP  23  21.739  19.865  19.925
  161    HB3  TRP  23           3HB      TRP  23  21.779  19.218  18.297
  162    HD1  TRP  23           HD1      TRP  23  19.405  18.797  17.298
  163    HE1  TRP  23           HE1      TRP  23  16.938  18.405  18.149
  164    HE3  TRP  23           HE3      TRP  23  20.567  18.717  22.248
  165    HZ2  TRP  23           HZ2      TRP  23  15.776  18.112  20.739
  166    HZ3  TRP  23           HZ3      TRP  23  18.707  18.373  23.872
  167    HH2  TRP  23           HH2      TRP  23  16.379  18.077  23.187
  168    H    VAL  24           HN       VAL  24  20.228  16.258  19.620
  169    HA   VAL  24           HA       VAL  24  19.395  16.209  22.260
  170    HB   VAL  24           HB       VAL  24  18.582  15.202  19.802
  171   HG11  VAL  24          1HG1      VAL  24  19.069  12.926  21.749
  172   HG12  VAL  24          2HG1      VAL  24  17.974  12.828  20.349
  173   HG13  VAL  24          3HG1      VAL  24  19.715  13.103  20.100
  174   HG21  VAL  24          3HG2      VAL  24  16.714  14.237  21.598
  175   HG22  VAL  24          1HG2      VAL  24  17.510  15.541  22.512
  176   HG23  VAL  24          2HG2      VAL  24  16.767  15.887  20.931
  177    H    ILE  25           HN       ILE  25  21.461  13.854  20.426
  178    HA   ILE  25           HA       ILE  25  21.885  12.193  22.653
  179    HB   ILE  25           HB       ILE  25  22.221  11.896  20.047
  180   HG12  ILE  25          2HG1      ILE  25  24.093  10.095  20.942
  181   HG13  ILE  25          3HG1      ILE  25  23.252  10.495  22.426
  182   HG21  ILE  25          1HG2      ILE  25  24.138  13.586  20.118
  183   HG22  ILE  25          2HG2      ILE  25  25.087  12.297  20.898
  184   HG23  ILE  25          3HG2      ILE  25  24.426  12.051  19.263
  185   HD11  ILE  25          3HD1      ILE  25  21.986   8.702  21.528
  186   HD12  ILE  25          1HD1      ILE  25  21.056  10.144  21.056
  187   HD13  ILE  25          2HD1      ILE  25  22.104   9.333  19.868
  188    H    SER  26           HN       SER  26  23.431  15.167  21.448
  189    HA   SER  26           HA       SER  26  25.746  14.907  22.987
  190    HB2  SER  26           2HB      SER  26  25.882  16.441  21.198
  191    HB3  SER  26           3HB      SER  26  24.345  17.188  21.583
  192    HG   SER  26           HG       SER  26  25.544  18.675  22.553
  193    H    ALA  27           HN       ALA  27  22.480  16.263  23.571
  194    HA   ALA  27           HA       ALA  27  23.166  17.559  25.997
  195    HB1  ALA  27           1HB      ALA  27  20.378  16.615  25.453
  196    HB2  ALA  27           2HB      ALA  27  20.960  18.208  25.993
  197    HB3  ALA  27           3HB      ALA  27  21.104  17.742  24.282
  198    H    VAL  28           HN       VAL  28  22.198  14.269  25.038
  199    HA   VAL  28           HA       VAL  28  21.503  13.416  27.644
  200    HB   VAL  28           HB       VAL  28  22.344  11.915  25.157
  201   HG11  VAL  28          1HG1      VAL  28  20.663  10.562  27.184
  202   HG12  VAL  28          2HG1      VAL  28  21.997   9.933  26.187
  203   HG13  VAL  28          3HG1      VAL  28  22.350  10.858  27.666
  204   HG21  VAL  28          3HG2      VAL  28  20.313  12.388  24.372
  205   HG22  VAL  28          1HG2      VAL  28  19.583  11.595  25.788
  206   HG23  VAL  28          2HG2      VAL  28  19.952  13.335  25.836
  207    H    ARG  29           HN       ARG  29  24.479  13.029  25.598
  208    HA   ARG  29           HA       ARG  29  25.868  11.760  27.670
  209    HB2  ARG  29           2HB      ARG  29  27.870  12.124  26.191
  210    HB3  ARG  29           3HB      ARG  29  26.513  11.436  25.321
  211    HG2  ARG  29           2HG      ARG  29  25.961  14.070  24.927
  212    HG3  ARG  29           3HG      ARG  29  27.698  14.190  25.126
  213    HD2  ARG  29           2HD      ARG  29  26.127  12.954  22.912
  214    HD3  ARG  29           3HD      ARG  29  27.694  13.736  22.862
  215    HE   ARG  29           HE       ARG  29  27.171  10.882  23.430
  216   HH11  ARG  29          2HH2      ARG  29  29.548  13.509  23.394
  217   HH12  ARG  29          1HH2      ARG  29  30.912  12.441  23.388
  218   HH22  ARG  29          HH1       ARG  29  30.549  10.072  23.405
  219    H    GLY  30           HN       GLY  30  25.238  15.114  26.774
  220    HA2  GLY  30           1HA      GLY  30  27.467  16.292  28.108
  221    HA3  GLY  30           2HA      GLY  30  26.012  17.090  27.547
  222    H    PHE  31           HN       PHE  31  24.103  15.381  29.010
  223    HA   PHE  31           HA       PHE  31  24.269  16.745  31.519
  224    HB2  PHE  31           2HB      PHE  31  22.032  16.525  30.868
  225    HB3  PHE  31           3HB      PHE  31  22.382  15.141  29.851
  226    HD1  PHE  31           HD2      PHE  31  21.544  16.213  33.264
  227    HD2  PHE  31           HD1      PHE  31  22.144  12.898  30.683
  228    HE1  PHE  31           HE2      PHE  31  20.493  14.697  34.966
  229    HE2  PHE  31           HE1      PHE  31  21.093  11.382  32.385
  230    HZ   PHE  31           HZ       PHE  31  20.280  12.300  34.507
  231    H    ILE  32           HN       ILE  32  24.999  13.517  30.250
  232    HA   ILE  32           HA       ILE  32  24.805  12.051  32.593
  233    HB   ILE  32           HB       ILE  32  25.357  11.501  30.033
  234   HG12  ILE  32          2HG1      ILE  32  26.426   9.490  31.935
  235   HG13  ILE  32          3HG1      ILE  32  24.811  10.078  32.278
  236   HG21  ILE  32          1HG2      ILE  32  28.023  10.991  31.353
  237   HG22  ILE  32          2HG2      ILE  32  27.577  10.838  29.636
  238   HG23  ILE  32          3HG2      ILE  32  27.700  12.449  30.384
  239   HD11  ILE  32          3HD1      ILE  32  25.763   8.899  29.627
  240   HD12  ILE  32          1HD1      ILE  32  24.679   8.118  30.803
  241   HD13  ILE  32          2HD1      ILE  32  24.137   9.562  29.915
  242    H    HIS  33           HN       HIS  33  27.441  14.138  31.308
  243    HA   HIS  33           HA       HIS  33  29.127  13.472  33.532
  244    HB2  HIS  33           2HB      HIS  33  30.740  14.915  32.500
  245    HB3  HIS  33           3HB      HIS  33  30.022  13.895  31.268
  246    HD1  HIS  33           HD1      HIS  33  29.912  17.480  32.550
  247    HD2  HIS  33           HD2      HIS  33  28.787  15.246  29.182
  248    HE1  HIS  33           HE1      HIS  33  29.188  19.170  30.780
  249    H    GLY  34           HN       GLY  34  26.473  15.566  32.938
  250    HA2  GLY  34           1HA      GLY  34  27.114  17.893  34.290
  251    HA3  GLY  34           2HA      GLY  34  25.516  17.182  34.171
  Start of MODEL    2
    1    H1   VAL   1           HN       VAL   1   1.024  -2.463  -2.926
    2    HA   VAL   1           HA       VAL   1   0.915  -0.452  -4.334
    3    HB   VAL   1           HB       VAL   1   2.176   1.482  -3.680
    4   HG11  VAL   1          1HG1      VAL   1  -0.023   1.697  -2.930
    5   HG12  VAL   1          2HG1      VAL   1   0.171   0.442  -1.683
    6   HG13  VAL   1          3HG1      VAL   1   0.930   2.037  -1.466
    7   HG21  VAL   1          3HG2      VAL   1   4.008   1.016  -2.431
    8   HG22  VAL   1          1HG2      VAL   1   2.907   1.345  -1.072
    9   HG23  VAL   1          2HG2      VAL   1   3.220  -0.333  -1.578
   10    H    PHE   2           HN       PHE   2   3.315   0.591  -5.182
   11    HA   PHE   2           HA       PHE   2   5.453  -1.232  -4.925
   12    HB2  PHE   2           2HB      PHE   2   5.269  -2.276  -7.142
   13    HB3  PHE   2           3HB      PHE   2   3.722  -2.505  -6.349
   14    HD1  PHE   2           HD2      PHE   2   1.788  -1.055  -6.990
   15    HD2  PHE   2           HD1      PHE   2   5.447  -1.000  -9.140
   16    HE1  PHE   2           HE2      PHE   2   0.631   0.037  -8.932
   17    HE2  PHE   2           HE1      PHE   2   4.290   0.092 -11.081
   18    HZ   PHE   2           HZ       PHE   2   1.896   0.598 -10.954
   19    H    HIS   3           HN       HIS   3   5.080   1.605  -4.693
   20    HA   HIS   3           HA       HIS   3   7.212   2.488  -6.227
   21    HB2  HIS   3           2HB      HIS   3   6.104   2.639  -8.214
   22    HB3  HIS   3           3HB      HIS   3   4.534   2.850  -7.465
   23    HD1  HIS   3           HD1      HIS   3   6.673   4.664  -9.544
   24    HD2  HIS   3           HD2      HIS   3   4.685   5.641  -5.981
   25    HE1  HIS   3           HE1      HIS   3   6.530   7.211  -9.480
   26    H    ALA   4           HN       ALA   4   4.147   3.242  -4.521
   27    HA   ALA   4           HA       ALA   4   4.611   5.831  -3.788
   28    HB1  ALA   4           1HB      ALA   4   2.530   5.045  -3.170
   29    HB2  ALA   4           2HB      ALA   4   3.168   3.483  -2.603
   30    HB3  ALA   4           3HB      ALA   4   3.364   4.940  -1.601
   31    H    TYR   5           HN       TYR   5   5.834   2.791  -2.257
   32    HA   TYR   5           HA       TYR   5   7.182   4.153  -0.171
   33    HB2  TYR   5           2HB      TYR   5   7.906   1.892   0.307
   34    HB3  TYR   5           3HB      TYR   5   6.364   1.659  -0.493
   35    HD1  TYR   5           HD2      TYR   5  10.033   1.827  -1.231
   36    HD2  TYR   5           HD1      TYR   5   6.221   0.235  -2.343
   37    HE1  TYR   5           HE2      TYR   5  11.151   0.344  -2.967
   38    HE2  TYR   5           HE1      TYR   5   7.352  -1.243  -4.076
   39    HH   TYR   5           HH       TYR   5  10.831  -1.498  -4.231
   40    H    SER   6           HN       SER   6   9.476   4.440   0.131
   41    HA   SER   6           HA       SER   6  11.187   3.976  -2.089
   42    HB2  SER   6           2HB      SER   6  10.413   6.819  -1.318
   43    HB3  SER   6           3HB      SER   6  11.881   6.451  -2.202
   44    HG   SER   6           HG       SER   6  10.554   5.453  -3.872
   45    H    ALA   7           HN       ALA   7  12.530   2.814  -0.663
   46    HA   ALA   7           HA       ALA   7  13.125   3.605   1.938
   47    HB1  ALA   7           1HB      ALA   7  13.628   1.393   1.553
   48    HB2  ALA   7           2HB      ALA   7  14.224   1.702  -0.096
   49    HB3  ALA   7           3HB      ALA   7  15.248   2.087   1.308
   50    H    ARG   8           HN       ARG   8  14.522   4.481  -1.231
   51    HA   ARG   8           HA       ARG   8  16.856   5.587  -0.226
   52    HB2  ARG   8           2HB      ARG   8  15.374   5.542  -2.783
   53    HB3  ARG   8           3HB      ARG   8  16.226   7.055  -2.548
   54    HG2  ARG   8           2HG      ARG   8  17.946   5.824  -3.498
   55    HG3  ARG   8           3HG      ARG   8  18.232   5.430  -1.814
   56    HD2  ARG   8           2HD      ARG   8  16.508   3.733  -3.683
   57    HD3  ARG   8           3HD      ARG   8  18.202   3.416  -3.366
   58    HE   ARG   8           HE       ARG   8  16.515   3.642  -0.956
   59   HH11  ARG   8          2HH2      ARG   8  17.942   1.460  -3.355
   60   HH12  ARG   8          1HH2      ARG   8  17.803   0.059  -2.346
   61   HH22  ARG   8          HH1       ARG   8  16.853   0.279  -0.157
   62    H    GLY   9           HN       GLY   9  13.575   6.564   0.066
   63    HA2  GLY   9           1HA      GLY   9  14.290   9.404   0.416
   64    HA3  GLY   9           2HA      GLY   9  12.683   8.763   0.135
   65    H    VAL  10           HN       VAL  10  13.012   6.462   2.020
   66    HA   VAL  10           HA       VAL  10  12.101   7.762   4.341
   67    HB   VAL  10           HB       VAL  10  11.749   5.351   3.314
   68   HG11  VAL  10          1HG1      VAL  10  12.957   3.646   4.688
   69   HG12  VAL  10          2HG1      VAL  10  14.007   4.538   3.561
   70   HG13  VAL  10          3HG1      VAL  10  14.013   4.945   5.294
   71   HG21  VAL  10          3HG2      VAL  10  10.259   5.559   4.973
   72   HG22  VAL  10          1HG2      VAL  10  11.461   4.760   6.014
   73   HG23  VAL  10          2HG2      VAL  10  11.372   6.537   5.959
   74    H    ARG  11           HN       ARG  11  15.200   6.073   3.510
   75    HA   ARG  11           HA       ARG  11  16.328   6.541   6.005
   76    HB2  ARG  11           2HB      ARG  11  18.478   5.929   4.877
   77    HB3  ARG  11           3HB      ARG  11  17.191   4.814   4.465
   78    HG2  ARG  11           2HG      ARG  11  16.808   6.496   2.422
   79    HG3  ARG  11           3HG      ARG  11  18.466   6.955   2.752
   80    HD2  ARG  11           2HD      ARG  11  17.385   4.311   1.783
   81    HD3  ARG  11           3HD      ARG  11  18.780   5.208   1.217
   82    HE   ARG  11           HE       ARG  11  18.755   3.230   3.333
   83   HH11  ARG  11          2HH2      ARG  11  20.354   6.228   2.328
   84   HH12  ARG  11          1HH2      ARG  11  21.811   5.890   3.203
   85   HH22  ARG  11          HH1       ARG  11  21.978   3.860   4.465
   86    H    ASN  12           HN       ASN  12  16.350   8.337   2.882
   87    HA   ASN  12           HA       ASN  12  18.318  10.145   3.495
   88    HB2  ASN  12           2HB      ASN  12  16.001   9.996   1.614
   89    HB3  ASN  12           3HB      ASN  12  16.532  11.629   1.964
   90   HD21  ASN  12          1HD2      ASN  12  17.925   8.413   1.311
   91   HD22  ASN  12          2HD2      ASN  12  19.164   8.929   0.215
   92    H    ASN  13           HN       ASN  13  15.051   9.741   4.708
   93    HA   ASN  13           HA       ASN  13  14.851  12.473   5.567
   94    HB2  ASN  13           2HB      ASN  13  13.061  10.024   5.663
   95    HB3  ASN  13           3HB      ASN  13  12.713  11.360   6.743
   96   HD21  ASN  13          1HD2      ASN  13  14.149  11.524   3.519
   97   HD22  ASN  13          2HD2      ASN  13  12.874  12.401   2.741
   98    H    TYR  14           HN       TYR  14  16.108   9.419   6.631
   99    HA   TYR  14           HA       TYR  14  15.682   9.842   9.442
  100    HB2  TYR  14           2HB      TYR  14  16.181   7.578   9.295
  101    HB3  TYR  14           3HB      TYR  14  16.415   7.782   7.571
  102    HD1  TYR  14           HD1      TYR  14  18.326   8.521  10.726
  103    HD2  TYR  14           HD2      TYR  14  18.425   7.010   6.725
  104    HE1  TYR  14           HE1      TYR  14  20.793   7.966  10.990
  105    HE2  TYR  14           HE2      TYR  14  20.892   6.459   7.002
  106    HH   TYR  14           HH       TYR  14  22.477   6.078   8.623
  107    H    LYS  15           HN       LYS  15  18.414  10.108   7.088
  108    HA   LYS  15           HA       LYS  15  20.396  10.666   8.944
  109    HB2  LYS  15           2HB      LYS  15  21.472  11.833   6.916
  110    HB3  LYS  15           3HB      LYS  15  21.131  10.118   6.808
  111    HG2  LYS  15           2HG      LYS  15  19.589  10.407   5.145
  112    HG3  LYS  15           3HG      LYS  15  18.834  11.765   5.956
  113    HD2  LYS  15           2HD      LYS  15  21.564  12.241   4.793
  114    HD3  LYS  15           3HD      LYS  15  20.250  12.030   3.652
  115    HE2  LYS  15           2HE      LYS  15  19.137  13.970   4.346
  116    HE3  LYS  15           3HE      LYS  15  19.773  13.886   5.977
  117    HZ1  LYS  15           2HZ      LYS  15  20.756  15.490   4.024
  118    HZ3  LYS  15           1HZ      LYS  15  21.826  14.263   3.991
  119    H    SER  16           HN       SER  16  17.617  12.508   7.985
  120    HA   SER  16           HA       SER  16  18.745  15.044   8.471
  121    HB2  SER  16           2HB      SER  16  16.311  14.009   7.453
  122    HB3  SER  16           3HB      SER  16  15.852  14.923   8.876
  123    HG   SER  16           HG       SER  16  15.968  16.165   6.817
  124    H    ALA  17           HN       ALA  17  16.576  12.808  10.340
  125    HA   ALA  17           HA       ALA  17  16.412  14.450  12.608
  126    HB1  ALA  17           1HB      ALA  17  14.825  12.639  12.070
  127    HB2  ALA  17           2HB      ALA  17  16.115  11.434  12.301
  128    HB3  ALA  17           3HB      ALA  17  15.543  12.401  13.682
  129    H    VAL  18           HN       VAL  18  19.031  12.697  11.245
  130    HA   VAL  18           HA       VAL  18  20.289  12.010  13.723
  131    HB   VAL  18           HB       VAL  18  20.960  11.904  10.810
  132   HG11  VAL  18          1HG1      VAL  18  23.188  10.789  11.944
  133   HG12  VAL  18          2HG1      VAL  18  23.108  12.428  11.255
  134   HG13  VAL  18          3HG1      VAL  18  22.911  12.189  13.007
  135   HG21  VAL  18          3HG2      VAL  18  20.217  10.056  12.953
  136   HG22  VAL  18          1HG2      VAL  18  20.132   9.856  11.186
  137   HG23  VAL  18          2HG2      VAL  18  21.652   9.516  12.047
  138    H    GLY  19           HN       GLY  19  20.185  14.772  11.492
  139    HA2  GLY  19           1HA      GLY  19  22.525  16.089  12.150
  140    HA3  GLY  19           2HA      GLY  19  21.023  16.849  11.664
  141    HA   PRO  20           HA       PRO  20  20.235  18.087  15.762
  142    HB2  PRO  20           2HB      PRO  20  17.662  17.395  16.368
  143    HB3  PRO  20           3HB      PRO  20  18.073  18.767  15.358
  144    HG2  PRO  20           2HG      PRO  20  16.994  16.134  14.558
  145    HG3  PRO  20           3HG      PRO  20  17.010  17.634  13.653
  146    HD2  PRO  20           2HD      PRO  20  18.738  15.378  13.266
  147    HD3  PRO  20           3HD      PRO  20  18.829  16.921  12.441
  148    H    ALA  21           HN       ALA  21  19.712  14.730  15.234
  149    HA   ALA  21           HA       ALA  21  19.364  13.874  17.825
  150    HB1  ALA  21           1HB      ALA  21  19.128  12.395  15.926
  151    HB2  ALA  21           2HB      ALA  21  20.833  12.628  15.469
  152    HB3  ALA  21           3HB      ALA  21  20.423  11.752  16.964
  153    H    ASP  22           HN       ASP  22  22.172  15.300  16.256
  154    HA   ASP  22           HA       ASP  22  24.082  14.221  17.992
  155    HB2  ASP  22           2HB      ASP  22  24.159  15.677  15.676
  156    HB3  ASP  22           3HB      ASP  22  24.503  16.953  16.827
  157    HD2  ASP  22           HD2      ASP  22  26.339  13.682  16.139
  158    H    TRP  23           HN       TRP  23  21.904  17.065  17.992
  159    HA   TRP  23           HA       TRP  23  23.189  18.412  20.137
  160    HB2  TRP  23           2HB      TRP  23  21.591  20.014  19.885
  161    HB3  TRP  23           3HB      TRP  23  21.597  19.301  18.284
  162    HD1  TRP  23           HD1      TRP  23  19.208  18.742  17.396
  163    HE1  TRP  23           HE1      TRP  23  16.794  18.284  18.359
  164    HE3  TRP  23           HE3      TRP  23  20.557  18.915  22.296
  165    HZ2  TRP  23           HZ2      TRP  23  15.743  18.051  21.002
  166    HZ3  TRP  23           HZ3      TRP  23  18.776  18.563  24.004
  167    HH2  TRP  23           HH2      TRP  23  16.439  18.142  23.424
  168    H    VAL  24           HN       VAL  24  20.226  16.338  19.784
  169    HA   VAL  24           HA       VAL  24  19.495  16.364  22.454
  170    HB   VAL  24           HB       VAL  24  18.635  15.224  20.073
  171   HG11  VAL  24          1HG1      VAL  24  19.291  13.052  22.088
  172   HG12  VAL  24          2HG1      VAL  24  18.150  12.851  20.737
  173   HG13  VAL  24          3HG1      VAL  24  19.867  13.187  20.409
  174   HG21  VAL  24          3HG2      VAL  24  16.831  15.870  21.239
  175   HG22  VAL  24          1HG2      VAL  24  16.884  14.255  21.987
  176   HG23  VAL  24          2HG2      VAL  24  17.651  15.639  22.802
  177    H    ILE  25           HN       ILE  25  21.590  14.023  20.636
  178    HA   ILE  25           HA       ILE  25  22.169  12.475  22.909
  179    HB   ILE  25           HB       ILE  25  22.418  12.082  20.306
  180   HG12  ILE  25          2HG1      ILE  25  24.390  10.393  21.185
  181   HG13  ILE  25          3HG1      ILE  25  23.614  10.829  22.695
  182   HG21  ILE  25          1HG2      ILE  25  24.582  12.298  19.429
  183   HG22  ILE  25          2HG2      ILE  25  24.264  13.852  20.235
  184   HG23  ILE  25          3HG2      ILE  25  25.295  12.635  21.024
  185   HD11  ILE  25          3HD1      ILE  25  21.383  10.396  21.224
  186   HD12  ILE  25          1HD1      ILE  25  22.505   9.326  20.349
  187   HD13  ILE  25          2HD1      ILE  25  22.222   9.086  22.090
  188    H    SER  26           HN       SER  26  23.538  15.457  21.526
  189    HA   SER  26           HA       SER  26  25.919  15.357  22.981
  190    HB2  SER  26           2HB      SER  26  25.924  16.820  21.130
  191    HB3  SER  26           3HB      SER  26  24.370  17.516  21.542
  192    HG   SER  26           HG       SER  26  26.929  17.996  22.778
  193    H    ALA  27           HN       ALA  27  22.623  16.600  23.639
  194    HA   ALA  27           HA       ALA  27  23.343  18.023  25.983
  195    HB1  ALA  27           1HB      ALA  27  21.142  18.629  25.980
  196    HB2  ALA  27           2HB      ALA  27  21.186  17.972  24.326
  197    HB3  ALA  27           3HB      ALA  27  20.577  16.971  25.666
  198    H    VAL  28           HN       VAL  28  22.482  14.659  25.196
  199    HA   VAL  28           HA       VAL  28  21.923  13.888  27.859
  200    HB   VAL  28           HB       VAL  28  22.733  12.321  25.403
  201   HG11  VAL  28          1HG1      VAL  28  22.510  10.370  26.524
  202   HG12  VAL  28          2HG1      VAL  28  22.881  11.370  27.949
  203   HG13  VAL  28          3HG1      VAL  28  21.190  10.985  27.548
  204   HG21  VAL  28          3HG2      VAL  28  20.456  13.767  25.747
  205   HG22  VAL  28          1HG2      VAL  28  20.563  12.285  24.767
  206   HG23  VAL  28          2HG2      VAL  28  19.961  12.204  26.440
  207    H    ARG  29           HN       ARG  29  24.833  13.539  25.714
  208    HA   ARG  29           HA       ARG  29  26.353  12.415  27.779
  209    HB2  ARG  29           2HB      ARG  29  28.280  12.801  26.208
  210    HB3  ARG  29           3HB      ARG  29  26.923  12.021  25.420
  211    HG2  ARG  29           2HG      ARG  29  26.243  14.611  24.944
  212    HG3  ARG  29           3HG      ARG  29  27.980  14.811  25.068
  213    HD2  ARG  29           2HD      ARG  29  26.381  13.419  22.970
  214    HD3  ARG  29           3HD      ARG  29  27.909  14.264  22.827
  215    HE   ARG  29           HE       ARG  29  27.531  11.416  23.529
  216   HH11  ARG  29          2HH2      ARG  29  29.790  14.136  23.293
  217   HH12  ARG  29          1HH2      ARG  29  31.198  13.126  23.276
  218   HH22  ARG  29          HH1       ARG  29  30.937  10.747  23.402
  219    H    GLY  30           HN       GLY  30  25.547  15.700  26.775
  220    HA2  GLY  30           1HA      GLY  30  27.772  17.024  27.971
  221    HA3  GLY  30           2HA      GLY  30  26.263  17.737  27.436
  222    H    PHE  31           HN       PHE  31  24.487  16.013  29.041
  223    HA   PHE  31           HA       PHE  31  24.689  17.486  31.485
  224    HB2  PHE  31           2HB      PHE  31  22.440  17.147  30.932
  225    HB3  PHE  31           3HB      PHE  31  22.810  15.737  29.958
  226    HD1  PHE  31           HD2      PHE  31  22.056  16.915  33.356
  227    HD2  PHE  31           HD1      PHE  31  22.701  13.524  30.889
  228    HE1  PHE  31           HE2      PHE  31  21.136  15.430  35.158
  229    HE2  PHE  31           HE1      PHE  31  21.782  12.038  32.691
  230    HZ   PHE  31           HZ       PHE  31  21.010  13.009  34.804
  231    H    ILE  32           HN       ILE  32  25.508  14.241  30.318
  232    HA   ILE  32           HA       ILE  32  25.466  12.868  32.724
  233    HB   ILE  32           HB       ILE  32  25.944  12.235  30.168
  234   HG12  ILE  32          2HG1      ILE  32  27.169  10.351  32.107
  235   HG13  ILE  32          3HG1      ILE  32  25.544  10.885  32.488
  236   HG21  ILE  32          1HG2      ILE  32  28.255  13.292  30.388
  237   HG22  ILE  32          2HG2      ILE  32  28.678  11.891  31.402
  238   HG23  ILE  32          3HG2      ILE  32  28.174  11.648  29.712
  239   HD11  ILE  32          3HD1      ILE  32  25.518   8.836  31.083
  240   HD12  ILE  32          1HD1      ILE  32  24.763  10.206  30.233
  241   HD13  ILE  32          2HD1      ILE  32  26.416   9.699  29.811
  242    H    HIS  33           HN       HIS  33  27.959  15.006  31.253
  243    HA   HIS  33           HA       HIS  33  29.755  14.505  33.434
  244    HB2  HIS  33           2HB      HIS  33  31.264  15.968  32.282
  245    HB3  HIS  33           3HB      HIS  33  30.545  14.870  31.122
  246    HD1  HIS  33           HD1      HIS  33  30.330  18.497  32.262
  247    HD2  HIS  33           HD2      HIS  33  29.175  16.080  29.034
  248    HE1  HIS  33           HE1      HIS  33  29.469  20.080  30.455
  249    H    GLY  34           HN       GLY  34  26.993  16.461  32.861
  250    HA2  GLY  34           1HA      GLY  34  27.860  18.618  34.627
  251    HA3  GLY  34           2HA      GLY  34  26.364  18.514  33.721
  Start of MODEL    3
    1    H1   VAL   1           HN       VAL   1   6.113  -0.492  -1.221
    2    HA   VAL   1           HA       VAL   1   4.342   0.676  -0.214
    3    HB   VAL   1           HB       VAL   1   6.807   1.779   1.120
    4   HG11  VAL   1          1HG1      VAL   1   4.035   0.993   1.973
    5   HG12  VAL   1          2HG1      VAL   1   5.374   0.894   3.141
    6   HG13  VAL   1          3HG1      VAL   1   4.980   2.449   2.370
    7   HG21  VAL   1          3HG2      VAL   1   6.000  -1.074   0.729
    8   HG22  VAL   1          1HG2      VAL   1   7.620  -0.347   0.852
    9   HG23  VAL   1          2HG2      VAL   1   6.641  -0.594   2.319
   10    H    PHE   2           HN       PHE   2   3.781   2.928   0.878
   11    HA   PHE   2           HA       PHE   2   3.958   4.833  -1.281
   12    HB2  PHE   2           2HB      PHE   2   2.411   4.344   1.276
   13    HB3  PHE   2           3HB      PHE   2   2.521   6.014   0.756
   14    HD1  PHE   2           HD2      PHE   2   2.537   3.526  -1.866
   15    HD2  PHE   2           HD1      PHE   2   0.037   5.948   0.561
   16    HE1  PHE   2           HE2      PHE   2   0.633   3.156  -3.459
   17    HE2  PHE   2           HE1      PHE   2  -1.867   5.578  -1.031
   18    HZ   PHE   2           HZ       PHE   2  -1.547   4.186  -3.022
   19    H    HIS   3           HN       HIS   3   6.254   4.069   0.752
   20    HA   HIS   3           HA       HIS   3   7.439   6.573   0.772
   21    HB2  HIS   3           2HB      HIS   3   6.109   7.438   2.440
   22    HB3  HIS   3           3HB      HIS   3   5.874   5.888   3.224
   23    HD1  HIS   3           HD1      HIS   3   7.640   8.991   3.651
   24    HD2  HIS   3           HD2      HIS   3   8.481   4.971   4.504
   25    HE1  HIS   3           HE1      HIS   3   9.507   9.004   5.390
   26    H    ALA   4           HN       ALA   4   7.063   3.351   2.304
   27    HA   ALA   4           HA       ALA   4   9.722   3.150   3.201
   28    HB1  ALA   4           1HB      ALA   4   8.746   1.382   4.179
   29    HB2  ALA   4           2HB      ALA   4   7.305   1.585   3.154
   30    HB3  ALA   4           3HB      ALA   4   8.659   0.573   2.596
   31    H    TYR   5           HN       TYR   5   8.174   2.864   0.054
   32    HA   TYR   5           HA       TYR   5  10.051   1.185  -1.181
   33    HB2  TYR   5           2HB      TYR   5   8.831   1.904  -3.134
   34    HB3  TYR   5           3HB      TYR   5   7.663   2.140  -1.850
   35    HD1  TYR   5           HD1      TYR   5   8.587   4.662  -0.608
   36    HD2  TYR   5           HD2      TYR   5   8.357   3.543  -4.731
   37    HE1  TYR   5           HE1      TYR   5   8.363   7.107  -1.267
   38    HE2  TYR   5           HE2      TYR   5   8.134   5.992  -5.376
   39    HH   TYR   5           HH       TYR   5   7.683   8.459  -2.954
   40    H    SER   6           HN       SER   6  11.143   2.326  -3.355
   41    HA   SER   6           HA       SER   6  13.070   3.236  -3.886
   42    HB2  SER   6           2HB      SER   6  11.614   5.681  -2.785
   43    HB3  SER   6           3HB      SER   6  13.034   5.764  -3.808
   44    HG   SER   6           HG       SER   6  11.879   5.188  -5.558
   45    H    ALA   7           HN       ALA   7  14.613   2.265  -2.482
   46    HA   ALA   7           HA       ALA   7  14.977   2.973   0.183
   47    HB1  ALA   7           1HB      ALA   7  17.385   2.037  -0.430
   48    HB2  ALA   7           2HB      ALA   7  15.966   0.963  -0.413
   49    HB3  ALA   7           3HB      ALA   7  16.582   1.599  -1.957
   50    H    ARG   8           HN       ARG   8  16.151   4.403  -2.872
   51    HA   ARG   8           HA       ARG   8  18.145   5.950  -1.736
   52    HB2  ARG   8           2HB      ARG   8  16.687   5.798  -4.313
   53    HB3  ARG   8           3HB      ARG   8  17.215   7.425  -3.933
   54    HG2  ARG   8           2HG      ARG   8  19.144   6.659  -4.966
   55    HG3  ARG   8           3HG      ARG   8  19.514   6.182  -3.320
   56    HD2  ARG   8           2HD      ARG   8  18.160   4.346  -5.355
   57    HD3  ARG   8           3HD      ARG   8  19.885   4.351  -5.044
   58    HE   ARG   8           HE       ARG   8  18.207   4.016  -2.644
   59   HH11  ARG   8          2HH2      ARG   8  20.006   2.382  -5.222
   60   HH12  ARG   8          1HH2      ARG   8  20.152   0.894  -4.347
   61   HH22  ARG   8          HH1       ARG   8  19.200   0.724  -2.154
   62    H    GLY   9           HN       GLY   9  14.728   6.089  -1.421
   63    HA2  GLY   9           1HA      GLY   9  14.747   8.977  -0.821
   64    HA3  GLY   9           2HA      GLY   9  13.338   8.003  -1.192
   65    H    VAL  10           HN       VAL  10  14.247   5.689   0.504
   66    HA   VAL  10           HA       VAL  10  13.040   6.537   2.910
   67    HB   VAL  10           HB       VAL  10  13.241   4.210   1.669
   68   HG11  VAL  10          1HG1      VAL  10  15.542   4.151   3.647
   69   HG12  VAL  10          2HG1      VAL  10  14.807   2.707   2.912
   70   HG13  VAL  10          3HG1      VAL  10  15.625   3.910   1.886
   71   HG21  VAL  10          3HG2      VAL  10  13.160   4.452   4.696
   72   HG22  VAL  10          1HG2      VAL  10  11.788   4.734   3.597
   73   HG23  VAL  10          2HG2      VAL  10  12.508   3.111   3.723
   74    H    ARG  11           HN       ARG  11  16.439   5.673   1.989
   75    HA   ARG  11           HA       ARG  11  17.439   6.157   4.535
   76    HB2  ARG  11           2HB      ARG  11  19.668   6.155   3.394
   77    HB3  ARG  11           3HB      ARG  11  18.667   4.819   2.860
   78    HG2  ARG  11           2HG      ARG  11  17.904   6.552   0.971
   79    HG3  ARG  11           3HG      ARG  11  19.417   7.341   1.370
   80    HD2  ARG  11           2HD      ARG  11  18.957   4.623   0.145
   81    HD3  ARG  11           3HD      ARG  11  20.114   5.857  -0.310
   82    HE   ARG  11           HE       ARG  11  20.453   3.822   1.794
   83   HH11  ARG  11          2HH2      ARG  11  21.654   6.864   0.433
   84   HH12  ARG  11          1HH2      ARG  11  23.223   6.710   1.151
   85   HH22  ARG  11          HH1       ARG  11  23.711   4.793   2.504
   86    H    ASN  12           HN       ASN  12  17.041   8.189   1.586
   87    HA   ASN  12           HA       ASN  12  18.547  10.332   2.394
   88    HB2  ASN  12           2HB      ASN  12  16.297   9.849   0.479
   89    HB3  ASN  12           3HB      ASN  12  16.491  11.521   0.966
   90   HD21  ASN  12          1HD2      ASN  12  18.541   8.729   0.116
   91   HD22  ASN  12          2HD2      ASN  12  19.624   9.568  -0.944
   92    H    ASN  13           HN       ASN  13  15.462   9.087   3.508
   93    HA   ASN  13           HA       ASN  13  14.648  11.613   4.605
   94    HB2  ASN  13           2HB      ASN  13  13.461   8.839   4.380
   95    HB3  ASN  13           3HB      ASN  13  12.852   9.877   5.654
   96   HD21  ASN  13          1HD2      ASN  13  14.062  10.702   2.422
   97   HD22  ASN  13          2HD2      ASN  13  12.609  11.423   1.814
   98    H    TYR  14           HN       TYR  14  16.573   8.841   5.412
   99    HA   TYR  14           HA       TYR  14  16.069   8.896   8.241
  100    HB2  TYR  14           2HB      TYR  14  17.073   6.828   7.899
  101    HB3  TYR  14           3HB      TYR  14  17.251   7.239   6.205
  102    HD1  TYR  14           HD2      TYR  14  18.947   8.101   9.451
  103    HD2  TYR  14           HD1      TYR  14  19.383   7.027   5.333
  104    HE1  TYR  14           HE2      TYR  14  21.476   8.102   9.711
  105    HE2  TYR  14           HE1      TYR  14  21.910   7.031   5.607
  106    HH   TYR  14           HH       TYR  14  23.499   6.651   7.643
  107    H    LYS  15           HN       LYS  15  18.662   9.993   5.972
  108    HA   LYS  15           HA       LYS  15  20.468  10.816   7.907
  109    HB2  LYS  15           2HB      LYS  15  21.244  12.378   6.013
  110    HB3  LYS  15           3HB      LYS  15  21.304  10.647   5.746
  111    HG2  LYS  15           2HG      LYS  15  19.708  10.716   4.105
  112    HG3  LYS  15           3HG      LYS  15  18.695  11.831   5.001
  113    HD2  LYS  15           2HD      LYS  15  21.200  13.094   4.077
  114    HD3  LYS  15           3HD      LYS  15  20.250  12.456   2.749
  115    HE2  LYS  15           2HE      LYS  15  18.729  13.974   4.842
  116    HE3  LYS  15           3HE      LYS  15  19.821  14.919   3.850
  117    HZ1  LYS  15           2HZ      LYS  15  18.559  13.366   2.020
  118    HZ3  LYS  15           1HZ      LYS  15  18.118  14.891   2.382
  119    H    SER  16           HN       SER  16  17.338  12.055   7.065
  120    HA   SER  16           HA       SER  16  17.857  14.727   7.796
  121    HB2  SER  16           2HB      SER  16  15.116  13.447   7.925
  122    HB3  SER  16           3HB      SER  16  15.537  15.083   7.460
  123    HG   SER  16           HG       SER  16  14.956  13.660   5.643
  124    H    ALA  17           HN       ALA  17  16.257  11.895   9.416
  125    HA   ALA  17           HA       ALA  17  15.730  13.245  11.818
  126    HB1  ALA  17           1HB      ALA  17  15.665  10.767  12.651
  127    HB2  ALA  17           2HB      ALA  17  14.485  11.295  11.428
  128    HB3  ALA  17           3HB      ALA  17  15.917  10.359  10.937
  129    H    VAL  18           HN       VAL  18  18.675  12.262  10.353
  130    HA   VAL  18           HA       VAL  18  20.061  11.653  12.783
  131    HB   VAL  18           HB       VAL  18  20.733  11.968   9.886
  132   HG11  VAL  18          1HG1      VAL  18  22.706  12.923  10.417
  133   HG12  VAL  18          2HG1      VAL  18  22.573  12.484  12.137
  134   HG13  VAL  18          3HG1      VAL  18  23.158  11.288  10.956
  135   HG21  VAL  18          3HG2      VAL  18  20.427   9.813  11.837
  136   HG22  VAL  18          1HG2      VAL  18  20.398   9.760  10.058
  137   HG23  VAL  18          2HG2      VAL  18  21.951   9.696  10.925
  138    H    GLY  19           HN       GLY  19  19.330  14.511  10.805
  139    HA2  GLY  19           1HA      GLY  19  21.311  16.258  11.624
  140    HA3  GLY  19           2HA      GLY  19  19.675  16.700  11.179
  141    HA   PRO  20           HA       PRO  20  18.634  17.348  15.356
  142    HB2  PRO  20           2HB      PRO  20  16.286  16.039  15.849
  143    HB3  PRO  20           3HB      PRO  20  16.373  17.555  14.973
  144    HG2  PRO  20           2HG      PRO  20  15.918  14.830  13.920
  145    HG3  PRO  20           3HG      PRO  20  15.592  16.372  13.154
  146    HD2  PRO  20           2HD      PRO  20  17.787  14.610  12.600
  147    HD3  PRO  20           3HD      PRO  20  17.523  16.203  11.918
  148    H    ALA  21           HN       ALA  21  18.885  14.022  14.520
  149    HA   ALA  21           HA       ALA  21  18.746  12.877  17.017
  150    HB1  ALA  21           1HB      ALA  21  20.257  11.137  15.990
  151    HB2  ALA  21           2HB      ALA  21  18.848  11.563  14.989
  152    HB3  ALA  21           3HB      ALA  21  20.454  12.216  14.588
  153    H    ASP  22           HN       ASP  22  21.153  15.038  15.635
  154    HA   ASP  22           HA       ASP  22  23.262  14.265  17.303
  155    HB2  ASP  22           2HB      ASP  22  23.001  15.907  15.129
  156    HB3  ASP  22           3HB      ASP  22  23.051  17.116  16.396
  157    HD2  ASP  22           HD2      ASP  22  25.277  16.427  17.957
  158    H    TRP  23           HN       TRP  23  20.495  16.531  17.516
  159    HA   TRP  23           HA       TRP  23  21.445  17.932  19.797
  160    HB2  TRP  23           2HB      TRP  23  19.525  19.147  19.659
  161    HB3  TRP  23           3HB      TRP  23  19.690  18.603  18.001
  162    HD1  TRP  23           HD1      TRP  23  17.488  17.601  17.022
  163    HE1  TRP  23           HE1      TRP  23  15.243  16.523  17.894
  164    HE3  TRP  23           HE3      TRP  23  18.772  17.627  21.942
  165    HZ2  TRP  23           HZ2      TRP  23  14.277  15.818  20.486
  166    HZ3  TRP  23           HZ3      TRP  23  17.121  16.727  23.578
  167    HH2  TRP  23           HH2      TRP  23  14.939  15.843  22.919
  168    H    VAL  24           HN       VAL  24  19.030  15.282  19.204
  169    HA   VAL  24           HA       VAL  24  18.317  14.899  21.852
  170    HB   VAL  24           HB       VAL  24  17.733  13.815  19.362
  171   HG11  VAL  24          1HG1      VAL  24  19.396  12.088  19.538
  172   HG12  VAL  24          2HG1      VAL  24  18.870  11.674  21.188
  173   HG13  VAL  24          3HG1      VAL  24  17.801  11.344  19.803
  174   HG21  VAL  24          3HG2      VAL  24  16.242  12.308  21.132
  175   HG22  VAL  24          1HG2      VAL  24  16.691  13.728  22.106
  176   HG23  VAL  24          2HG2      VAL  24  15.838  13.944  20.559
  177    H    ILE  25           HN       ILE  25  20.885  13.268  19.872
  178    HA   ILE  25           HA       ILE  25  21.805  11.689  22.007
  179    HB   ILE  25           HB       ILE  25  22.131  11.603  19.385
  180   HG12  ILE  25          2HG1      ILE  25  24.391  10.286  20.068
  181   HG13  ILE  25          3HG1      ILE  25  23.680  10.476  21.658
  182   HG21  ILE  25          1HG2      ILE  25  23.527  13.744  19.510
  183   HG22  ILE  25          2HG2      ILE  25  24.810  12.723  20.202
  184   HG23  ILE  25          3HG2      ILE  25  24.186  12.384  18.570
  185   HD11  ILE  25          3HD1      ILE  25  22.149   9.380  19.257
  186   HD12  ILE  25          1HD1      ILE  25  22.978   8.360  20.458
  187   HD13  ILE  25          2HD1      ILE  25  21.615   9.391  20.956
  188    H    SER  26           HN       SER  26  22.459  15.018  20.923
  189    HA   SER  26           HA       SER  26  24.803  15.327  22.408
  190    HB2  SER  26           2HB      SER  26  24.467  16.913  20.692
  191    HB3  SER  26           3HB      SER  26  22.799  17.205  21.144
  192    HG   SER  26           HG       SER  26  24.685  18.806  21.750
  193    H    ALA  27           HN       ALA  27  21.312  15.727  23.112
  194    HA   ALA  27           HA       ALA  27  21.696  17.056  25.587
  195    HB1  ALA  27           1HB      ALA  27  19.623  16.911  23.993
  196    HB2  ALA  27           2HB      ALA  27  19.273  15.401  24.867
  197    HB3  ALA  27           3HB      ALA  27  19.361  16.941  25.754
  198    H    VAL  28           HN       VAL  28  21.618  13.670  24.486
  199    HA   VAL  28           HA       VAL  28  21.254  12.552  27.058
  200    HB   VAL  28           HB       VAL  28  22.394  11.440  24.487
  201   HG11  VAL  28          1HG1      VAL  28  21.198   9.599  26.473
  202   HG12  VAL  28          2HG1      VAL  28  22.623   9.396  25.425
  203   HG13  VAL  28          3HG1      VAL  28  22.757  10.318  26.941
  204   HG21  VAL  28          3HG2      VAL  28  19.871  12.308  24.852
  205   HG22  VAL  28          1HG2      VAL  28  20.281  10.908  23.833
  206   HG23  VAL  28          2HG2      VAL  28  19.706  10.658  25.499
  207    H    ARG  29           HN       ARG  29  24.163  13.068  24.946
  208    HA   ARG  29           HA       ARG  29  25.902  12.133  26.930
  209    HB2  ARG  29           2HB      ARG  29  27.689  13.086  25.436
  210    HB3  ARG  29           3HB      ARG  29  26.542  12.095  24.557
  211    HG2  ARG  29           2HG      ARG  29  25.292  14.497  24.301
  212    HG3  ARG  29           3HG      ARG  29  26.938  15.072  24.476
  213    HD2  ARG  29           2HD      ARG  29  25.692  13.553  22.232
  214    HD3  ARG  29           3HD      ARG  29  26.990  14.731  22.194
  215    HE   ARG  29           HE       ARG  29  27.269  11.819  22.631
  216   HH11  ARG  29          2HH2      ARG  29  28.851  14.989  22.682
  217   HH12  ARG  29          1HH2      ARG  29  30.451  14.330  22.602
  218   HH22  ARG  29          HH1       ARG  29  30.737  11.952  22.510
  219    H    GLY  30           HN       GLY  30  24.370  15.228  26.210
  220    HA2  GLY  30           1HA      GLY  30  26.239  16.905  27.561
  221    HA3  GLY  30           2HA      GLY  30  24.607  17.305  27.064
  222    H    PHE  31           HN       PHE  31  23.271  15.084  28.474
  223    HA   PHE  31           HA       PHE  31  23.137  16.335  31.043
  224    HB2  PHE  31           2HB      PHE  31  21.024  15.547  30.419
  225    HB3  PHE  31           3HB      PHE  31  21.702  14.353  29.331
  226    HD1  PHE  31           HD1      PHE  31  20.707  15.015  32.805
  227    HD2  PHE  31           HD2      PHE  31  22.100  12.097  30.057
  228    HE1  PHE  31           HE1      PHE  31  20.151  13.201  34.449
  229    HE2  PHE  31           HE2      PHE  31  21.545  10.283  31.701
  230    HZ   PHE  31           HZ       PHE  31  20.578  10.857  33.878
  231    H    ILE  32           HN       ILE  32  24.670  13.480  29.607
  232    HA   ILE  32           HA       ILE  32  24.945  11.918  31.878
  233    HB   ILE  32           HB       ILE  32  25.550  11.646  29.286
  234   HG12  ILE  32          2HG1      ILE  32  27.175   9.920  31.071
  235   HG13  ILE  32          3HG1      ILE  32  25.472  10.035  31.468
  236   HG21  ILE  32          1HG2      ILE  32  28.293  11.819  30.535
  237   HG22  ILE  32          2HG2      ILE  32  27.854  11.625  28.821
  238   HG23  ILE  32          3HG2      ILE  32  27.561  13.175  29.644
  239   HD11  ILE  32          3HD1      ILE  32  24.876   9.430  29.121
  240   HD12  ILE  32          1HD1      ILE  32  26.607   9.299  28.730
  241   HD13  ILE  32          2HD1      ILE  32  25.870   8.173  29.894
  242    H    HIS  33           HN       HIS  33  26.885  14.691  30.654
  243    HA   HIS  33           HA       HIS  33  28.751  14.411  32.815
  244    HB2  HIS  33           2HB      HIS  33  29.887  16.277  31.828
  245    HB3  HIS  33           3HB      HIS  33  29.434  15.155  30.560
  246    HD1  HIS  33           HD1      HIS  33  28.404  18.521  32.015
  247    HD2  HIS  33           HD2      HIS  33  27.821  16.209  28.563
  248    HE1  HIS  33           HE1      HIS  33  27.202  20.026  30.341
  249    H    GLY  34           HN       GLY  34  25.616  15.736  32.366
  250    HA2  GLY  34           1HA      GLY  34  25.307  16.615  34.959
  251    HA3  GLY  34           2HA      GLY  34  25.837  18.021  34.056
  Start of MODEL    4
    1    H1   VAL   1           HN       VAL   1   8.588  -1.211   4.411
    2    HA   VAL   1           HA       VAL   1   8.054   1.558   4.506
    3    HB   VAL   1           HB       VAL   1   9.447   2.425   2.870
    4   HG11  VAL   1          1HG1      VAL   1  11.273   0.459   4.289
    5   HG12  VAL   1          2HG1      VAL   1  11.696   2.061   3.639
    6   HG13  VAL   1          3HG1      VAL   1  10.607   1.929   5.040
    7   HG21  VAL   1          3HG2      VAL   1  10.200  -0.421   2.127
    8   HG22  VAL   1          1HG2      VAL   1   9.222   0.719   1.172
    9   HG23  VAL   1          2HG2      VAL   1  10.952   1.040   1.441
   10    H    PHE   2           HN       PHE   2   6.346   2.051   3.118
   11    HA   PHE   2           HA       PHE   2   5.770   0.411   0.872
   12    HB2  PHE   2           2HB      PHE   2   3.712  -0.591   1.803
   13    HB3  PHE   2           3HB      PHE   2   5.032  -0.992   2.885
   14    HD1  PHE   2           HD2      PHE   2   5.307   0.334   5.012
   15    HD2  PHE   2           HD1      PHE   2   1.857   0.662   2.562
   16    HE1  PHE   2           HE2      PHE   2   4.039   1.337   6.931
   17    HE2  PHE   2           HE1      PHE   2   0.589   1.665   4.482
   18    HZ   PHE   2           HZ       PHE   2   1.695   1.991   6.644
   19    H    HIS   3           HN       HIS   3   6.231   3.162   1.121
   20    HA   HIS   3           HA       HIS   3   3.976   4.194  -0.113
   21    HB2  HIS   3           2HB      HIS   3   2.686   4.412   1.753
   22    HB3  HIS   3           3HB      HIS   3   4.057   4.522   2.840
   23    HD1  HIS   3           HD1      HIS   3   1.416   6.543   1.527
   24    HD2  HIS   3           HD2      HIS   3   5.461   7.216   2.409
   25    HE1  HIS   3           HE1      HIS   3   1.688   9.070   1.746
   26    H    ALA   4           HN       ALA   4   6.893   4.755   1.898
   27    HA   ALA   4           HA       ALA   4   7.427   7.325   0.849
   28    HB1  ALA   4           1HB      ALA   4   8.309   5.886   2.967
   29    HB2  ALA   4           2HB      ALA   4   9.654   5.602   1.836
   30    HB3  ALA   4           3HB      ALA   4   9.206   7.265   2.288
   31    H    TYR   5           HN       TYR   5   8.329   3.964  -0.056
   32    HA   TYR   5           HA       TYR   5   9.429   3.144  -1.805
   33    HB2  TYR   5           2HB      TYR   5   7.746   5.487  -2.742
   34    HB3  TYR   5           3HB      TYR   5   8.871   4.838  -3.920
   35    HD1  TYR   5           HD1      TYR   5   6.880   3.009  -1.331
   36    HD2  TYR   5           HD2      TYR   5   7.514   3.758  -5.495
   37    HE1  TYR   5           HE1      TYR   5   5.215   1.180  -1.921
   38    HE2  TYR   5           HE2      TYR   5   5.847   1.926  -6.071
   39    HH   TYR   5           HH       TYR   5   3.669   0.757  -3.999
   40    H    SER   6           HN       SER   6  10.835   3.940  -3.941
   41    HA   SER   6           HA       SER   6  12.884   4.535  -4.423
   42    HB2  SER   6           2HB      SER   6  11.918   7.237  -3.384
   43    HB3  SER   6           3HB      SER   6  13.280   6.998  -4.461
   44    HG   SER   6           HG       SER   6  11.955   6.574  -6.144
   45    H    ALA   7           HN       ALA   7  14.230   3.373  -2.986
   46    HA   ALA   7           HA       ALA   7  14.583   3.994  -0.300
   47    HB1  ALA   7           1HB      ALA   7  16.867   2.744  -0.842
   48    HB2  ALA   7           2HB      ALA   7  15.314   1.875  -0.886
   49    HB3  ALA   7           3HB      ALA   7  16.064   2.434  -2.400
   50    H    ARG   8           HN       ARG   8  16.086   5.273  -3.282
   51    HA   ARG   8           HA       ARG   8  18.207   6.531  -2.012
   52    HB2  ARG   8           2HB      ARG   8  16.903   6.580  -4.680
   53    HB3  ARG   8           3HB      ARG   8  17.654   8.106  -4.256
   54    HG2  ARG   8           2HG      ARG   8  19.494   7.036  -5.183
   55    HG3  ARG   8           3HG      ARG   8  19.692   6.534  -3.515
   56    HD2  ARG   8           2HD      ARG   8  18.177   4.890  -5.599
   57    HD3  ARG   8           3HD      ARG   8  19.870   4.647  -5.220
   58    HE   ARG   8           HE       ARG   8  18.085   4.599  -2.879
   59   HH11  ARG   8          2HH2      ARG   8  19.673   2.671  -5.392
   60   HH12  ARG   8          1HH2      ARG   8  19.555   1.189  -4.504
   61   HH22  ARG   8          HH1       ARG   8  18.526   1.196  -2.340
   62    H    GLY   9           HN       GLY   9  14.814   7.155  -1.985
   63    HA2  GLY   9           1HA      GLY   9  15.183  10.011  -1.370
   64    HA3  GLY   9           2HA      GLY   9  13.683   9.223  -1.815
   65    H    VAL  10           HN       VAL  10  14.169   6.839  -0.052
   66    HA   VAL  10           HA       VAL  10  12.963   7.886   2.276
   67    HB   VAL  10           HB       VAL  10  12.888   5.539   1.060
   68   HG11  VAL  10          1HG1      VAL  10  14.145   3.839   2.397
   69   HG12  VAL  10          2HG1      VAL  10  15.187   4.896   1.413
   70   HG13  VAL  10          3HG1      VAL  10  15.043   5.170   3.166
   71   HG21  VAL  10          3HG2      VAL  10  11.702   6.547   3.222
   72   HG22  VAL  10          1HG2      VAL  10  11.564   4.826   2.789
   73   HG23  VAL  10          2HG2      VAL  10  12.723   5.339   4.039
   74    H    ARG  11           HN       ARG  11  16.243   6.524   1.548
   75    HA   ARG  11           HA       ARG  11  17.172   6.867   4.137
   76    HB2  ARG  11           2HB      ARG  11  19.435   6.570   3.108
   77    HB3  ARG  11           3HB      ARG  11  18.291   5.386   2.507
   78    HG2  ARG  11           2HG      ARG  11  17.867   7.221   0.606
   79    HG3  ARG  11           3HG      ARG  11  19.452   7.792   1.090
   80    HD2  ARG  11           2HD      ARG  11  18.707   5.067  -0.038
   81    HD3  ARG  11           3HD      ARG  11  19.864   6.219  -0.673
   82    HE   ARG  11           HE       ARG  11  20.831   5.604   1.875
   83   HH11  ARG  11          2HH2      ARG  11  20.044   3.731  -1.028
   84   HH12  ARG  11          1HH2      ARG  11  21.215   2.497  -0.700
   85   HH22  ARG  11          HH1       ARG  11  22.574   2.662   1.267
   86    H    ASN  12           HN       ASN  12  17.201   8.955   1.200
   87    HA   ASN  12           HA       ASN  12  18.941  10.868   2.110
   88    HB2  ASN  12           2HB      ASN  12  16.750  10.703   0.078
   89    HB3  ASN  12           3HB      ASN  12  17.132  12.331   0.601
   90   HD21  ASN  12          1HD2      ASN  12  18.856   9.307  -0.175
   91   HD22  ASN  12          2HD2      ASN  12  20.089  10.007  -1.170
   92    H    ASN  13           HN       ASN  13  15.664  10.045   3.055
   93    HA   ASN  13           HA       ASN  13  15.145  12.650   4.145
   94    HB2  ASN  13           2HB      ASN  13  13.606  10.064   3.830
   95    HB3  ASN  13           3HB      ASN  13  13.079  11.172   5.081
   96   HD21  ASN  13          1HD2      ASN  13  14.524  11.765   1.889
   97   HD22  ASN  13          2HD2      ASN  13  13.227  12.701   1.226
   98    H    TYR  14           HN       TYR  14  16.636   9.639   5.008
   99    HA   TYR  14           HA       TYR  14  16.002   9.740   7.809
  100    HB2  TYR  14           2HB      TYR  14  16.734   7.559   7.486
  101    HB3  TYR  14           3HB      TYR  14  17.053   7.955   5.810
  102    HD1  TYR  14           HD1      TYR  14  18.680   8.555   9.148
  103    HD2  TYR  14           HD2      TYR  14  19.179   7.463   5.042
  104    HE1  TYR  14           HE1      TYR  14  21.169   8.212   9.535
  105    HE2  TYR  14           HE2      TYR  14  21.666   7.124   5.442
  106    HH   TYR  14           HH       TYR  14  23.344   8.292   7.438
  107    H    LYS  15           HN       LYS  15  18.829  10.496   5.685
  108    HA   LYS  15           HA       LYS  15  20.630  11.053   7.717
  109    HB2  LYS  15           2HB      LYS  15  21.701  12.512   5.886
  110    HB3  LYS  15           3HB      LYS  15  21.543  10.792   5.596
  111    HG2  LYS  15           2HG      LYS  15  20.110  11.105   3.848
  112    HG3  LYS  15           3HG      LYS  15  19.136  12.256   4.742
  113    HD2  LYS  15           2HD      LYS  15  21.862  13.041   3.645
  114    HD3  LYS  15           3HD      LYS  15  20.435  13.099   2.630
  115    HE2  LYS  15           2HE      LYS  15  19.479  14.866   3.817
  116    HE3  LYS  15           3HE      LYS  15  20.217  14.394   5.335
  117    HZ1  LYS  15           2HZ      LYS  15  21.241  16.408   4.388
  118    HZ3  LYS  15           1HZ      LYS  15  21.712  15.589   3.061
  119    H    SER  16           HN       SER  16  17.740  12.708   6.744
  120    HA   SER  16           HA       SER  16  18.574  15.280   7.538
  121    HB2  SER  16           2HB      SER  16  16.308  14.108   6.282
  122    HB3  SER  16           3HB      SER  16  15.693  14.865   7.738
  123    HG   SER  16           HG       SER  16  15.872  16.746   6.751
  124    H    ALA  17           HN       ALA  17  16.535  12.674   9.041
  125    HA   ALA  17           HA       ALA  17  16.077  14.063  11.435
  126    HB1  ALA  17           1HB      ALA  17  16.191  11.055  11.266
  127    HB2  ALA  17           2HB      ALA  17  15.019  12.099  12.108
  128    HB3  ALA  17           3HB      ALA  17  14.958  11.941  10.336
  129    H    VAL  18           HN       VAL  18  18.932  12.707  10.096
  130    HA   VAL  18           HA       VAL  18  20.106  11.899  12.578
  131    HB   VAL  18           HB       VAL  18  20.953  12.145   9.721
  132   HG11  VAL  18          1HG1      VAL  18  23.008  12.823  10.356
  133   HG12  VAL  18          2HG1      VAL  18  22.735  12.394  12.061
  134   HG13  VAL  18          3HG1      VAL  18  23.212  11.138  10.893
  135   HG21  VAL  18          3HG2      VAL  18  20.272  10.034  11.626
  136   HG22  VAL  18          1HG2      VAL  18  20.318  10.000   9.847
  137   HG23  VAL  18          2HG2      VAL  18  21.807   9.723  10.780
  138    H    GLY  19           HN       GLY  19  19.860  14.845  10.609
  139    HA2  GLY  19           1HA      GLY  19  22.013  16.305  11.544
  140    HA3  GLY  19           2HA      GLY  19  20.473  16.965  11.030
  141    HA   PRO  20           HA       PRO  20  19.329  17.713  15.163
  142    HB2  PRO  20           2HB      PRO  20  16.807  16.725  15.528
  143    HB3  PRO  20           3HB      PRO  20  17.137  18.222  14.679
  144    HG2  PRO  20           2HG      PRO  20  16.375  15.592  13.567
  145    HG3  PRO  20           3HG      PRO  20  16.293  17.169  12.809
  146    HD2  PRO  20           2HD      PRO  20  18.258  15.135  12.332
  147    HD3  PRO  20           3HD      PRO  20  18.242  16.754  11.661
  148    H    ALA  21           HN       ALA  21  19.174  14.389  14.293
  149    HA   ALA  21           HA       ALA  21  18.764  13.253  16.764
  150    HB1  ALA  21           1HB      ALA  21  20.485  12.389  14.407
  151    HB2  ALA  21           2HB      ALA  21  20.078  11.335  15.783
  152    HB3  ALA  21           3HB      ALA  21  18.788  11.954  14.724
  153    H    ASP  22           HN       ASP  22  21.501  15.086  15.527
  154    HA   ASP  22           HA       ASP  22  23.407  14.024  17.279
  155    HB2  ASP  22           2HB      ASP  22  23.470  15.705  15.120
  156    HB3  ASP  22           3HB      ASP  22  23.617  16.887  16.406
  157    HD2  ASP  22           HD2      ASP  22  25.917  13.781  16.269
  158    H    TRP  23           HN       TRP  23  20.960  16.639  17.397
  159    HA   TRP  23           HA       TRP  23  21.977  17.878  19.743
  160    HB2  TRP  23           2HB      TRP  23  20.243  19.340  19.535
  161    HB3  TRP  23           3HB      TRP  23  20.417  18.797  17.878
  162    HD1  TRP  23           HD1      TRP  23  18.154  18.108  16.777
  163    HE1  TRP  23           HE1      TRP  23  15.744  17.331  17.521
  164    HE3  TRP  23           HE3      TRP  23  19.181  17.912  21.753
  165    HZ2  TRP  23           HZ2      TRP  23  14.565  16.736  20.050
  166    HZ3  TRP  23           HZ3      TRP  23  17.345  17.224  23.292
  167    HH2  TRP  23           HH2      TRP  23  15.101  16.647  22.513
  168    H    VAL  24           HN       VAL  24  19.262  15.580  18.994
  169    HA   VAL  24           HA       VAL  24  18.375  15.271  21.599
  170    HB   VAL  24           HB       VAL  24  17.776  14.298  19.068
  171   HG11  VAL  24          1HG1      VAL  24  19.186  12.364  19.296
  172   HG12  VAL  24          2HG1      VAL  24  18.528  12.007  20.911
  173   HG13  VAL  24          3HG1      VAL  24  17.496  11.836  19.471
  174   HG21  VAL  24          3HG2      VAL  24  16.595  14.354  21.746
  175   HG22  VAL  24          1HG2      VAL  24  15.847  14.641  20.157
  176   HG23  VAL  24          2HG2      VAL  24  16.027  12.979  20.768
  177    H    ILE  25           HN       ILE  25  20.801  13.332  19.720
  178    HA   ILE  25           HA       ILE  25  21.395  11.625  21.871
  179    HB   ILE  25           HB       ILE  25  21.840  11.522  19.267
  180   HG12  ILE  25          2HG1      ILE  25  23.755   9.838  19.898
  181   HG13  ILE  25          3HG1      ILE  25  23.297  10.215  21.547
  182   HG21  ILE  25          1HG2      ILE  25  24.598  12.272  20.232
  183   HG22  ILE  25          2HG2      ILE  25  24.018  12.032  18.566
  184   HG23  ILE  25          3HG2      ILE  25  23.496  13.459  19.493
  185   HD11  ILE  25          3HD1      ILE  25  22.093   8.219  20.465
  186   HD12  ILE  25          1HD1      ILE  25  21.045   9.444  21.220
  187   HD13  ILE  25          2HD1      ILE  25  21.241   9.408  19.451
  188    H    SER  26           HN       SER  26  22.536  14.849  20.876
  189    HA   SER  26           HA       SER  26  24.822  14.829  22.479
  190    HB2  SER  26           2HB      SER  26  23.163  16.941  21.107
  191    HB3  SER  26           3HB      SER  26  24.357  17.459  22.280
  192    HG   SER  26           HG       SER  26  25.999  16.789  20.997
  193    H    ALA  27           HN       ALA  27  21.383  15.683  23.016
  194    HA   ALA  27           HA       ALA  27  21.811  16.925  25.528
  195    HB1  ALA  27           1HB      ALA  27  19.299  16.587  25.696
  196    HB2  ALA  27           2HB      ALA  27  19.849  17.467  24.250
  197    HB3  ALA  27           3HB      ALA  27  19.382  15.754  24.125
  198    H    VAL  28           HN       VAL  28  21.344  13.591  24.370
  199    HA   VAL  28           HA       VAL  28  20.704  12.506  26.902
  200    HB   VAL  28           HB       VAL  28  21.818  11.278  24.373
  201   HG11  VAL  28          1HG1      VAL  28  21.899  10.096  26.827
  202   HG12  VAL  28          2HG1      VAL  28  20.289   9.590  26.263
  203   HG13  VAL  28          3HG1      VAL  28  21.731   9.214  25.290
  204   HG21  VAL  28          3HG2      VAL  28  19.258  12.347  24.983
  205   HG22  VAL  28          1HG2      VAL  28  19.757  11.434  23.539
  206   HG23  VAL  28          2HG2      VAL  28  19.092  10.575  24.950
  207    H    ARG  29           HN       ARG  29  23.760  12.652  24.946
  208    HA   ARG  29           HA       ARG  29  25.257  11.475  26.998
  209    HB2  ARG  29           2HB      ARG  29  27.228  12.197  25.611
  210    HB3  ARG  29           3HB      ARG  29  26.007  11.375  24.660
  211    HG2  ARG  29           2HG      ARG  29  25.099  13.925  24.381
  212    HG3  ARG  29           3HG      ARG  29  26.796  14.274  24.647
  213    HD2  ARG  29           2HD      ARG  29  25.477  12.955  22.320
  214    HD3  ARG  29           3HD      ARG  29  26.919  13.951  22.365
  215    HE   ARG  29           HE       ARG  29  26.789  11.024  22.768
  216   HH11  ARG  29          2HH2      ARG  29  28.771  13.956  22.948
  217   HH12  ARG  29          1HH2      ARG  29  30.271  13.091  22.936
  218   HH22  ARG  29          HH1       ARG  29  30.246  10.697  22.820
  219    H    GLY  30           HN       GLY  30  24.185  14.753  26.253
  220    HA2  GLY  30           1HA      GLY  30  26.188  16.154  27.723
  221    HA3  GLY  30           2HA      GLY  30  24.651  16.772  27.152
  222    H    PHE  31           HN       PHE  31  22.962  14.735  28.458
  223    HA   PHE  31           HA       PHE  31  22.863  15.968  31.037
  224    HB2  PHE  31           2HB      PHE  31  20.699  15.474  30.296
  225    HB3  PHE  31           3HB      PHE  31  21.269  14.210  29.224
  226    HD1  PHE  31           HD1      PHE  31  20.191  14.965  32.654
  227    HD2  PHE  31           HD2      PHE  31  21.329  11.914  29.932
  228    HE1  PHE  31           HE1      PHE  31  19.318  13.225  34.239
  229    HE2  PHE  31           HE2      PHE  31  20.455  10.175  31.517
  230    HZ   PHE  31           HZ       PHE  31  19.461  10.851  33.651
  231    H    ILE  32           HN       ILE  32  24.077  12.949  29.632
  232    HA   ILE  32           HA       ILE  32  24.027  11.343  31.889
  233    HB   ILE  32           HB       ILE  32  24.724  11.018  29.326
  234   HG12  ILE  32          2HG1      ILE  32  26.012   9.074  31.161
  235   HG13  ILE  32          3HG1      ILE  32  24.322   9.410  31.475
  236   HG21  ILE  32          1HG2      ILE  32  26.897  12.263  29.808
  237   HG22  ILE  32          2HG2      ILE  32  27.397  10.814  30.713
  238   HG23  ILE  32          3HG2      ILE  32  27.025  10.695  28.976
  239   HD11  ILE  32          3HD1      ILE  32  23.733   8.867  29.141
  240   HD12  ILE  32          1HD1      ILE  32  25.451   8.617  28.751
  241   HD13  ILE  32          2HD1      ILE  32  24.624   7.514  29.878
  242    H    HIS  33           HN       HIS  33  26.376  13.846  30.807
  243    HA   HIS  33           HA       HIS  33  28.075  13.300  33.054
  244    HB2  HIS  33           2HB      HIS  33  29.497  15.008  32.155
  245    HB3  HIS  33           3HB      HIS  33  28.966  13.968  30.848
  246    HD1  HIS  33           HD1      HIS  33  28.316  17.427  32.304
  247    HD2  HIS  33           HD2      HIS  33  27.610  15.245  28.791
  248    HE1  HIS  33           HE1      HIS  33  27.411  19.094  30.597
  249    H    GLY  34           HN       GLY  34  25.170  15.033  32.472
  250    HA2  GLY  34           1HA      GLY  34  25.446  17.345  33.973
  251    HA3  GLY  34           2HA      GLY  34  23.964  16.440  33.740
  Start of MODEL    5
    1    H1   VAL   1           HN       VAL   1   8.839  -1.485   3.173
    2    HA   VAL   1           HA       VAL   1   8.047   0.904   4.032
    3    HB   VAL   1           HB       VAL   1   8.463   2.344   1.913
    4   HG11  VAL   1          1HG1      VAL   1  10.218   3.462   3.008
    5   HG12  VAL   1          2HG1      VAL   1   9.339   2.636   4.317
    6   HG13  VAL   1          3HG1      VAL   1  10.867   1.958   3.704
    7   HG21  VAL   1          3HG2      VAL   1   9.754   0.159   0.979
    8   HG22  VAL   1          1HG2      VAL   1  10.133   1.821   0.468
    9   HG23  VAL   1          2HG2      VAL   1  11.119   1.028   1.719
   10    H    PHE   2           HN       PHE   2   6.203   1.861   2.630
   11    HA   PHE   2           HA       PHE   2   5.277   0.166   0.520
   12    HB2  PHE   2           2HB      PHE   2   3.208  -0.494   1.791
   13    HB3  PHE   2           3HB      PHE   2   4.640  -1.110   2.591
   14    HD1  PHE   2           HD2      PHE   2   5.620   0.416   4.484
   15    HD2  PHE   2           HD1      PHE   2   1.645   0.691   3.026
   16    HE1  PHE   2           HE2      PHE   2   4.918   1.546   6.612
   17    HE2  PHE   2           HE1      PHE   2   0.943   1.822   5.154
   18    HZ   PHE   2           HZ       PHE   2   2.588   2.236   6.922
   19    H    HIS   3           HN       HIS   3   5.985   2.992   0.881
   20    HA   HIS   3           HA       HIS   3   3.813   4.136  -0.400
   21    HB2  HIS   3           2HB      HIS   3   2.469   4.335   1.435
   22    HB3  HIS   3           3HB      HIS   3   3.809   4.395   2.563
   23    HD1  HIS   3           HD1      HIS   3   1.205   6.476   1.499
   24    HD2  HIS   3           HD2      HIS   3   5.333   7.085   1.931
   25    HE1  HIS   3           HE1      HIS   3   1.539   8.998   1.692
   26    H    ALA   4           HN       ALA   4   6.674   4.538   1.726
   27    HA   ALA   4           HA       ALA   4   7.331   7.113   0.745
   28    HB1  ALA   4           1HB      ALA   4   8.022   5.935   2.942
   29    HB2  ALA   4           2HB      ALA   4   9.253   5.108   1.958
   30    HB3  ALA   4           3HB      ALA   4   9.264   6.883   2.090
   31    H    TYR   5           HN       TYR   5   8.297   3.733  -0.076
   32    HA   TYR   5           HA       TYR   5   9.490   2.908  -1.762
   33    HB2  TYR   5           2HB      TYR   5   7.817   5.209  -2.854
   34    HB3  TYR   5           3HB      TYR   5   8.938   4.441  -3.960
   35    HD1  TYR   5           HD2      TYR   5   6.310   3.444  -1.464
   36    HD2  TYR   5           HD1      TYR   5   8.131   2.702  -5.264
   37    HE1  TYR   5           HE2      TYR   5   4.607   1.616  -1.932
   38    HE2  TYR   5           HE1      TYR   5   6.421   0.876  -5.719
   39    HH   TYR   5           HH       TYR   5   4.697  -0.192  -4.994
   40    H    SER   6           HN       SER   6  10.856   3.818  -3.950
   41    HA   SER   6           HA       SER   6  12.902   4.464  -4.394
   42    HB2  SER   6           2HB      SER   6  11.802   7.108  -3.338
   43    HB3  SER   6           3HB      SER   6  13.222   6.954  -4.354
   44    HG   SER   6           HG       SER   6  11.902   6.084  -6.046
   45    H    ALA   7           HN       ALA   7  14.245   3.304  -2.940
   46    HA   ALA   7           HA       ALA   7  14.566   3.933  -0.250
   47    HB1  ALA   7           1HB      ALA   7  16.030   2.356  -2.335
   48    HB2  ALA   7           2HB      ALA   7  16.891   2.726  -0.822
   49    HB3  ALA   7           3HB      ALA   7  15.352   1.833  -0.775
   50    H    ARG   8           HN       ARG   8  16.078   5.222  -3.223
   51    HA   ARG   8           HA       ARG   8  18.178   6.503  -1.946
   52    HB2  ARG   8           2HB      ARG   8  16.879   6.543  -4.616
   53    HB3  ARG   8           3HB      ARG   8  17.607   8.078  -4.189
   54    HG2  ARG   8           2HG      ARG   8  19.466   7.038  -5.111
   55    HG3  ARG   8           3HG      ARG   8  19.665   6.530  -3.445
   56    HD2  ARG   8           2HD      ARG   8  18.181   4.878  -5.545
   57    HD3  ARG   8           3HD      ARG   8  19.875   4.653  -5.156
   58    HE   ARG   8           HE       ARG   8  18.043   4.564  -2.843
   59   HH11  ARG   8          2HH2      ARG   8  19.790   2.697  -5.296
   60   HH12  ARG   8          1HH2      ARG   8  19.711   1.215  -4.403
   61   HH22  ARG   8          HH1       ARG   8  18.618   1.187  -2.270
   62    H    GLY   9           HN       GLY   9  14.788   7.075  -1.875
   63    HA2  GLY   9           1HA      GLY   9  15.118   9.941  -1.278
   64    HA3  GLY   9           2HA      GLY   9  13.626   9.131  -1.710
   65    H    VAL  10           HN       VAL  10  14.141   6.757   0.047
   66    HA   VAL  10           HA       VAL  10  12.947   7.791   2.386
   67    HB   VAL  10           HB       VAL  10  12.892   5.441   1.172
   68   HG11  VAL  10          1HG1      VAL  10  15.068   5.101   3.261
   69   HG12  VAL  10          2HG1      VAL  10  14.181   3.759   2.499
   70   HG13  VAL  10          3HG1      VAL  10  15.202   4.828   1.507
   71   HG21  VAL  10          3HG2      VAL  10  11.281   5.609   2.769
   72   HG22  VAL  10          1HG2      VAL  10  12.377   4.517   3.650
   73   HG23  VAL  10          2HG2      VAL  10  12.400   6.265   3.989
   74    H    ARG  11           HN       ARG  11  16.238   6.469   1.632
   75    HA   ARG  11           HA       ARG  11  17.180   6.835   4.216
   76    HB2  ARG  11           2HB      ARG  11  19.439   6.544   3.176
   77    HB3  ARG  11           3HB      ARG  11  18.299   5.347   2.593
   78    HG2  ARG  11           2HG      ARG  11  17.850   7.160   0.678
   79    HG3  ARG  11           3HG      ARG  11  19.433   7.747   1.147
   80    HD2  ARG  11           2HD      ARG  11  18.699   5.015   0.036
   81    HD3  ARG  11           3HD      ARG  11  19.861   6.164  -0.596
   82    HE   ARG  11           HE       ARG  11  20.927   5.627   1.864
   83   HH11  ARG  11          2HH2      ARG  11  19.729   3.477  -0.685
   84   HH12  ARG  11          1HH2      ARG  11  20.801   2.182  -0.268
   85   HH22  ARG  11          HH1       ARG  11  22.328   2.463   1.558
   86    H    ASN  12           HN       ASN  12  17.175   8.895   1.260
   87    HA   ASN  12           HA       ASN  12  18.907  10.829   2.138
   88    HB2  ASN  12           2HB      ASN  12  16.704  10.627   0.125
   89    HB3  ASN  12           3HB      ASN  12  17.072  12.264   0.632
   90   HD21  ASN  12          1HD2      ASN  12  18.827   9.254  -0.127
   91   HD22  ASN  12          2HD2      ASN  12  20.044   9.959  -1.138
   92    H    ASN  13           HN       ASN  13  15.642   9.994   3.115
   93    HA   ASN  13           HA       ASN  13  15.115  12.605   4.187
   94    HB2  ASN  13           2HB      ASN  13  13.590   9.991   3.964
   95    HB3  ASN  13           3HB      ASN  13  13.052  11.174   5.140
   96   HD21  ASN  13          1HD2      ASN  13  14.644  11.894   2.083
   97   HD22  ASN  13          2HD2      ASN  13  13.311  12.674   1.299
   98    H    TYR  14           HN       TYR  14  16.619   9.600   5.067
   99    HA   TYR  14           HA       TYR  14  16.016   9.737   7.873
  100    HB2  TYR  14           2HB      TYR  14  16.746   7.551   7.577
  101    HB3  TYR  14           3HB      TYR  14  17.032   7.921   5.888
  102    HD1  TYR  14           HD2      TYR  14  18.724   8.564   9.186
  103    HD2  TYR  14           HD1      TYR  14  19.143   7.421   5.085
  104    HE1  TYR  14           HE2      TYR  14  21.220   8.224   9.529
  105    HE2  TYR  14           HE1      TYR  14  21.638   7.085   5.441
  106    HH   TYR  14           HH       TYR  14  23.334   8.332   7.584
  107    H    LYS  15           HN       LYS  15  18.831  10.443   5.713
  108    HA   LYS  15           HA       LYS  15  20.656  11.022   7.710
  109    HB2  LYS  15           2HB      LYS  15  21.998  11.883   6.013
  110    HB3  LYS  15           3HB      LYS  15  20.989  10.717   5.181
  111    HG2  LYS  15           2HG      LYS  15  20.719  12.520   3.745
  112    HG3  LYS  15           3HG      LYS  15  19.384  12.837   4.836
  113    HD2  LYS  15           2HD      LYS  15  21.263  14.171   6.214
  114    HD3  LYS  15           3HD      LYS  15  22.061  14.224   4.655
  115    HE2  LYS  15           2HE      LYS  15  19.202  14.887   4.423
  116    HE3  LYS  15           3HE      LYS  15  20.017  15.950   5.553
  117    HZ1  LYS  15           2HZ      LYS  15  20.078  16.323   2.913
  118    HZ3  LYS  15           1HZ      LYS  15  21.448  15.456   3.070
  119    H    SER  16           HN       SER  16  17.763  12.690   6.747
  120    HA   SER  16           HA       SER  16  18.619  15.257   7.536
  121    HB2  SER  16           2HB      SER  16  16.658  15.858   6.586
  122    HB3  SER  16           3HB      SER  16  16.402  14.166   6.209
  123    HG   SER  16           HG       SER  16  14.657  14.413   7.442
  124    H    ALA  17           HN       ALA  17  16.574  12.661   9.044
  125    HA   ALA  17           HA       ALA  17  16.116  14.055  11.436
  126    HB1  ALA  17           1HB      ALA  17  15.382  11.605  10.219
  127    HB2  ALA  17           2HB      ALA  17  16.143  11.175  11.770
  128    HB3  ALA  17           3HB      ALA  17  14.757  12.291  11.738
  129    H    VAL  18           HN       VAL  18  18.970  12.693  10.098
  130    HA   VAL  18           HA       VAL  18  20.144  11.892  12.583
  131    HB   VAL  18           HB       VAL  18  20.990  12.128   9.725
  132   HG11  VAL  18          1HG1      VAL  18  23.247  11.121  10.907
  133   HG12  VAL  18          2HG1      VAL  18  23.048  12.801  10.352
  134   HG13  VAL  18          3HG1      VAL  18  22.772  12.389  12.062
  135   HG21  VAL  18          3HG2      VAL  18  21.843   9.708  10.768
  136   HG22  VAL  18          1HG2      VAL  18  20.328  10.020  11.649
  137   HG23  VAL  18          2HG2      VAL  18  20.333   9.989   9.869
  138    H    GLY  19           HN       GLY  19  19.895  14.833  10.608
  139    HA2  GLY  19           1HA      GLY  19  22.052  16.293  11.537
  140    HA3  GLY  19           2HA      GLY  19  20.512  16.953  11.022
  141    HA   PRO  20           HA       PRO  20  19.371  17.714  15.154
  142    HB2  PRO  20           2HB      PRO  20  16.848  16.729  15.521
  143    HB3  PRO  20           3HB      PRO  20  17.179  18.224  14.669
  144    HG2  PRO  20           2HG      PRO  20  16.414  15.591  13.564
  145    HG3  PRO  20           3HG      PRO  20  16.334  17.167  12.802
  146    HD2  PRO  20           2HD      PRO  20  18.296  15.129  12.329
  147    HD3  PRO  20           3HD      PRO  20  18.281  16.746  11.655
  148    H    ALA  21           HN       ALA  21  19.212  14.388  14.292
  149    HA   ALA  21           HA       ALA  21  18.802  13.259  16.766
  150    HB1  ALA  21           1HB      ALA  21  20.114  11.337  15.790
  151    HB2  ALA  21           2HB      ALA  21  18.824  11.954  14.730
  152    HB3  ALA  21           3HB      ALA  21  20.521  12.387  14.412
  153    H    ASP  22           HN       ASP  22  21.541  15.085  15.523
  154    HA   ASP  22           HA       ASP  22  23.446  14.027  17.278
  155    HB2  ASP  22           2HB      ASP  22  23.511  15.700  15.114
  156    HB3  ASP  22           3HB      ASP  22  23.659  16.886  16.395
  157    HD2  ASP  22           HD2      ASP  22  26.162  14.613  17.641
  158    H    TRP  23           HN       TRP  23  21.001  16.644  17.389
  159    HA   TRP  23           HA       TRP  23  22.020  17.889  19.730
  160    HB2  TRP  23           2HB      TRP  23  20.288  19.352  19.519
  161    HB3  TRP  23           3HB      TRP  23  20.460  18.804  17.864
  162    HD1  TRP  23           HD1      TRP  23  18.195  18.112  16.767
  163    HE1  TRP  23           HE1      TRP  23  15.785  17.340  17.516
  164    HE3  TRP  23           HE3      TRP  23  19.227  17.932  21.743
  165    HZ2  TRP  23           HZ2      TRP  23  14.608  16.754  20.049
  166    HZ3  TRP  23           HZ3      TRP  23  17.391  17.250  23.285
  167    HH2  TRP  23           HH2      TRP  23  15.146  16.673  22.511
  168    H    VAL  24           HN       VAL  24  19.303  15.591  18.991
  169    HA   VAL  24           HA       VAL  24  18.418  15.291  21.597
  170    HB   VAL  24           HB       VAL  24  17.817  14.310  19.069
  171   HG11  VAL  24          1HG1      VAL  24  19.225  12.376  19.303
  172   HG12  VAL  24          2HG1      VAL  24  18.567  12.025  20.919
  173   HG13  VAL  24          3HG1      VAL  24  17.534  11.850  19.481
  174   HG21  VAL  24          3HG2      VAL  24  16.638  14.365  21.752
  175   HG22  VAL  24          1HG2      VAL  24  15.892  14.667  20.165
  176   HG23  VAL  24          2HG2      VAL  24  16.063  13.000  20.765
  177    H    ILE  25           HN       ILE  25  20.841  13.344  19.722
  178    HA   ILE  25           HA       ILE  25  21.435  11.644  21.878
  179    HB   ILE  25           HB       ILE  25  21.878  11.533  19.274
  180   HG12  ILE  25          2HG1      ILE  25  23.880   9.903  20.010
  181   HG13  ILE  25          3HG1      ILE  25  23.197  10.205  21.595
  182   HG21  ILE  25          1HG2      ILE  25  24.059  12.036  18.572
  183   HG22  ILE  25          2HG2      ILE  25  23.536  13.468  19.491
  184   HG23  ILE  25          3HG2      ILE  25  24.636  12.285  20.237
  185   HD11  ILE  25          3HD1      ILE  25  20.884   9.732  20.315
  186   HD12  ILE  25          1HD1      ILE  25  21.961   8.833  19.221
  187   HD13  ILE  25          2HD1      ILE  25  21.884   8.402  20.946
  188    H    SER  26           HN       SER  26  22.578  14.863  20.873
  189    HA   SER  26           HA       SER  26  24.865  14.846  22.475
  190    HB2  SER  26           2HB      SER  26  23.207  16.955  21.097
  191    HB3  SER  26           3HB      SER  26  24.402  17.476  22.267
  192    HG   SER  26           HG       SER  26  26.058  16.502  21.046
  193    H    ALA  27           HN       ALA  27  21.427  15.704  23.011
  194    HA   ALA  27           HA       ALA  27  21.857  16.954  25.519
  195    HB1  ALA  27           1HB      ALA  27  19.252  15.654  24.793
  196    HB2  ALA  27           2HB      ALA  27  19.568  17.258  25.497
  197    HB3  ALA  27           3HB      ALA  27  19.845  16.977  23.761
  198    H    VAL  28           HN       VAL  28  21.388  13.616  24.371
  199    HA   VAL  28           HA       VAL  28  20.748  12.540  26.908
  200    HB   VAL  28           HB       VAL  28  21.859  11.303  24.382
  201   HG11  VAL  28          1HG1      VAL  28  20.331   9.625  26.284
  202   HG12  VAL  28          2HG1      VAL  28  21.766   9.240  25.304
  203   HG13  VAL  28          3HG1      VAL  28  21.947  10.127  26.836
  204   HG21  VAL  28          3HG2      VAL  28  19.341  12.422  24.903
  205   HG22  VAL  28          1HG2      VAL  28  19.786  11.352  23.552
  206   HG23  VAL  28          2HG2      VAL  28  19.106  10.663  25.046
  207    H    ARG  29           HN       ARG  29  23.804  12.677  24.949
  208    HA   ARG  29           HA       ARG  29  25.300  11.507  27.004
  209    HB2  ARG  29           2HB      ARG  29  27.271  12.223  25.613
  210    HB3  ARG  29           3HB      ARG  29  26.049  11.399  24.665
  211    HG2  ARG  29           2HG      ARG  29  25.143  13.948  24.379
  212    HG3  ARG  29           3HG      ARG  29  26.840  14.297  24.642
  213    HD2  ARG  29           2HD      ARG  29  25.519  12.971  22.320
  214    HD3  ARG  29           3HD      ARG  29  26.961  13.966  22.361
  215    HE   ARG  29           HE       ARG  29  26.829  11.041  22.774
  216   HH11  ARG  29          2HH2      ARG  29  28.813  13.971  22.944
  217   HH12  ARG  29          1HH2      ARG  29  30.313  13.106  22.933
  218   HH22  ARG  29          HH1       ARG  29  30.286  10.712  22.825
  219    H    GLY  30           HN       GLY  30  24.231  14.783  26.248
  220    HA2  GLY  30           1HA      GLY  30  26.235  16.189  27.711
  221    HA3  GLY  30           2HA      GLY  30  24.697  16.805  27.140
  222    H    PHE  31           HN       PHE  31  23.009  14.773  28.455
  223    HA   PHE  31           HA       PHE  31  22.915  16.014  31.030
  224    HB2  PHE  31           2HB      PHE  31  20.749  15.521  30.294
  225    HB3  PHE  31           3HB      PHE  31  21.316  14.254  29.224
  226    HD1  PHE  31           HD1      PHE  31  20.242  15.019  32.653
  227    HD2  PHE  31           HD2      PHE  31  21.377  11.960  29.940
  228    HE1  PHE  31           HE1      PHE  31  19.369  13.284  34.244
  229    HE2  PHE  31           HE2      PHE  31  20.504  10.225  31.531
  230    HZ   PHE  31           HZ       PHE  31  19.510  10.908  33.663
  231    H    ILE  32           HN       ILE  32  24.124  12.990  29.633
  232    HA   ILE  32           HA       ILE  32  24.075  11.391  31.895
  233    HB   ILE  32           HB       ILE  32  24.766  11.057  29.332
  234   HG12  ILE  32          2HG1      ILE  32  26.056   9.116  31.168
  235   HG13  ILE  32          3HG1      ILE  32  24.367   9.457  31.488
  236   HG21  ILE  32          1HG2      ILE  32  27.067  10.730  28.979
  237   HG22  ILE  32          2HG2      ILE  32  26.943  12.301  29.807
  238   HG23  ILE  32          3HG2      ILE  32  27.441  10.852  30.715
  239   HD11  ILE  32          3HD1      ILE  32  24.743   7.546  29.872
  240   HD12  ILE  32          1HD1      ILE  32  23.731   8.853  29.213
  241   HD13  ILE  32          2HD1      ILE  32  25.438   8.718  28.727
  242    H    HIS  33           HN       HIS  33  26.425  13.887  30.802
  243    HA   HIS  33           HA       HIS  33  28.127  13.346  33.047
  244    HB2  HIS  33           2HB      HIS  33  29.549  15.050  32.140
  245    HB3  HIS  33           3HB      HIS  33  29.015  14.008  30.837
  246    HD1  HIS  33           HD1      HIS  33  28.367  17.470  32.287
  247    HD2  HIS  33           HD2      HIS  33  27.660  15.282  28.778
  248    HE1  HIS  33           HE1      HIS  33  27.462  19.133  30.577
  249    H    GLY  34           HN       GLY  34  25.223  15.080  32.465
  250    HA2  GLY  34           1HA      GLY  34  25.773  16.978  34.653
  251    HA3  GLY  34           2HA      GLY  34  24.516  17.122  33.441
  Start of MODEL    6
    1    H1   VAL   1           HN       VAL   1   8.677  -0.653   5.018
    2    HA   VAL   1           HA       VAL   1   7.456   1.042   4.262
    3    HB   VAL   1           HB       VAL   1   8.522   2.401   2.586
    4   HG11  VAL   1          1HG1      VAL   1   9.829   1.337   4.880
    5   HG12  VAL   1          2HG1      VAL   1  11.057   1.536   3.607
    6   HG13  VAL   1          3HG1      VAL   1  10.062   2.924   4.109
    7   HG21  VAL   1          3HG2      VAL   1   9.179   1.239   0.750
    8   HG22  VAL   1          1HG2      VAL   1  10.739   1.203   1.606
    9   HG23  VAL   1          2HG2      VAL   1   9.645  -0.199   1.690
   10    H    PHE   2           HN       PHE   2   5.918   1.856   2.605
   11    HA   PHE   2           HA       PHE   2   5.422   0.220   0.326
   12    HB2  PHE   2           2HB      PHE   2   3.217  -0.601   1.143
   13    HB3  PHE   2           3HB      PHE   2   4.465  -1.129   2.254
   14    HD1  PHE   2           HD1      PHE   2   4.771   0.101   4.423
   15    HD2  PHE   2           HD2      PHE   2   1.464   0.821   1.864
   16    HE1  PHE   2           HE1      PHE   2   3.533   1.174   6.325
   17    HE2  PHE   2           HE2      PHE   2   0.225   1.893   3.766
   18    HZ   PHE   2           HZ       PHE   2   1.275   2.057   5.973
   19    H    HIS   3           HN       HIS   3   6.013   2.973   0.655
   20    HA   HIS   3           HA       HIS   3   3.949   4.107  -0.803
   21    HB2  HIS   3           2HB      HIS   3   2.477   4.381   0.912
   22    HB3  HIS   3           3HB      HIS   3   3.725   4.415   2.142
   23    HD1  HIS   3           HD1      HIS   3   1.268   6.555   0.879
   24    HD2  HIS   3           HD2      HIS   3   5.370   7.058   1.600
   25    HE1  HIS   3           HE1      HIS   3   1.656   9.069   1.077
   26    H    ALA   4           HN       ALA   4   6.657   4.533   1.510
   27    HA   ALA   4           HA       ALA   4   7.413   7.086   0.624
   28    HB1  ALA   4           1HB      ALA   4   9.341   6.734   1.960
   29    HB2  ALA   4           2HB      ALA   4   8.060   5.790   2.759
   30    HB3  ALA   4           3HB      ALA   4   9.271   4.969   1.746
   31    H    TYR   5           HN       TYR   5   8.528   3.750  -0.265
   32    HA   TYR   5           HA       TYR   5   9.688   3.003  -2.003
   33    HB2  TYR   5           2HB      TYR   5   8.025   5.343  -3.046
   34    HB3  TYR   5           3HB      TYR   5   9.126   4.556  -4.160
   35    HD1  TYR   5           HD2      TYR   5   6.452   3.641  -1.685
   36    HD2  TYR   5           HD1      TYR   5   8.306   2.809  -5.450
   37    HE1  TYR   5           HE2      TYR   5   4.706   1.854  -2.159
   38    HE2  TYR   5           HE1      TYR   5   6.554   1.025  -5.911
   39    HH   TYR   5           HH       TYR   5   4.289   0.513  -5.236
   40    H    SER   6           HN       SER   6  11.068   3.998  -4.134
   41    HA   SER   6           HA       SER   6  13.095   4.708  -4.550
   42    HB2  SER   6           2HB      SER   6  11.944   7.276  -3.373
   43    HB3  SER   6           3HB      SER   6  13.387   7.202  -4.364
   44    HG   SER   6           HG       SER   6  11.652   5.919  -5.838
   45    H    ALA   7           HN       ALA   7  14.479   3.515  -3.175
   46    HA   ALA   7           HA       ALA   7  14.778   3.981  -0.450
   47    HB1  ALA   7           1HB      ALA   7  17.118   2.860  -1.047
   48    HB2  ALA   7           2HB      ALA   7  15.602   1.933  -1.148
   49    HB3  ALA   7           3HB      ALA   7  16.333   2.608  -2.624
   50    H    ARG   8           HN       ARG   8  16.261   5.495  -3.331
   51    HA   ARG   8           HA       ARG   8  18.325   6.748  -1.981
   52    HB2  ARG   8           2HB      ARG   8  16.976   6.981  -4.628
   53    HB3  ARG   8           3HB      ARG   8  17.737   8.465  -4.090
   54    HG2  ARG   8           2HG      ARG   8  19.539   7.446  -5.163
   55    HG3  ARG   8           3HG      ARG   8  19.795   6.878  -3.525
   56    HD2  ARG   8           2HD      ARG   8  18.196   5.297  -5.592
   57    HD3  ARG   8           3HD      ARG   8  19.918   5.080  -5.354
   58    HE   ARG   8           HE       ARG   8  18.270   4.873  -2.910
   59   HH11  ARG   8          2HH2      ARG   8  19.885   3.141  -5.545
   60   HH12  ARG   8          1HH2      ARG   8  19.909   1.628  -4.702
   61   HH22  ARG   8          HH1       ARG   8  18.972   1.496  -2.500
   62    H    GLY   9           HN       GLY   9  14.931   7.205  -1.810
   63    HA2  GLY   9           1HA      GLY   9  15.192  10.033  -1.012
   64    HA3  GLY   9           2HA      GLY   9  13.717   9.225  -1.507
   65    H    VAL  10           HN       VAL  10  14.204   6.740   0.041
   66    HA   VAL  10           HA       VAL  10  12.991   7.525   2.439
   67    HB   VAL  10           HB       VAL  10  13.100   5.268   1.064
   68   HG11  VAL  10          1HG1      VAL  10  15.437   4.773   1.391
   69   HG12  VAL  10          2HG1      VAL  10  15.270   4.920   3.157
   70   HG13  VAL  10          3HG1      VAL  10  14.476   3.580   2.297
   71   HG21  VAL  10          3HG2      VAL  10  12.774   4.290   3.675
   72   HG22  VAL  10          1HG2      VAL  10  12.311   6.007   3.757
   73   HG23  VAL  10          2HG2      VAL  10  11.510   4.923   2.594
   74    H    ARG  11           HN       ARG  11  16.368   6.457   1.660
   75    HA   ARG  11           HA       ARG  11  17.219   6.774   4.303
   76    HB2  ARG  11           2HB      ARG  11  19.517   6.556   3.314
   77    HB3  ARG  11           3HB      ARG  11  18.425   5.318   2.726
   78    HG2  ARG  11           2HG      ARG  11  17.964   7.154   0.802
   79    HG3  ARG  11           3HG      ARG  11  19.564   7.697   1.269
   80    HD2  ARG  11           2HD      ARG  11  19.542   5.975  -0.606
   81    HD3  ARG  11           3HD      ARG  11  20.553   5.544   0.759
   82    HE   ARG  11           HE       ARG  11  17.775   4.540   0.876
   83   HH11  ARG  11          2HH2      ARG  11  21.143   3.840   0.025
   84   HH12  ARG  11          1HH2      ARG  11  20.926   2.122   0.065
   85   HH22  ARG  11          HH1       ARG  11  18.769   1.223   0.597
   86    H    ASN  12           HN       ASN  12  17.217   8.855   1.366
   87    HA   ASN  12           HA       ASN  12  18.896  10.819   2.274
   88    HB2  ASN  12           2HB      ASN  12  16.703  10.594   0.249
   89    HB3  ASN  12           3HB      ASN  12  17.051  12.232   0.767
   90   HD21  ASN  12          1HD2      ASN  12  18.980   9.289   0.184
   91   HD22  ASN  12          2HD2      ASN  12  20.144   9.999  -0.885
   92    H    ASN  13           HN       ASN  13  15.634   9.911   3.207
   93    HA   ASN  13           HA       ASN  13  15.044  12.496   4.302
   94    HB2  ASN  13           2HB      ASN  13  13.583   9.860   4.009
   95    HB3  ASN  13           3HB      ASN  13  13.020  10.974   5.239
   96   HD21  ASN  13          1HD2      ASN  13  14.505  11.660   2.094
   97   HD22  ASN  13          2HD2      ASN  13  13.169  12.511   1.393
   98    H    TYR  14           HN       TYR  14  16.595   9.507   5.171
   99    HA   TYR  14           HA       TYR  14  15.977   9.624   7.976
  100    HB2  TYR  14           2HB      TYR  14  16.742   7.450   7.676
  101    HB3  TYR  14           3HB      TYR  14  17.023   7.829   5.989
  102    HD1  TYR  14           HD1      TYR  14  18.705   8.483   9.290
  103    HD2  TYR  14           HD2      TYR  14  19.141   7.367   5.183
  104    HE1  TYR  14           HE1      TYR  14  21.205   8.178   9.631
  105    HE2  TYR  14           HE2      TYR  14  21.641   7.065   5.538
  106    HH   TYR  14           HH       TYR  14  23.351   7.798   6.992
  107    H    LYS  15           HN       LYS  15  18.791  10.380   5.831
  108    HA   LYS  15           HA       LYS  15  20.595  10.977   7.845
  109    HB2  LYS  15           2HB      LYS  15  21.643  12.429   5.998
  110    HB3  LYS  15           3HB      LYS  15  21.492  10.707   5.716
  111    HG2  LYS  15           2HG      LYS  15  20.026  10.998   3.989
  112    HG3  LYS  15           3HG      LYS  15  19.078  12.177   4.874
  113    HD2  LYS  15           2HD      LYS  15  21.802  12.911   3.740
  114    HD3  LYS  15           3HD      LYS  15  20.369  12.962   2.732
  115    HE2  LYS  15           2HE      LYS  15  19.930  15.028   3.560
  116    HE3  LYS  15           3HE      LYS  15  19.600  14.287   5.113
  117    HZ1  LYS  15           2HZ      LYS  15  21.501  16.064   4.859
  118    HZ3  LYS  15           1HZ      LYS  15  22.406  14.785   4.415
  119    H    SER  16           HN       SER  16  17.683  12.596   6.877
  120    HA   SER  16           HA       SER  16  18.494  15.182   7.645
  121    HB2  SER  16           2HB      SER  16  16.203  13.948   6.456
  122    HB3  SER  16           3HB      SER  16  15.628  14.793   7.880
  123    HG   SER  16           HG       SER  16  16.652  16.739   7.096
  124    H    ALA  17           HN       ALA  17  16.491  12.571   9.185
  125    HA   ALA  17           HA       ALA  17  16.040  13.974  11.572
  126    HB1  ALA  17           1HB      ALA  17  16.090  11.104  11.938
  127    HB2  ALA  17           2HB      ALA  17  14.692  12.205  11.880
  128    HB3  ALA  17           3HB      ALA  17  15.333  11.499  10.376
  129    H    VAL  18           HN       VAL  18  18.896  12.631  10.220
  130    HA   VAL  18           HA       VAL  18  20.097  11.854  12.699
  131    HB   VAL  18           HB       VAL  18  20.919  12.083   9.833
  132   HG11  VAL  18          1HG1      VAL  18  22.717  12.366  12.157
  133   HG12  VAL  18          2HG1      VAL  18  23.195  11.104  10.996
  134   HG13  VAL  18          3HG1      VAL  18  22.973  12.782  10.446
  135   HG21  VAL  18          3HG2      VAL  18  21.801   9.676  10.903
  136   HG22  VAL  18          1HG2      VAL  18  20.272   9.982  11.762
  137   HG23  VAL  18          2HG2      VAL  18  20.300   9.935   9.983
  138    H    GLY  19           HN       GLY  19  19.807  14.782  10.710
  139    HA2  GLY  19           1HA      GLY  19  21.957  16.267  11.615
  140    HA3  GLY  19           2HA      GLY  19  20.407  16.910  11.108
  141    HA   PRO  20           HA       PRO  20  19.289  17.683  15.244
  142    HB2  PRO  20           2HB      PRO  20  16.779  16.677  15.636
  143    HB3  PRO  20           3HB      PRO  20  17.089  18.171  14.772
  144    HG2  PRO  20           2HG      PRO  20  16.340  15.524  13.688
  145    HG3  PRO  20           3HG      PRO  20  16.240  17.095  12.917
  146    HD2  PRO  20           2HD      PRO  20  18.218  15.073  12.442
  147    HD3  PRO  20           3HD      PRO  20  18.183  16.686  11.758
  148    H    ALA  21           HN       ALA  21  19.157  14.351  14.401
  149    HA   ALA  21           HA       ALA  21  18.775  13.232  16.885
  150    HB1  ALA  21           1HB      ALA  21  20.484  12.364  14.521
  151    HB2  ALA  21           2HB      ALA  21  20.098  11.317  15.909
  152    HB3  ALA  21           3HB      ALA  21  18.794  11.916  14.856
  153    H    ASP  22           HN       ASP  22  21.488  15.076  15.610
  154    HA   ASP  22           HA       ASP  22  23.415  14.045  17.357
  155    HB2  ASP  22           2HB      ASP  22  23.449  15.705  15.183
  156    HB3  ASP  22           3HB      ASP  22  23.598  16.900  16.456
  157    HD2  ASP  22           HD2      ASP  22  26.018  16.719  17.598
  158    H    TRP  23           HN       TRP  23  20.946  16.638  17.472
  159    HA   TRP  23           HA       TRP  23  21.972  17.910  19.796
  160    HB2  TRP  23           2HB      TRP  23  20.225  19.355  19.588
  161    HB3  TRP  23           3HB      TRP  23  20.386  18.795  17.935
  162    HD1  TRP  23           HD1      TRP  23  18.117  18.075  16.865
  163    HE1  TRP  23           HE1      TRP  23  15.722  17.287  17.642
  164    HE3  TRP  23           HE3      TRP  23  19.198  17.941  21.832
  165    HZ2  TRP  23           HZ2      TRP  23  14.574  16.708  20.190
  166    HZ3  TRP  23           HZ3      TRP  23  17.384  17.254  23.397
  167    HH2  TRP  23           HH2      TRP  23  15.137  16.650  22.648
  168    H    VAL  24           HN       VAL  24  19.270  15.582  19.094
  169    HA   VAL  24           HA       VAL  24  18.410  15.291  21.710
  170    HB   VAL  24           HB       VAL  24  17.795  14.289  19.193
  171   HG11  VAL  24          1HG1      VAL  24  17.535  11.829  19.624
  172   HG12  VAL  24          2HG1      VAL  24  19.220  12.368  19.425
  173   HG13  VAL  24          3HG1      VAL  24  18.582  12.023  21.051
  174   HG21  VAL  24          3HG2      VAL  24  16.642  14.335  21.892
  175   HG22  VAL  24          1HG2      VAL  24  15.883  14.651  20.313
  176   HG23  VAL  24          2HG2      VAL  24  16.059  12.979  20.897
  177    H    ILE  25           HN       ILE  25  20.831  13.351  19.824
  178    HA   ILE  25           HA       ILE  25  21.460  11.671  21.986
  179    HB   ILE  25           HB       ILE  25  21.878  11.545  19.378
  180   HG12  ILE  25          2HG1      ILE  25  24.077  10.188  20.752
  181   HG13  ILE  25          3HG1      ILE  25  22.554  10.023  21.604
  182   HG21  ILE  25          1HG2      ILE  25  23.524  13.494  19.568
  183   HG22  ILE  25          2HG2      ILE  25  24.641  12.322  20.308
  184   HG23  ILE  25          3HG2      ILE  25  24.046  12.061  18.651
  185   HD11  ILE  25          3HD1      ILE  25  23.347   8.495  19.421
  186   HD12  ILE  25          1HD1      ILE  25  21.673   8.662  20.003
  187   HD13  ILE  25          2HD1      ILE  25  22.263   9.697  18.680
  188    H    SER  26           HN       SER  26  22.567  14.892  20.947
  189    HA   SER  26           HA       SER  26  24.871  14.904  22.525
  190    HB2  SER  26           2HB      SER  26  24.807  16.522  20.807
  191    HB3  SER  26           3HB      SER  26  23.170  17.017  21.189
  192    HG   SER  26           HG       SER  26  25.565  17.994  22.159
  193    H    ALA  27           HN       ALA  27  21.431  15.738  23.091
  194    HA   ALA  27           HA       ALA  27  21.878  17.008  25.586
  195    HB1  ALA  27           1HB      ALA  27  19.814  17.647  24.928
  196    HB2  ALA  27           2HB      ALA  27  19.641  16.250  23.837
  197    HB3  ALA  27           3HB      ALA  27  19.255  16.082  25.567
  198    H    VAL  28           HN       VAL  28  21.423  13.659  24.466
  199    HA   VAL  28           HA       VAL  28  20.819  12.595  27.016
  200    HB   VAL  28           HB       VAL  28  21.914  11.350  24.487
  201   HG11  VAL  28          1HG1      VAL  28  21.850   9.293  25.424
  202   HG12  VAL  28          2HG1      VAL  28  22.033  10.192  26.950
  203   HG13  VAL  28          3HG1      VAL  28  20.418   9.670  26.412
  204   HG21  VAL  28          3HG2      VAL  28  19.168  10.703  25.196
  205   HG22  VAL  28          1HG2      VAL  28  19.398  12.458  25.013
  206   HG23  VAL  28          2HG2      VAL  28  19.829  11.360  23.680
  207    H    ARG  29           HN       ARG  29  23.852  12.743  25.024
  208    HA   ARG  29           HA       ARG  29  25.380  11.599  27.071
  209    HB2  ARG  29           2HB      ARG  29  27.330  12.321  25.654
  210    HB3  ARG  29           3HB      ARG  29  26.105  11.481  24.725
  211    HG2  ARG  29           2HG      ARG  29  25.175  14.020  24.432
  212    HG3  ARG  29           3HG      ARG  29  26.872  14.385  24.675
  213    HD2  ARG  29           2HD      ARG  29  25.538  13.033  22.376
  214    HD3  ARG  29           3HD      ARG  29  26.972  14.040  22.395
  215    HE   ARG  29           HE       ARG  29  26.868  11.116  22.829
  216   HH11  ARG  29          2HH2      ARG  29  28.830  14.064  22.957
  217   HH12  ARG  29          1HH2      ARG  29  30.337  13.210  22.937
  218   HH22  ARG  29          HH1       ARG  29  30.328  10.815  22.845
  219    H    GLY  30           HN       GLY  30  24.276  14.861  26.305
  220    HA2  GLY  30           1HA      GLY  30  26.285  16.292  27.738
  221    HA3  GLY  30           2HA      GLY  30  24.736  16.892  27.179
  222    H    PHE  31           HN       PHE  31  23.078  14.856  28.524
  223    HA   PHE  31           HA       PHE  31  23.000  16.114  31.092
  224    HB2  PHE  31           2HB      PHE  31  20.831  15.598  30.382
  225    HB3  PHE  31           3HB      PHE  31  21.397  14.329  29.315
  226    HD1  PHE  31           HD2      PHE  31  20.356  15.108  32.751
  227    HD2  PHE  31           HD1      PHE  31  21.479  12.040  30.043
  228    HE1  PHE  31           HE2      PHE  31  19.513  13.377  34.362
  229    HE2  PHE  31           HE1      PHE  31  20.636  10.309  31.654
  230    HZ   PHE  31           HZ       PHE  31  19.663  10.999  33.794
  231    H    ILE  32           HN       ILE  32  24.219  13.090  29.702
  232    HA   ILE  32           HA       ILE  32  24.206  11.505  31.975
  233    HB   ILE  32           HB       ILE  32  24.874  11.160  29.407
  234   HG12  ILE  32          2HG1      ILE  32  26.197   9.243  31.246
  235   HG13  ILE  32          3HG1      ILE  32  24.508   9.571  31.576
  236   HG21  ILE  32          1HG2      ILE  32  27.565  10.986  30.763
  237   HG22  ILE  32          2HG2      ILE  32  27.173  10.849  29.032
  238   HG23  ILE  32          3HG2      ILE  32  27.045  12.424  29.852
  239   HD11  ILE  32          3HD1      ILE  32  25.642   8.712  28.873
  240   HD12  ILE  32          1HD1      ILE  32  24.747   7.671  30.006
  241   HD13  ILE  32          2HD1      ILE  32  23.925   9.037  29.215
  242    H    HIS  33           HN       HIS  33  26.525  14.013  30.841
  243    HA   HIS  33           HA       HIS  33  28.255  13.501  33.072
  244    HB2  HIS  33           2HB      HIS  33  29.653  15.210  32.140
  245    HB3  HIS  33           3HB      HIS  33  29.114  14.154  30.850
  246    HD1  HIS  33           HD1      HIS  33  28.454  17.621  32.282
  247    HD2  HIS  33           HD2      HIS  33  27.728  15.403  28.796
  248    HE1  HIS  33           HE1      HIS  33  27.518  19.266  30.571
  249    H    GLY  34           HN       GLY  34  25.330  15.207  32.510
  250    HA2  GLY  34           1HA      GLY  34  24.239  16.099  34.453
  251    HA3  GLY  34           2HA      GLY  34  25.771  16.768  34.980
  Start of MODEL    7
    1    H1   VAL   1           HN       VAL   1   5.884  -0.587  -1.749
    2    HA   VAL   1           HA       VAL   1   3.898   0.420  -1.527
    3    HB   VAL   1           HB       VAL   1   4.962   1.716   0.947
    4   HG11  VAL   1          1HG1      VAL   1   2.815   1.647   1.550
    5   HG12  VAL   1          2HG1      VAL   1   2.424   1.006  -0.064
    6   HG13  VAL   1          3HG1      VAL   1   2.750  -0.112   1.283
    7   HG21  VAL   1          3HG2      VAL   1   4.731  -1.292   0.597
    8   HG22  VAL   1          1HG2      VAL   1   6.253  -0.381   0.744
    9   HG23  VAL   1          2HG2      VAL   1   5.108  -0.426   2.106
   10    H    PHE   2           HN       PHE   2   3.581   3.003   0.120
   11    HA   PHE   2           HA       PHE   2   3.882   4.743  -2.163
   12    HB2  PHE   2           2HB      PHE   2   1.788   4.887  -0.961
   13    HB3  PHE   2           3HB      PHE   2   2.578   4.755   0.597
   14    HD1  PHE   2           HD1      PHE   2   3.717   6.714   1.580
   15    HD2  PHE   2           HD2      PHE   2   1.531   7.013  -2.045
   16    HE1  PHE   2           HE1      PHE   2   3.661   9.212   1.820
   17    HE2  PHE   2           HE2      PHE   2   1.476   9.511  -1.806
   18    HZ   PHE   2           HZ       PHE   2   2.542  10.581   0.124
   19    H    HIS   3           HN       HIS   3   6.040   3.719   0.071
   20    HA   HIS   3           HA       HIS   3   7.766   5.852  -0.310
   21    HB2  HIS   3           2HB      HIS   3   6.743   7.305   1.124
   22    HB3  HIS   3           3HB      HIS   3   6.046   6.035   2.111
   23    HD1  HIS   3           HD1      HIS   3   8.270   8.660   2.551
   24    HD2  HIS   3           HD2      HIS   3   8.568   4.561   3.389
   25    HE1  HIS   3           HE1      HIS   3  10.086   8.424   4.327
   26    H    ALA   4           HN       ALA   4   6.664   3.130   1.748
   27    HA   ALA   4           HA       ALA   4   8.963   2.446   3.018
   28    HB1  ALA   4           1HB      ALA   4   7.768   0.046   2.027
   29    HB2  ALA   4           2HB      ALA   4   7.560   0.803   3.625
   30    HB3  ALA   4           3HB      ALA   4   6.463   1.228   2.290
   31    H    TYR   5           HN       TYR   5   8.123   2.066  -0.437
   32    HA   TYR   5           HA       TYR   5  10.328   0.382  -1.038
   33    HB2  TYR   5           2HB      TYR   5   9.425   0.649  -3.251
   34    HB3  TYR   5           3HB      TYR   5   8.019   0.946  -2.248
   35    HD1  TYR   5           HD1      TYR   5   8.628   3.737  -1.303
   36    HD2  TYR   5           HD2      TYR   5   8.983   1.940  -5.169
   37    HE1  TYR   5           HE1      TYR   5   8.333   6.014  -2.397
   38    HE2  TYR   5           HE2      TYR   5   8.687   4.222  -6.250
   39    HH   TYR   5           HH       TYR   5   8.432   7.140  -4.257
   40    H    SER   6           HN       SER   6  11.534   1.506  -3.274
   41    HA   SER   6           HA       SER   6  13.423   2.573  -3.635
   42    HB2  SER   6           2HB      SER   6  11.566   4.879  -2.911
   43    HB3  SER   6           3HB      SER   6  13.118   5.105  -3.692
   44    HG   SER   6           HG       SER   6  11.481   3.185  -4.936
   45    H    ALA   7           HN       ALA   7  14.765   1.761  -1.904
   46    HA   ALA   7           HA       ALA   7  14.748   2.791   0.684
   47    HB1  ALA   7           1HB      ALA   7  17.381   1.922  -0.062
   48    HB2  ALA   7           2HB      ALA   7  16.153   1.053   0.889
   49    HB3  ALA   7           3HB      ALA   7  16.195   0.880  -0.882
   50    H    ARG   8           HN       ARG   8  16.294   3.882  -2.346
   51    HA   ARG   8           HA       ARG   8  18.109   5.605  -1.189
   52    HB2  ARG   8           2HB      ARG   8  17.077   5.009  -3.843
   53    HB3  ARG   8           3HB      ARG   8  17.196   6.748  -3.664
   54    HG2  ARG   8           2HG      ARG   8  19.303   5.575  -4.537
   55    HG3  ARG   8           3HG      ARG   8  19.544   6.658  -3.180
   56    HD2  ARG   8           2HD      ARG   8  20.581   4.195  -3.160
   57    HD3  ARG   8           3HD      ARG   8  19.981   4.923  -1.683
   58    HE   ARG   8           HE       ARG   8  18.094   3.482  -1.730
   59   HH11  ARG   8          2HH2      ARG   8  20.021   3.111  -4.680
   60   HH12  ARG   8          1HH2      ARG   8  19.216   1.659  -5.172
   61   HH22  ARG   8          HH1       ARG   8  17.461   0.769  -3.804
   62    H    GLY   9           HN       GLY   9  14.677   5.687  -1.227
   63    HA2  GLY   9           1HA      GLY   9  14.562   8.619  -0.999
   64    HA3  GLY   9           2HA      GLY   9  13.216   7.537  -1.295
   65    H    VAL  10           HN       VAL  10  13.893   5.521   0.722
   66    HA   VAL  10           HA       VAL  10  12.670   6.762   2.948
   67    HB   VAL  10           HB       VAL  10  12.708   4.288   2.011
   68   HG11  VAL  10          1HG1      VAL  10  15.048   3.821   2.370
   69   HG12  VAL  10          2HG1      VAL  10  14.926   4.290   4.083
   70   HG13  VAL  10          3HG1      VAL  10  14.092   2.830   3.498
   71   HG21  VAL  10          3HG2      VAL  10  11.112   4.648   3.616
   72   HG22  VAL  10          1HG2      VAL  10  12.217   3.597   4.535
   73   HG23  VAL  10          2HG2      VAL  10  12.267   5.361   4.768
   74    H    ARG  11           HN       ARG  11  16.007   5.508   2.287
   75    HA   ARG  11           HA       ARG  11  17.013   6.105   4.767
   76    HB2  ARG  11           2HB      ARG  11  19.197   5.815   3.761
   77    HB3  ARG  11           3HB      ARG  11  18.112   4.733   2.910
   78    HG2  ARG  11           2HG      ARG  11  17.801   6.593   1.162
   79    HG3  ARG  11           3HG      ARG  11  19.098   7.460   1.961
   80    HD2  ARG  11           2HD      ARG  11  20.479   5.243   1.670
   81    HD3  ARG  11           3HD      ARG  11  19.242   4.787   0.516
   82    HE   ARG  11           HE       ARG  11  19.868   7.269  -0.394
   83   HH11  ARG  11          2HH2      ARG  11  21.974   4.598   0.598
   84   HH12  ARG  11          1HH2      ARG  11  23.261   5.052  -0.468
   85   HH22  ARG  11          HH1       ARG  11  22.999   6.979  -1.869
   86    H    ASN  12           HN       ASN  12  16.674   8.094   1.784
   87    HA   ASN  12           HA       ASN  12  18.242  10.207   2.546
   88    HB2  ASN  12           2HB      ASN  12  16.024   9.716   0.622
   89    HB3  ASN  12           3HB      ASN  12  16.143  11.391   1.123
   90   HD21  ASN  12          1HD2      ASN  12  18.202   8.659   0.137
   91   HD22  ASN  12          2HD2      ASN  12  19.307   9.559  -0.849
   92    H    ASN  13           HN       ASN  13  15.123   9.075   3.692
   93    HA   ASN  13           HA       ASN  13  14.392  11.640   4.753
   94    HB2  ASN  13           2HB      ASN  13  13.045   8.963   5.341
   95    HB3  ASN  13           3HB      ASN  13  12.324  10.559   5.419
   96   HD21  ASN  13          1HD2      ASN  13  13.474  11.602   3.036
   97   HD22  ASN  13          2HD2      ASN  13  12.715  10.848   1.674
   98    H    TYR  14           HN       TYR  14  16.221   8.807   5.604
   99    HA   TYR  14           HA       TYR  14  15.750   8.952   8.435
  100    HB2  TYR  14           2HB      TYR  14  16.670   6.838   8.144
  101    HB3  TYR  14           3HB      TYR  14  16.825   7.191   6.434
  102    HD1  TYR  14           HD1      TYR  14  18.630   8.067   9.617
  103    HD2  TYR  14           HD2      TYR  14  18.926   6.875   5.518
  104    HE1  TYR  14           HE1      TYR  14  21.163   7.970   9.820
  105    HE2  TYR  14           HE2      TYR  14  21.457   6.782   5.736
  106    HH   TYR  14           HH       TYR  14  23.101   6.477   7.490
  107    H    LYS  15           HN       LYS  15  18.366   9.877   6.115
  108    HA   LYS  15           HA       LYS  15  20.229  10.665   8.006
  109    HB2  LYS  15           2HB      LYS  15  21.042  12.156   6.069
  110    HB3  LYS  15           3HB      LYS  15  21.026  10.419   5.836
  111    HG2  LYS  15           2HG      LYS  15  19.500  10.562   4.154
  112    HG3  LYS  15           3HG      LYS  15  18.437  11.580   5.104
  113    HD2  LYS  15           2HD      LYS  15  20.943  12.875   4.080
  114    HD3  LYS  15           3HD      LYS  15  19.742  12.455   2.875
  115    HE2  LYS  15           2HE      LYS  15  18.202  14.001   3.657
  116    HE3  LYS  15           3HE      LYS  15  18.679  13.797   5.331
  117    HZ1  LYS  15           2HZ      LYS  15  20.888  14.915   4.243
  118    HZ3  LYS  15           1HZ      LYS  15  19.723  15.764   5.000
  119    H    SER  16           HN       SER  16  17.144  12.024   7.177
  120    HA   SER  16           HA       SER  16  17.788  14.683   7.852
  121    HB2  SER  16           2HB      SER  16  15.756  13.629   6.489
  122    HB3  SER  16           3HB      SER  16  14.988  13.569   8.063
  123    HG   SER  16           HG       SER  16  14.833  15.734   8.133
  124    H    ALA  17           HN       ALA  17  16.091  11.951   9.543
  125    HA   ALA  17           HA       ALA  17  15.646  13.364  11.925
  126    HB1  ALA  17           1HB      ALA  17  15.215  11.096  12.844
  127    HB2  ALA  17           2HB      ALA  17  14.406  11.348  11.278
  128    HB3  ALA  17           3HB      ALA  17  15.898  10.381  11.364
  129    H    VAL  18           HN       VAL  18  18.533  12.236  10.447
  130    HA   VAL  18           HA       VAL  18  19.921  11.616  12.873
  131    HB   VAL  18           HB       VAL  18  20.572  11.851   9.963
  132   HG11  VAL  18          1HG1      VAL  18  22.589  12.732  10.453
  133   HG12  VAL  18          2HG1      VAL  18  22.456  12.334  12.183
  134   HG13  VAL  18          3HG1      VAL  18  22.979  11.091  11.021
  135   HG21  VAL  18          3HG2      VAL  18  21.708   9.550  11.028
  136   HG22  VAL  18          1HG2      VAL  18  20.204   9.745  11.959
  137   HG23  VAL  18          2HG2      VAL  18  20.146   9.662  10.182
  138    H    GLY  19           HN       GLY  19  19.282  14.465  10.850
  139    HA2  GLY  19           1HA      GLY  19  21.341  16.145  11.613
  140    HA3  GLY  19           2HA      GLY  19  19.719  16.645  11.178
  141    HA   PRO  20           HA       PRO  20  18.754  17.411  15.353
  142    HB2  PRO  20           2HB      PRO  20  16.361  16.208  15.895
  143    HB3  PRO  20           3HB      PRO  20  16.499  17.703  14.991
  144    HG2  PRO  20           2HG      PRO  20  15.922  14.980  13.995
  145    HG3  PRO  20           3HG      PRO  20  15.650  16.519  13.203
  146    HD2  PRO  20           2HD      PRO  20  17.765  14.660  12.658
  147    HD3  PRO  20           3HD      PRO  20  17.558  16.249  11.949
  148    H    ALA  21           HN       ALA  21  18.861  14.063  14.577
  149    HA   ALA  21           HA       ALA  21  18.704  12.971  17.097
  150    HB1  ALA  21           1HB      ALA  21  20.356  12.196  14.662
  151    HB2  ALA  21           2HB      ALA  21  20.132  11.152  16.086
  152    HB3  ALA  21           3HB      ALA  21  18.730  11.616  15.094
  153    H    ASP  22           HN       ASP  22  21.181  15.007  15.648
  154    HA   ASP  22           HA       ASP  22  23.276  14.180  17.308
  155    HB2  ASP  22           2HB      ASP  22  23.058  15.789  15.106
  156    HB3  ASP  22           3HB      ASP  22  23.168  17.020  16.348
  157    HD2  ASP  22           HD2      ASP  22  26.441  15.638  14.995
  158    H    TRP  23           HN       TRP  23  20.606  16.559  17.508
  159    HA   TRP  23           HA       TRP  23  21.638  17.962  19.753
  160    HB2  TRP  23           2HB      TRP  23  19.767  19.251  19.613
  161    HB3  TRP  23           3HB      TRP  23  19.891  18.672  17.963
  162    HD1  TRP  23           HD1      TRP  23  17.640  17.742  17.026
  163    HE1  TRP  23           HE1      TRP  23  15.362  16.772  17.941
  164    HE3  TRP  23           HE3      TRP  23  18.978  17.805  21.931
  165    HZ2  TRP  23           HZ2      TRP  23  14.398  16.154  20.555
  166    HZ3  TRP  23           HZ3      TRP  23  17.310  17.002  23.601
  167    HH2  TRP  23           HH2      TRP  23  15.088  16.196  22.981
  168    H    VAL  24           HN       VAL  24  19.111  15.402  19.235
  169    HA   VAL  24           HA       VAL  24  18.413  15.096  21.897
  170    HB   VAL  24           HB       VAL  24  17.758  13.992  19.434
  171   HG11  VAL  24          1HG1      VAL  24  19.351  12.202  19.625
  172   HG12  VAL  24          2HG1      VAL  24  18.827  11.840  21.287
  173   HG13  VAL  24          3HG1      VAL  24  17.730  11.528  19.920
  174   HG21  VAL  24          3HG2      VAL  24  15.880  14.214  20.643
  175   HG22  VAL  24          1HG2      VAL  24  16.230  12.578  21.252
  176   HG23  VAL  24          2HG2      VAL  24  16.742  14.004  22.186
  177    H    ILE  25           HN       ILE  25  20.891  13.326  19.921
  178    HA   ILE  25           HA       ILE  25  21.769  11.751  22.076
  179    HB   ILE  25           HB       ILE  25  22.063  11.604  19.452
  180   HG12  ILE  25          2HG1      ILE  25  24.415  10.505  20.878
  181   HG13  ILE  25          3HG1      ILE  25  22.861  10.124  21.594
  182   HG21  ILE  25          1HG2      ILE  25  23.543  13.687  19.515
  183   HG22  ILE  25          2HG2      ILE  25  24.791  12.635  20.225
  184   HG23  ILE  25          3HG2      ILE  25  24.144  12.280  18.605
  185   HD11  ILE  25          3HD1      ILE  25  23.672   8.466  19.838
  186   HD12  ILE  25          1HD1      ILE  25  22.049   9.131  19.539
  187   HD13  ILE  25          2HD1      ILE  25  23.445   9.749  18.625
  188    H    SER  26           HN       SER  26  22.546  15.030  20.922
  189    HA   SER  26           HA       SER  26  24.917  15.270  22.376
  190    HB2  SER  26           2HB      SER  26  24.628  16.838  20.635
  191    HB3  SER  26           3HB      SER  26  22.977  17.204  21.096
  192    HG   SER  26           HG       SER  26  25.392  17.984  22.490
  193    H    ALA  27           HN       ALA  27  21.453  15.824  23.109
  194    HA   ALA  27           HA       ALA  27  21.917  17.182  25.554
  195    HB1  ALA  27           1HB      ALA  27  19.656  17.405  25.540
  196    HB2  ALA  27           2HB      ALA  27  19.783  16.788  23.875
  197    HB3  ALA  27           3HB      ALA  27  19.389  15.677  25.209
  198    H    VAL  28           HN       VAL  28  21.692  13.782  24.518
  199    HA   VAL  28           HA       VAL  28  21.312  12.728  27.115
  200    HB   VAL  28           HB       VAL  28  22.377  11.523  24.554
  201   HG11  VAL  28          1HG1      VAL  28  21.131   9.771  26.590
  202   HG12  VAL  28          2HG1      VAL  28  22.532   9.488  25.528
  203   HG13  VAL  28          3HG1      VAL  28  22.725  10.433  27.024
  204   HG21  VAL  28          3HG2      VAL  28  19.768  10.598  25.326
  205   HG22  VAL  28          1HG2      VAL  28  19.773  12.378  25.294
  206   HG23  VAL  28          2HG2      VAL  28  20.264  11.460  23.850
  207    H    ARG  29           HN       ARG  29  24.216  13.087  24.963
  208    HA   ARG  29           HA       ARG  29  25.938  12.119  26.945
  209    HB2  ARG  29           2HB      ARG  29  27.744  12.971  25.414
  210    HB3  ARG  29           3HB      ARG  29  26.548  12.011  24.566
  211    HG2  ARG  29           2HG      ARG  29  25.393  14.457  24.278
  212    HG3  ARG  29           3HG      ARG  29  27.063  14.968  24.425
  213    HD2  ARG  29           2HD      ARG  29  25.732  13.459  22.223
  214    HD3  ARG  29           3HD      ARG  29  27.075  14.582  22.149
  215    HE   ARG  29           HE       ARG  29  27.241  11.670  22.638
  216   HH11  ARG  29          2HH2      ARG  29  28.951  14.773  22.614
  217   HH12  ARG  29          1HH2      ARG  29  30.522  14.048  22.529
  218   HH22  ARG  29          HH1       ARG  29  30.711  11.660  22.478
  219    H    GLY  30           HN       GLY  30  24.523  15.260  26.182
  220    HA2  GLY  30           1HA      GLY  30  26.474  16.885  27.481
  221    HA3  GLY  30           2HA      GLY  30  24.854  17.341  26.994
  222    H    PHE  31           HN       PHE  31  23.446  15.203  28.462
  223    HA   PHE  31           HA       PHE  31  23.394  16.506  31.007
  224    HB2  PHE  31           2HB      PHE  31  21.243  15.794  30.423
  225    HB3  PHE  31           3HB      PHE  31  21.859  14.554  29.349
  226    HD1  PHE  31           HD1      PHE  31  20.932  15.318  32.821
  227    HD2  PHE  31           HD2      PHE  31  22.175  12.296  30.113
  228    HE1  PHE  31           HE1      PHE  31  20.324  13.559  34.505
  229    HE2  PHE  31           HE2      PHE  31  21.567  10.537  31.797
  230    HZ   PHE  31           HZ       PHE  31  20.649  11.189  33.973
  231    H    ILE  32           HN       ILE  32  24.792  13.565  29.608
  232    HA   ILE  32           HA       ILE  32  25.031  12.035  31.906
  233    HB   ILE  32           HB       ILE  32  25.593  11.691  29.312
  234   HG12  ILE  32          2HG1      ILE  32  27.167   9.932  31.111
  235   HG13  ILE  32          3HG1      ILE  32  25.475  10.124  31.525
  236   HG21  ILE  32          1HG2      ILE  32  27.669  13.142  29.619
  237   HG22  ILE  32          2HG2      ILE  32  28.355  11.774  30.528
  238   HG23  ILE  32          3HG2      ILE  32  27.888  11.565  28.823
  239   HD11  ILE  32          3HD1      ILE  32  26.485   9.365  28.746
  240   HD12  ILE  32          1HD1      ILE  32  25.875   8.211  29.955
  241   HD13  ILE  32          2HD1      ILE  32  24.785   9.438  29.267
  242    H    HIS  33           HN       HIS  33  27.067  14.703  30.606
  243    HA   HIS  33           HA       HIS  33  28.947  14.387  32.750
  244    HB2  HIS  33           2HB      HIS  33  30.145  16.187  31.715
  245    HB3  HIS  33           3HB      HIS  33  29.632  15.061  30.474
  246    HD1  HIS  33           HD1      HIS  33  28.754  18.491  31.879
  247    HD2  HIS  33           HD2      HIS  33  28.040  16.145  28.476
  248    HE1  HIS  33           HE1      HIS  33  27.594  20.013  30.192
  249    H    GLY  34           HN       GLY  34  25.863  15.829  32.314
  250    HA2  GLY  34           1HA      GLY  34  26.284  17.450  34.747
  251    HA3  GLY  34           2HA      GLY  34  25.452  18.107  33.352
  Start of MODEL    8
    1    H1   VAL   1           HN       VAL   1   2.020   2.596   2.741
    2    HA   VAL   1           HA       VAL   1   4.697   1.881   2.619
    3    HB   VAL   1           HB       VAL   1   5.080   1.291   0.382
    4   HG11  VAL   1          1HG1      VAL   1   2.700  -0.223   1.488
    5   HG12  VAL   1          2HG1      VAL   1   3.593  -0.741   0.038
    6   HG13  VAL   1          3HG1      VAL   1   4.426  -0.640   1.607
    7   HG21  VAL   1          3HG2      VAL   1   2.577   2.644  -0.106
    8   HG22  VAL   1          1HG2      VAL   1   3.861   2.192  -1.253
    9   HG23  VAL   1          2HG2      VAL   1   2.561   1.038  -0.872
   10    H    PHE   2           HN       PHE   2   4.981   3.293  -0.102
   11    HA   PHE   2           HA       PHE   2   4.995   5.347  -0.938
   12    HB2  PHE   2           2HB      PHE   2   2.557   5.239   0.322
   13    HB3  PHE   2           3HB      PHE   2   3.318   6.445   1.340
   14    HD1  PHE   2           HD2      PHE   2   3.538   5.891  -2.344
   15    HD2  PHE   2           HD1      PHE   2   2.364   8.481   0.805
   16    HE1  PHE   2           HE2      PHE   2   2.966   7.669  -4.020
   17    HE2  PHE   2           HE1      PHE   2   1.791  10.259  -0.871
   18    HZ   PHE   2           HZ       PHE   2   2.099   9.832  -3.264
   19    H    HIS   3           HN       HIS   3   6.832   4.334   1.161
   20    HA   HIS   3           HA       HIS   3   8.277   6.661   1.576
   21    HB2  HIS   3           2HB      HIS   3   7.029   7.533   3.258
   22    HB3  HIS   3           3HB      HIS   3   6.348   5.986   3.720
   23    HD1  HIS   3           HD1      HIS   3   8.296   8.474   5.183
   24    HD2  HIS   3           HD2      HIS   3   8.800   4.322   4.856
   25    HE1  HIS   3           HE1      HIS   3   9.910   7.801   7.042
   26    H    ALA   4           HN       ALA   4   7.411   3.358   2.675
   27    HA   ALA   4           HA       ALA   4  10.030   2.789   3.641
   28    HB1  ALA   4           1HB      ALA   4   8.085   0.657   2.808
   29    HB2  ALA   4           2HB      ALA   4   9.116   0.755   4.255
   30    HB3  ALA   4           3HB      ALA   4   7.636   1.738   4.149
   31    H    TYR   5           HN       TYR   5   8.343   2.675   0.527
   32    HA   TYR   5           HA       TYR   5  10.106   0.855  -0.726
   33    HB2  TYR   5           2HB      TYR   5   8.784   1.497  -2.638
   34    HB3  TYR   5           3HB      TYR   5   7.691   1.803  -1.302
   35    HD1  TYR   5           HD2      TYR   5   9.162   4.379  -0.342
   36    HD2  TYR   5           HD1      TYR   5   7.776   3.056  -4.167
   37    HE1  TYR   5           HE2      TYR   5   8.920   6.794  -1.098
   38    HE2  TYR   5           HE1      TYR   5   7.539   5.476  -4.910
   39    HH   TYR   5           HH       TYR   5   7.761   8.077  -2.675
   40    H    SER   6           HN       SER   6  11.181   1.788  -2.943
   41    HA   SER   6           HA       SER   6  13.039   2.694  -3.647
   42    HB2  SER   6           2HB      SER   6  11.805   5.248  -2.523
   43    HB3  SER   6           3HB      SER   6  13.037   5.175  -3.766
   44    HG   SER   6           HG       SER   6  11.557   4.153  -5.188
   45    H    ALA   7           HN       ALA   7  14.709   1.806  -2.374
   46    HA   ALA   7           HA       ALA   7  15.228   2.515   0.265
   47    HB1  ALA   7           1HB      ALA   7  16.802   1.247  -1.980
   48    HB2  ALA   7           2HB      ALA   7  17.581   1.599  -0.419
   49    HB3  ALA   7           3HB      ALA   7  16.177   0.507  -0.487
   50    H    ARG   8           HN       ARG   8  16.171   3.979  -2.854
   51    HA   ARG   8           HA       ARG   8  18.183   5.583  -1.808
   52    HB2  ARG   8           2HB      ARG   8  16.601   5.408  -4.329
   53    HB3  ARG   8           3HB      ARG   8  17.209   7.014  -3.983
   54    HG2  ARG   8           2HG      ARG   8  19.031   6.125  -5.137
   55    HG3  ARG   8           3HG      ARG   8  19.492   5.742  -3.490
   56    HD2  ARG   8           2HD      ARG   8  17.938   3.801  -5.262
   57    HD3  ARG   8           3HD      ARG   8  19.688   3.814  -5.177
   58    HE   ARG   8           HE       ARG   8  18.300   3.634  -2.574
   59   HH11  ARG   8          2HH2      ARG   8  19.881   1.873  -5.211
   60   HH12  ARG   8          1HH2      ARG   8  20.169   0.456  -4.258
   61   HH22  ARG   8          HH1       ARG   8  19.454   0.414  -1.971
   62    H    GLY   9           HN       GLY   9  14.767   5.636  -1.405
   63    HA2  GLY   9           1HA      GLY   9  14.737   8.527  -0.817
   64    HA3  GLY   9           2HA      GLY   9  13.341   7.526  -1.164
   65    H    VAL  10           HN       VAL  10  14.360   5.235   0.524
   66    HA   VAL  10           HA       VAL  10  13.146   6.036   2.939
   67    HB   VAL  10           HB       VAL  10  13.446   3.716   1.707
   68   HG11  VAL  10          1HG1      VAL  10  15.844   3.531   1.901
   69   HG12  VAL  10          2HG1      VAL  10  15.767   3.776   3.662
   70   HG13  VAL  10          3HG1      VAL  10  15.094   2.295   2.940
   71   HG21  VAL  10          3HG2      VAL  10  12.030   3.247   3.365
   72   HG22  VAL  10          1HG2      VAL  10  13.428   2.935   4.422
   73   HG23  VAL  10          2HG2      VAL  10  12.700   4.558   4.365
   74    H    ARG  11           HN       ARG  11  16.573   5.331   1.989
   75    HA   ARG  11           HA       ARG  11  17.570   5.882   4.525
   76    HB2  ARG  11           2HB      ARG  11  19.788   5.964   3.368
   77    HB3  ARG  11           3HB      ARG  11  18.843   4.580   2.857
   78    HG2  ARG  11           2HG      ARG  11  17.992   6.248   0.952
   79    HG3  ARG  11           3HG      ARG  11  19.465   7.117   1.333
   80    HD2  ARG  11           2HD      ARG  11  20.435   4.540   1.175
   81    HD3  ARG  11           3HD      ARG  11  19.120   4.455   0.020
   82    HE   ARG  11           HE       ARG  11  20.273   5.941  -1.397
   83   HH11  ARG  11          2HH2      ARG  11  21.826   5.900   1.787
   84   HH12  ARG  11          1HH2      ARG  11  23.209   6.801   1.262
   85   HH22  ARG  11          HH1       ARG  11  23.347   7.514  -1.022
   86    H    ASN  12           HN       ASN  12  17.062   7.860   1.556
   87    HA   ASN  12           HA       ASN  12  18.478  10.076   2.326
   88    HB2  ASN  12           2HB      ASN  12  16.238   9.470   0.436
   89    HB3  ASN  12           3HB      ASN  12  16.356  11.154   0.905
   90   HD21  ASN  12          1HD2      ASN  12  18.493   8.441   0.019
   91   HD22  ASN  12          2HD2      ASN  12  19.540   9.324  -1.042
   92    H    ASN  13           HN       ASN  13  15.459   8.712   3.480
   93    HA   ASN  13           HA       ASN  13  14.546  11.212   4.557
   94    HB2  ASN  13           2HB      ASN  13  13.482   8.374   4.428
   95    HB3  ASN  13           3HB      ASN  13  12.812   9.460   5.630
   96   HD21  ASN  13          1HD2      ASN  13  14.081  10.342   2.457
   97   HD22  ASN  13          2HD2      ASN  13  12.597  10.897   1.758
   98    H    TYR  14           HN       TYR  14  16.583   8.521   5.381
   99    HA   TYR  14           HA       TYR  14  16.108   8.603   8.215
  100    HB2  TYR  14           2HB      TYR  14  17.185   6.568   7.900
  101    HB3  TYR  14           3HB      TYR  14  17.314   6.950   6.195
  102    HD1  TYR  14           HD2      TYR  14  19.044   7.931   9.389
  103    HD2  TYR  14           HD1      TYR  14  19.434   6.801   5.281
  104    HE1  TYR  14           HE2      TYR  14  21.576   8.026   9.595
  105    HE2  TYR  14           HE1      TYR  14  21.965   6.900   5.501
  106    HH   TYR  14           HH       TYR  14  23.537   8.452   7.511
  107    H    LYS  15           HN       LYS  15  18.649   9.738   5.903
  108    HA   LYS  15           HA       LYS  15  20.448  10.652   7.795
  109    HB2  LYS  15           2HB      LYS  15  21.536  11.700   6.023
  110    HB3  LYS  15           3HB      LYS  15  20.700  10.365   5.256
  111    HG2  LYS  15           2HG      LYS  15  20.066  12.079   3.821
  112    HG3  LYS  15           3HG      LYS  15  18.741  12.163   4.965
  113    HD2  LYS  15           2HD      LYS  15  20.464  13.814   6.247
  114    HD3  LYS  15           3HD      LYS  15  21.078  14.028   4.620
  115    HE2  LYS  15           2HE      LYS  15  18.104  14.139   4.850
  116    HE3  LYS  15           3HE      LYS  15  18.949  15.430   5.682
  117    HZ1  LYS  15           2HZ      LYS  15  20.088  15.976   3.617
  118    HZ3  LYS  15           1HZ      LYS  15  18.484  15.965   3.331
  119    H    SER  16           HN       SER  16  17.268  11.789   6.973
  120    HA   SER  16           HA       SER  16  17.714  14.477   7.694
  121    HB2  SER  16           2HB      SER  16  15.484  14.789   7.165
  122    HB3  SER  16           3HB      SER  16  15.766  13.287   6.307
  123    HG   SER  16           HG       SER  16  14.021  12.708   7.462
  124    H    ALA  17           HN       ALA  17  16.218  11.599   9.330
  125    HA   ALA  17           HA       ALA  17  15.653  12.937  11.731
  126    HB1  ALA  17           1HB      ALA  17  14.683  10.756  10.875
  127    HB2  ALA  17           2HB      ALA  17  16.217   9.976  11.328
  128    HB3  ALA  17           3HB      ALA  17  15.198  10.730  12.578
  129    H    VAL  18           HN       VAL  18  18.625  12.053  10.255
  130    HA   VAL  18           HA       VAL  18  20.043  11.504  12.681
  131    HB   VAL  18           HB       VAL  18  20.690  11.831   9.780
  132   HG11  VAL  18          1HG1      VAL  18  22.519  12.425  12.018
  133   HG12  VAL  18          2HG1      VAL  18  23.142  11.238  10.847
  134   HG13  VAL  18          3HG1      VAL  18  22.633  12.852  10.294
  135   HG21  VAL  18          3HG2      VAL  18  20.416   9.613   9.973
  136   HG22  VAL  18          1HG2      VAL  18  21.992   9.606  10.801
  137   HG23  VAL  18          2HG2      VAL  18  20.487   9.673  11.750
  138    H    GLY  19           HN       GLY  19  19.197  14.326  10.699
  139    HA2  GLY  19           1HA      GLY  19  21.121  16.145  11.500
  140    HA3  GLY  19           2HA      GLY  19  19.468  16.527  11.061
  141    HA   PRO  20           HA       PRO  20  18.424  17.155  15.241
  142    HB2  PRO  20           2HB      PRO  20  16.127  15.766  15.750
  143    HB3  PRO  20           3HB      PRO  20  16.156  17.280  14.868
  144    HG2  PRO  20           2HG      PRO  20  15.792  14.537  13.828
  145    HG3  PRO  20           3HG      PRO  20  15.409  16.064  13.057
  146    HD2  PRO  20           2HD      PRO  20  17.661  14.378  12.499
  147    HD3  PRO  20           3HD      PRO  20  17.339  15.958  11.813
  148    H    ALA  21           HN       ALA  21  18.789  13.836  14.416
  149    HA   ALA  21           HA       ALA  21  18.702  12.697  16.918
  150    HB1  ALA  21           1HB      ALA  21  18.841  11.379  14.895
  151    HB2  ALA  21           2HB      ALA  21  20.421  12.087  14.483
  152    HB3  ALA  21           3HB      ALA  21  20.269  11.007  15.890
  153    H    ASP  22           HN       ASP  22  21.025  14.936  15.516
  154    HA   ASP  22           HA       ASP  22  23.168  14.244  17.178
  155    HB2  ASP  22           2HB      ASP  22  22.840  15.866  14.998
  156    HB3  ASP  22           3HB      ASP  22  22.851  17.083  16.260
  157    HD2  ASP  22           HD2      ASP  22  26.198  15.158  15.282
  158    H    TRP  23           HN       TRP  23  20.324  16.411  17.395
  159    HA   TRP  23           HA       TRP  23  21.234  17.854  19.667
  160    HB2  TRP  23           2HB      TRP  23  19.272  19.000  19.533
  161    HB3  TRP  23           3HB      TRP  23  19.448  18.456  17.876
  162    HD1  TRP  23           HD1      TRP  23  17.278  17.373  16.912
  163    HE1  TRP  23           HE1      TRP  23  15.076  16.220  17.799
  164    HE3  TRP  23           HE3      TRP  23  18.584  17.464  21.825
  165    HZ2  TRP  23           HZ2      TRP  23  14.149  15.492  20.398
  166    HZ3  TRP  23           HZ3      TRP  23  16.973  16.512  23.473
  167    HH2  TRP  23           HH2      TRP  23  14.821  15.550  22.828
  168    H    VAL  24           HN       VAL  24  18.911  15.119  19.095
  169    HA   VAL  24           HA       VAL  24  18.225  14.720  21.747
  170    HB   VAL  24           HB       VAL  24  17.668  13.608  19.265
  171   HG11  VAL  24          1HG1      VAL  24  18.887  11.515  21.093
  172   HG12  VAL  24          2HG1      VAL  24  17.824  11.142  19.714
  173   HG13  VAL  24          3HG1      VAL  24  19.391  11.940  19.439
  174   HG21  VAL  24          3HG2      VAL  24  15.772  13.665  20.464
  175   HG22  VAL  24          1HG2      VAL  24  16.244  12.054  21.056
  176   HG23  VAL  24          2HG2      VAL  24  16.639  13.505  22.010
  177    H    ILE  25           HN       ILE  25  20.840  13.173  19.761
  178    HA   ILE  25           HA       ILE  25  21.824  11.637  21.898
  179    HB   ILE  25           HB       ILE  25  22.141  11.552  19.274
  180   HG12  ILE  25          2HG1      ILE  25  24.204  10.123  19.713
  181   HG13  ILE  25          3HG1      ILE  25  24.082  10.606  21.393
  182   HG21  ILE  25          1HG2      ILE  25  24.164  12.400  18.448
  183   HG22  ILE  25          2HG2      ILE  25  23.461  13.741  19.384
  184   HG23  ILE  25          3HG2      ILE  25  24.782  12.769  20.075
  185   HD11  ILE  25          3HD1      ILE  25  22.489   9.040  21.744
  186   HD12  ILE  25          1HD1      ILE  25  21.453   9.805  20.515
  187   HD13  ILE  25          2HD1      ILE  25  22.618   8.545  20.039
  188    H    SER  26           HN       SER  26  22.355  14.982  20.799
  189    HA   SER  26           HA       SER  26  24.694  15.379  22.271
  190    HB2  SER  26           2HB      SER  26  24.296  16.947  20.552
  191    HB3  SER  26           3HB      SER  26  22.620  17.179  21.007
  192    HG   SER  26           HG       SER  26  24.786  18.624  21.773
  193    H    ALA  27           HN       ALA  27  21.194  15.658  22.990
  194    HA   ALA  27           HA       ALA  27  21.541  17.010  25.458
  195    HB1  ALA  27           1HB      ALA  27  19.102  15.637  25.529
  196    HB2  ALA  27           2HB      ALA  27  19.367  17.296  24.940
  197    HB3  ALA  27           3HB      ALA  27  19.387  15.932  23.797
  198    H    VAL  28           HN       VAL  28  21.579  13.619  24.370
  199    HA   VAL  28           HA       VAL  28  21.267  12.499  26.949
  200    HB   VAL  28           HB       VAL  28  22.434  11.418  24.377
  201   HG11  VAL  28          1HG1      VAL  28  22.845  10.321  26.836
  202   HG12  VAL  28          2HG1      VAL  28  21.313   9.542  26.373
  203   HG13  VAL  28          3HG1      VAL  28  22.742   9.388  25.323
  204   HG21  VAL  28          3HG2      VAL  28  19.789  12.101  25.043
  205   HG22  VAL  28          1HG2      VAL  28  20.340  11.123  23.662
  206   HG23  VAL  28          2HG2      VAL  28  19.872  10.328  25.185
  207    H    ARG  29           HN       ARG  29  24.146  13.109  24.821
  208    HA   ARG  29           HA       ARG  29  25.926  12.245  26.800
  209    HB2  ARG  29           2HB      ARG  29  27.671  13.255  25.294
  210    HB3  ARG  29           3HB      ARG  29  26.556  12.220  24.424
  211    HG2  ARG  29           2HG      ARG  29  25.220  14.575  24.165
  212    HG3  ARG  29           3HG      ARG  29  26.846  15.208  24.330
  213    HD2  ARG  29           2HD      ARG  29  25.644  13.637  22.098
  214    HD3  ARG  29           3HD      ARG  29  26.899  14.860  22.048
  215    HE   ARG  29           HE       ARG  29  27.283  11.962  22.496
  216   HH11  ARG  29          2HH2      ARG  29  28.752  15.186  22.528
  217   HH12  ARG  29          1HH2      ARG  29  30.374  14.583  22.442
  218   HH22  ARG  29          HH1       ARG  29  30.744  12.217  22.358
  219    H    GLY  30           HN       GLY  30  24.282  15.281  26.074
  220    HA2  GLY  30           1HA      GLY  30  26.097  17.029  27.410
  221    HA3  GLY  30           2HA      GLY  30  24.449  17.369  26.920
  222    H    PHE  31           HN       PHE  31  23.199  15.108  28.346
  223    HA   PHE  31           HA       PHE  31  23.035  16.364  30.910
  224    HB2  PHE  31           2HB      PHE  31  20.947  15.500  30.300
  225    HB3  PHE  31           3HB      PHE  31  21.662  14.326  29.213
  226    HD1  PHE  31           HD1      PHE  31  20.662  14.965  32.690
  227    HD2  PHE  31           HD2      PHE  31  22.142  12.088  29.945
  228    HE1  PHE  31           HE1      PHE  31  20.180  13.140  34.344
  229    HE2  PHE  31           HE2      PHE  31  21.660  10.262  31.599
  230    HZ   PHE  31           HZ       PHE  31  20.684  10.810  33.778
  231    H    ILE  32           HN       ILE  32  24.660  13.559  29.477
  232    HA   ILE  32           HA       ILE  32  25.001  12.017  31.753
  233    HB   ILE  32           HB       ILE  32  25.602  11.756  29.159
  234   HG12  ILE  32          2HG1      ILE  32  27.295  10.095  30.942
  235   HG13  ILE  32          3HG1      ILE  32  25.591  10.151  31.347
  236   HG21  ILE  32          1HG2      ILE  32  27.560  13.356  29.501
  237   HG22  ILE  32          2HG2      ILE  32  28.343  12.029  30.393
  238   HG23  ILE  32          3HG2      ILE  32  27.903  11.813  28.682
  239   HD11  ILE  32          3HD1      ILE  32  25.003   9.513  29.009
  240   HD12  ILE  32          1HD1      ILE  32  26.735   9.450  28.603
  241   HD13  ILE  32          2HD1      ILE  32  26.053   8.298  29.777
  242    H    HIS  33           HN       HIS  33  26.836  14.852  30.507
  243    HA   HIS  33           HA       HIS  33  28.722  14.646  32.659
  244    HB2  HIS  33           2HB      HIS  33  29.786  16.547  31.659
  245    HB3  HIS  33           3HB      HIS  33  29.367  15.405  30.398
  246    HD1  HIS  33           HD1      HIS  33  28.224  18.737  31.846
  247    HD2  HIS  33           HD2      HIS  33  27.708  16.394  28.405
  248    HE1  HIS  33           HE1      HIS  33  26.962  20.192  30.173
  249    H    GLY  34           HN       GLY  34  25.540  15.857  32.223
  250    HA2  GLY  34           1HA      GLY  34  25.832  18.005  34.179
  251    HA3  GLY  34           2HA      GLY  34  24.405  17.591  33.250
  Start of MODEL    9
    1    H1   VAL   1           HN       VAL   1   2.092  -2.289  -1.718
    2    HA   VAL   1           HA       VAL   1   2.912   0.088  -2.467
    3    HB   VAL   1           HB       VAL   1   3.105   1.607  -0.692
    4   HG11  VAL   1          1HG1      VAL   1   0.716   1.796   0.189
    5   HG12  VAL   1          2HG1      VAL   1   0.913   1.748  -1.579
    6   HG13  VAL   1          3HG1      VAL   1   0.378   0.293  -0.704
    7   HG21  VAL   1          3HG2      VAL   1   1.848   0.449   1.558
    8   HG22  VAL   1          1HG2      VAL   1   3.019  -0.755   0.965
    9   HG23  VAL   1          2HG2      VAL   1   3.562   0.891   1.370
   10    H    PHE   2           HN       PHE   2   4.810   0.609  -0.099
   11    HA   PHE   2           HA       PHE   2   6.690  -0.194   0.758
   12    HB2  PHE   2           2HB      PHE   2   5.048  -2.410   0.716
   13    HB3  PHE   2           3HB      PHE   2   6.264  -2.949  -0.424
   14    HD1  PHE   2           HD1      PHE   2   6.420  -1.071   2.807
   15    HD2  PHE   2           HD2      PHE   2   7.717  -4.430   0.563
   16    HE1  PHE   2           HE1      PHE   2   7.895  -1.774   4.712
   17    HE2  PHE   2           HE2      PHE   2   9.193  -5.134   2.468
   18    HZ   PHE   2           HZ       PHE   2   9.264  -3.797   4.520
   19    H    HIS   3           HN       HIS   3   6.365   0.841  -2.004
   20    HA   HIS   3           HA       HIS   3   8.952   0.403  -2.896
   21    HB2  HIS   3           2HB      HIS   3   8.657  -1.671  -3.766
   22    HB3  HIS   3           3HB      HIS   3   6.926  -1.480  -3.957
   23    HD1  HIS   3           HD1      HIS   3   9.759  -1.984  -5.974
   24    HD2  HIS   3           HD2      HIS   3   6.517   0.667  -6.208
   25    HE1  HIS   3           HE1      HIS   3   9.629  -1.227  -8.407
   26    H    ALA   4           HN       ALA   4   5.538   1.189  -3.670
   27    HA   ALA   4           HA       ALA   4   5.876   2.768  -5.870
   28    HB1  ALA   4           1HB      ALA   4   3.889   4.077  -4.669
   29    HB2  ALA   4           2HB      ALA   4   3.666   2.421  -5.282
   30    HB3  ALA   4           3HB      ALA   4   3.970   2.695  -3.550
   31    H    TYR   5           HN       TYR   5   6.277   3.643  -2.382
   32    HA   TYR   5           HA       TYR   5   6.853   6.350  -2.872
   33    HB2  TYR   5           2HB      TYR   5   7.315   6.278  -0.506
   34    HB3  TYR   5           3HB      TYR   5   6.212   4.932  -0.718
   35    HD1  TYR   5           HD1      TYR   5   8.055   2.897  -1.923
   36    HD2  TYR   5           HD2      TYR   5   8.635   5.622   1.323
   37    HE1  TYR   5           HE1      TYR   5   9.780   1.330  -0.906
   38    HE2  TYR   5           HE2      TYR   5  10.357   4.046   2.329
   39    HH   TYR   5           HH       TYR   5  11.083   0.937   0.770
   40    H    SER   6           HN       SER   6   9.039   7.363  -2.211
   41    HA   SER   6           HA       SER   6  11.099   5.821  -3.572
   42    HB2  SER   6           2HB      SER   6  10.730   8.821  -3.198
   43    HB3  SER   6           3HB      SER   6  12.205   8.121  -3.836
   44    HG   SER   6           HG       SER   6  11.140   8.385  -5.702
   45    H    ALA   7           HN       ALA   7  12.020   4.646  -1.849
   46    HA   ALA   7           HA       ALA   7  12.387   5.632   0.721
   47    HB1  ALA   7           1HB      ALA   7  12.524   3.311   0.484
   48    HB2  ALA   7           2HB      ALA   7  13.586   3.416  -0.940
   49    HB3  ALA   7           3HB      ALA   7  14.234   3.764   0.681
   50    H    ARG   8           HN       ARG   8  14.322   5.943  -2.266
   51    HA   ARG   8           HA       ARG   8  16.653   6.789  -1.054
   52    HB2  ARG   8           2HB      ARG   8  15.440   6.917  -3.786
   53    HB3  ARG   8           3HB      ARG   8  16.681   8.115  -3.477
   54    HG2  ARG   8           2HG      ARG   8  17.963   6.315  -4.263
   55    HG3  ARG   8           3HG      ARG   8  18.075   6.086  -2.529
   56    HD2  ARG   8           2HD      ARG   8  15.918   4.726  -4.203
   57    HD3  ARG   8           3HD      ARG   8  17.489   3.996  -3.938
   58    HE   ARG   8           HE       ARG   8  16.078   4.875  -1.494
   59   HH11  ARG   8          2HH2      ARG   8  16.803   2.188  -3.687
   60   HH12  ARG   8          1HH2      ARG   8  16.401   0.968  -2.525
   61   HH22  ARG   8          HH1       ARG   8  15.665   1.625  -0.341
   62    H    GLY   9           HN       GLY   9  13.552   8.306  -1.365
   63    HA2  GLY   9           1HA      GLY   9  14.654  11.016  -1.106
   64    HA3  GLY   9           2HA      GLY   9  12.995  10.580  -1.465
   65    H    VAL  10           HN       VAL  10  12.766   8.484   0.615
   66    HA   VAL  10           HA       VAL  10  12.003  10.167   2.755
   67    HB   VAL  10           HB       VAL  10  11.149   7.829   1.857
   68   HG11  VAL  10          1HG1      VAL  10  13.112   7.068   4.044
   69   HG12  VAL  10          2HG1      VAL  10  11.818   6.009   3.436
   70   HG13  VAL  10          3HG1      VAL  10  13.125   6.533   2.347
   71   HG21  VAL  10          3HG2      VAL  10  10.483   9.456   3.920
   72   HG22  VAL  10          1HG2      VAL  10   9.667   7.913   3.571
   73   HG23  VAL  10          2HG2      VAL  10  10.939   7.986   4.814
   74    H    ARG  11           HN       ARG  11  14.652   7.735   2.286
   75    HA   ARG  11           HA       ARG  11  15.699   7.989   4.806
   76    HB2  ARG  11           2HB      ARG  11  17.633   6.848   3.932
   77    HB3  ARG  11           3HB      ARG  11  16.278   6.267   2.985
   78    HG2  ARG  11           2HG      ARG  11  16.835   8.068   1.250
   79    HG3  ARG  11           3HG      ARG  11  18.293   8.407   2.162
   80    HD2  ARG  11           2HD      ARG  11  17.598   5.978   0.524
   81    HD3  ARG  11           3HD      ARG  11  19.116   6.849   0.625
   82    HE   ARG  11           HE       ARG  11  18.184   4.722   2.449
   83   HH11  ARG  11          2HH2      ARG  11  20.550   7.299   1.888
   84   HH12  ARG  11          1HH2      ARG  11  21.700   6.658   3.013
   85   HH22  ARG  11          HH1       ARG  11  21.180   4.645   4.204
   86    H    ASN  12           HN       ASN  12  16.260   9.871   1.788
   87    HA   ASN  12           HA       ASN  12  18.468  11.271   2.610
   88    HB2  ASN  12           2HB      ASN  12  16.314  11.588   0.576
   89    HB3  ASN  12           3HB      ASN  12  17.041  13.107   1.060
   90   HD21  ASN  12          1HD2      ASN  12  17.929   9.771   0.199
   91   HD22  ASN  12          2HD2      ASN  12  19.340  10.149  -0.732
   92    H    ASN  13           HN       ASN  13  15.103  11.415   3.599
   93    HA   ASN  13           HA       ASN  13  15.333  14.099   4.589
   94    HB2  ASN  13           2HB      ASN  13  13.058  12.137   5.131
   95    HB3  ASN  13           3HB      ASN  13  12.982  13.888   5.150
   96   HD21  ASN  13          1HD2      ASN  13  14.550  14.352   2.823
   97   HD22  ASN  13          2HD2      ASN  13  13.629  13.894   1.429
   98    H    TYR  14           HN       TYR  14  15.940  10.821   5.568
   99    HA   TYR  14           HA       TYR  14  15.418  11.211   8.367
  100    HB2  TYR  14           2HB      TYR  14  15.502   8.900   8.143
  101    HB3  TYR  14           3HB      TYR  14  15.868   9.121   6.444
  102    HD1  TYR  14           HD2      TYR  14  17.697   9.366   9.722
  103    HD2  TYR  14           HD1      TYR  14  17.748   8.023   5.660
  104    HE1  TYR  14           HE2      TYR  14  20.000   8.348  10.079
  105    HE2  TYR  14           HE1      TYR  14  20.050   7.010   6.031
  106    HH   TYR  14           HH       TYR  14  21.600   7.180   9.225
  107    H    LYS  15           HN       LYS  15  18.301  11.036   6.190
  108    HA   LYS  15           HA       LYS  15  20.227  11.142   8.177
  109    HB2  LYS  15           2HB      LYS  15  21.630  12.164   6.275
  110    HB3  LYS  15           3HB      LYS  15  20.983  10.550   6.060
  111    HG2  LYS  15           2HG      LYS  15  19.637  11.192   4.329
  112    HG3  LYS  15           3HG      LYS  15  19.089  12.629   5.168
  113    HD2  LYS  15           2HD      LYS  15  21.919  12.574   4.110
  114    HD3  LYS  15           3HD      LYS  15  20.608  12.805   2.970
  115    HE2  LYS  15           2HE      LYS  15  19.759  14.683   4.538
  116    HE3  LYS  15           3HE      LYS  15  21.291  14.546   5.378
  117    HZ1  LYS  15           2HZ      LYS  15  20.934  15.233   2.512
  118    HZ3  LYS  15           1HZ      LYS  15  22.390  14.949   3.184
  119    H    SER  16           HN       SER  16  17.909  13.514   7.155
  120    HA   SER  16           HA       SER  16  19.456  15.769   7.837
  121    HB2  SER  16           2HB      SER  16  17.427  15.715   6.291
  122    HB3  SER  16           3HB      SER  16  16.418  15.543   7.714
  123    HG   SER  16           HG       SER  16  17.839  17.597   8.385
  124    H    ALA  17           HN       ALA  17  16.786  13.911   9.456
  125    HA   ALA  17           HA       ALA  17  16.779  15.464  11.792
  126    HB1  ALA  17           1HB      ALA  17  15.356  13.290  10.676
  127    HB2  ALA  17           2HB      ALA  17  15.998  12.703  12.229
  128    HB3  ALA  17           3HB      ALA  17  14.985  14.166  12.181
  129    H    VAL  18           HN       VAL  18  19.111  13.303  10.497
  130    HA   VAL  18           HA       VAL  18  20.048  12.292  13.006
  131    HB   VAL  18           HB       VAL  18  20.883  12.176  10.137
  132   HG11  VAL  18          1HG1      VAL  18  22.782  10.615  11.339
  133   HG12  VAL  18          2HG1      VAL  18  23.056  12.267  10.735
  134   HG13  VAL  18          3HG1      VAL  18  22.699  11.997  12.458
  135   HG21  VAL  18          3HG2      VAL  18  19.671  10.305  10.352
  136   HG22  VAL  18          1HG2      VAL  18  21.032   9.654  11.298
  137   HG23  VAL  18          2HG2      VAL  18  19.657  10.423  12.128
  138    H    GLY  19           HN       GLY  19  20.611  15.109  10.919
  139    HA2  GLY  19           1HA      GLY  19  23.106  15.932  11.781
  140    HA3  GLY  19           2HA      GLY  19  21.809  16.982  11.247
  141    HA   PRO  20           HA       PRO  20  20.990  18.184  15.350
  142    HB2  PRO  20           2HB      PRO  20  18.297  17.968  15.766
  143    HB3  PRO  20           3HB      PRO  20  19.024  19.276  14.855
  144    HG2  PRO  20           2HG      PRO  20  17.530  16.929  13.857
  145    HG3  PRO  20           3HG      PRO  20  17.887  18.434  13.033
  146    HD2  PRO  20           2HD      PRO  20  19.187  15.908  12.633
  147    HD3  PRO  20           3HD      PRO  20  19.619  17.438  11.896
  148    H    ALA  21           HN       ALA  21  19.887  15.010  14.619
  149    HA   ALA  21           HA       ALA  21  19.211  14.134  17.138
  150    HB1  ALA  21           1HB      ALA  21  18.832  12.803  15.154
  151    HB2  ALA  21           2HB      ALA  21  20.577  12.727  14.812
  152    HB3  ALA  21           3HB      ALA  21  19.912  11.885  16.232
  153    H    ASP  22           HN       ASP  22  22.335  15.063  15.812
  154    HA   ASP  22           HA       ASP  22  23.888  13.573  17.601
  155    HB2  ASP  22           2HB      ASP  22  24.392  15.078  15.372
  156    HB3  ASP  22           3HB      ASP  22  24.890  16.220  16.604
  157    HD2  ASP  22           HD2      ASP  22  26.670  12.744  15.960
  158    H    TRP  23           HN       TRP  23  22.284  16.776  17.618
  159    HA   TRP  23           HA       TRP  23  23.650  17.770  19.902
  160    HB2  TRP  23           2HB      TRP  23  22.399  19.654  19.638
  161    HB3  TRP  23           3HB      TRP  23  22.380  19.016  18.006
  162    HD1  TRP  23           HD1      TRP  23  19.993  18.955  16.953
  163    HE1  TRP  23           HE1      TRP  23  17.477  18.925  17.748
  164    HE3  TRP  23           HE3      TRP  23  21.019  18.677  21.925
  165    HZ2  TRP  23           HZ2      TRP  23  16.226  18.792  20.309
  166    HZ3  TRP  23           HZ3      TRP  23  19.093  18.601  23.506
  167    HH2  TRP  23           HH2      TRP  23  16.763  18.654  22.770
  168    H    VAL  24           HN       VAL  24  20.382  16.310  19.269
  169    HA   VAL  24           HA       VAL  24  19.491  16.369  21.889
  170    HB   VAL  24           HB       VAL  24  18.595  15.506  19.406
  171   HG11  VAL  24          1HG1      VAL  24  19.400  13.261  19.709
  172   HG12  VAL  24          2HG1      VAL  24  18.698  13.173  21.342
  173   HG13  VAL  24          3HG1      VAL  24  17.633  13.245  19.918
  174   HG21  VAL  24          3HG2      VAL  24  16.564  14.818  21.146
  175   HG22  VAL  24          1HG2      VAL  24  17.522  15.978  22.096
  176   HG23  VAL  24          2HG2      VAL  24  16.879  16.448  20.505
  177    H    ILE  25           HN       ILE  25  21.230  13.746  20.080
  178    HA   ILE  25           HA       ILE  25  21.355  12.028  22.300
  179    HB   ILE  25           HB       ILE  25  21.703  11.700  19.699
  180   HG12  ILE  25          2HG1      ILE  25  23.403   9.750  20.960
  181   HG13  ILE  25          3HG1      ILE  25  22.081  10.140  22.042
  182   HG21  ILE  25          1HG2      ILE  25  23.924  11.534  18.965
  183   HG22  ILE  25          2HG2      ILE  25  23.846  13.089  19.827
  184   HG23  ILE  25          3HG2      ILE  25  24.577  11.669  20.615
  185   HD11  ILE  25          3HD1      ILE  25  21.647   8.265  20.330
  186   HD12  ILE  25          1HD1      ILE  25  20.420   9.552  20.413
  187   HD13  ILE  25          2HD1      ILE  25  21.614   9.545  19.093
  188    H    SER  26           HN       SER  26  23.348  14.749  21.156
  189    HA   SER  26           HA       SER  26  25.564  14.143  22.741
  190    HB2  SER  26           2HB      SER  26  25.963  15.650  20.969
  191    HB3  SER  26           3HB      SER  26  24.545  16.614  21.330
  192    HG   SER  26           HG       SER  26  26.715  17.533  21.946
  193    H    ALA  27           HN       ALA  27  22.520  15.961  23.267
  194    HA   ALA  27           HA       ALA  27  23.333  17.128  25.719
  195    HB1  ALA  27           1HB      ALA  27  21.541  18.018  24.242
  196    HB2  ALA  27           2HB      ALA  27  20.555  16.580  24.599
  197    HB3  ALA  27           3HB      ALA  27  20.962  17.725  25.899
  198    H    VAL  28           HN       VAL  28  21.915  14.022  24.710
  199    HA   VAL  28           HA       VAL  28  21.043  13.266  27.292
  200    HB   VAL  28           HB       VAL  28  21.711  11.672  24.811
  201   HG11  VAL  28          1HG1      VAL  28  21.506  10.610  27.309
  202   HG12  VAL  28          2HG1      VAL  28  19.804  10.569  26.790
  203   HG13  VAL  28          3HG1      VAL  28  21.052   9.756  25.815
  204   HG21  VAL  28          3HG2      VAL  28  18.909  12.109  25.721
  205   HG22  VAL  28          1HG2      VAL  28  19.758  13.507  25.019
  206   HG23  VAL  28          2HG2      VAL  28  19.582  12.008  24.076
  207    H    ARG  29           HN       ARG  29  23.975  12.457  25.308
  208    HA   ARG  29           HA       ARG  29  25.116  10.985  27.398
  209    HB2  ARG  29           2HB      ARG  29  27.183  11.060  25.965
  210    HB3  ARG  29           3HB      ARG  29  25.760  10.583  25.060
  211    HG2  ARG  29           2HG      ARG  29  25.610  13.272  24.678
  212    HG3  ARG  29           3HG      ARG  29  27.340  13.134  24.916
  213    HD2  ARG  29           2HD      ARG  29  25.656  12.155  22.658
  214    HD3  ARG  29           3HD      ARG  29  27.321  12.699  22.649
  215    HE   ARG  29           HE       ARG  29  26.372   9.949  23.180
  216   HH11  ARG  29          2HH2      ARG  29  29.109  12.199  23.218
  217   HH12  ARG  29          1HH2      ARG  29  30.301  10.943  23.232
  218   HH22  ARG  29          HH1       ARG  29  29.594   8.653  23.220
  219    H    GLY  30           HN       GLY  30  25.006  14.400  26.519
  220    HA2  GLY  30           1HA      GLY  30  27.353  15.230  27.911
  221    HA3  GLY  30           2HA      GLY  30  26.044  16.237  27.326
  222    H    PHE  31           HN       PHE  31  23.872  14.818  28.732
  223    HA   PHE  31           HA       PHE  31  24.179  16.129  31.256
  224    HB2  PHE  31           2HB      PHE  31  21.950  16.244  30.554
  225    HB3  PHE  31           3HB      PHE  31  22.115  14.830  29.533
  226    HD1  PHE  31           HD1      PHE  31  21.364  15.994  32.936
  227    HD2  PHE  31           HD2      PHE  31  21.534  12.641  30.341
  228    HE1  PHE  31           HE1      PHE  31  20.064  14.639  34.601
  229    HE2  PHE  31           HE2      PHE  31  20.234  11.286  32.006
  230    HZ   PHE  31           HZ       PHE  31  19.514  12.301  34.116
  231    H    ILE  32           HN       ILE  32  24.456  12.836  29.974
  232    HA   ILE  32           HA       ILE  32  23.996  11.401  32.299
  233    HB   ILE  32           HB       ILE  32  24.519  10.791  29.747
  234   HG12  ILE  32          2HG1      ILE  32  25.238   8.633  31.652
  235   HG13  ILE  32          3HG1      ILE  32  23.721   9.450  31.968
  236   HG21  ILE  32          1HG2      ILE  32  26.626   9.811  29.392
  237   HG22  ILE  32          2HG2      ILE  32  26.967  11.382  30.157
  238   HG23  ILE  32          3HG2      ILE  32  27.051   9.887  31.119
  239   HD11  ILE  32          3HD1      ILE  32  23.273   7.578  30.481
  240   HD12  ILE  32          1HD1      ILE  32  23.077   9.078  29.542
  241   HD13  ILE  32          2HD1      ILE  32  24.554   8.101  29.362
  242    H    HIS  33           HN       HIS  33  26.938  13.086  31.090
  243    HA   HIS  33           HA       HIS  33  28.456  12.167  33.345
  244    HB2  HIS  33           2HB      HIS  33  30.287  13.362  32.361
  245    HB3  HIS  33           3HB      HIS  33  29.456  12.466  31.105
  246    HD1  HIS  33           HD1      HIS  33  29.844  16.021  32.416
  247    HD2  HIS  33           HD2      HIS  33  28.480  13.996  29.005
  248    HE1  HIS  33           HE1      HIS  33  29.417  17.809  30.646
  249    H    GLY  34           HN       GLY  34  26.153  14.631  32.712
  250    HA2  GLY  34           1HA      GLY  34  27.272  16.622  34.477
  251    HA3  GLY  34           2HA      GLY  34  25.704  16.637  33.694
  Start of MODEL   10
    1    H1   VAL   1           HN       VAL   1   9.637   1.206   0.631
    2    HA   VAL   1           HA       VAL   1   8.334   0.493   2.719
    3    HB   VAL   1           HB       VAL   1   7.269   3.287   2.413
    4   HG11  VAL   1          1HG1      VAL   1   5.708   2.262   3.689
    5   HG12  VAL   1          2HG1      VAL   1   6.815   0.962   4.190
    6   HG13  VAL   1          3HG1      VAL   1   6.877   2.546   5.001
    7   HG21  VAL   1          3HG2      VAL   1   8.680   3.423   4.745
    8   HG22  VAL   1          1HG2      VAL   1   9.774   2.444   3.738
    9   HG23  VAL   1          2HG2      VAL   1   9.250   4.052   3.180
   10    H    PHE   2           HN       PHE   2   5.753   0.530   2.452
   11    HA   PHE   2           HA       PHE   2   5.352  -0.110  -0.335
   12    HB2  PHE   2           2HB      PHE   2   4.457  -0.971   2.250
   13    HB3  PHE   2           3HB      PHE   2   3.042  -0.250   1.510
   14    HD1  PHE   2           HD2      PHE   2   3.001  -0.983  -1.199
   15    HD2  PHE   2           HD1      PHE   2   4.466  -3.259   2.069
   16    HE1  PHE   2           HE2      PHE   2   2.598  -3.096  -2.490
   17    HE2  PHE   2           HE1      PHE   2   4.062  -5.373   0.777
   18    HZ   PHE   2           HZ       PHE   2   3.133  -5.266  -1.487
   19    H    HIS   3           HN       HIS   3   5.757   2.687   0.088
   20    HA   HIS   3           HA       HIS   3   3.559   3.703  -1.259
   21    HB2  HIS   3           2HB      HIS   3   2.149   3.740   0.549
   22    HB3  HIS   3           3HB      HIS   3   3.444   3.939   1.712
   23    HD1  HIS   3           HD1      HIS   3   0.675   5.745   0.600
   24    HD2  HIS   3           HD2      HIS   3   4.719   6.764   1.056
   25    HE1  HIS   3           HE1      HIS   3   0.757   8.290   0.768
   26    H    ALA   4           HN       ALA   4   6.300   4.264   0.988
   27    HA   ALA   4           HA       ALA   4   6.817   6.874  -0.081
   28    HB1  ALA   4           1HB      ALA   4   8.354   7.027   1.627
   29    HB2  ALA   4           2HB      ALA   4   7.327   5.733   2.291
   30    HB3  ALA   4           3HB      ALA   4   8.856   5.326   1.475
   31    H    TYR   5           HN       TYR   5   7.952   3.510  -0.564
   32    HA   TYR   5           HA       TYR   5   9.462   2.640  -1.959
   33    HB2  TYR   5           2HB      TYR   5   7.763   4.689  -3.398
   34    HB3  TYR   5           3HB      TYR   5   9.144   4.102  -4.303
   35    HD1  TYR   5           HD1      TYR   5   6.410   2.644  -2.169
   36    HD2  TYR   5           HD2      TYR   5   8.739   2.339  -5.745
   37    HE1  TYR   5           HE1      TYR   5   5.089   0.585  -2.862
   38    HE2  TYR   5           HE2      TYR   5   7.410   0.281  -6.426
   39    HH   TYR   5           HH       TYR   5   5.361  -0.748  -6.028
   40    H    SER   6           HN       SER   6  11.027   3.540  -4.062
   41    HA   SER   6           HA       SER   6  13.103   4.240  -4.252
   42    HB2  SER   6           2HB      SER   6  11.657   6.848  -3.621
   43    HB3  SER   6           3HB      SER   6  13.277   6.782  -4.285
   44    HG   SER   6           HG       SER   6  12.092   6.890  -6.118
   45    H    ALA   7           HN       ALA   7  14.173   3.205  -2.468
   46    HA   ALA   7           HA       ALA   7  14.127   4.191   0.144
   47    HB1  ALA   7           1HB      ALA   7  16.412   2.665  -1.142
   48    HB2  ALA   7           2HB      ALA   7  15.843   2.594   0.543
   49    HB3  ALA   7           3HB      ALA   7  14.853   1.896  -0.761
   50    H    ARG   8           HN       ARG   8  16.076   5.007  -2.737
   51    HA   ARG   8           HA       ARG   8  18.075   6.365  -1.408
   52    HB2  ARG   8           2HB      ARG   8  17.165   5.984  -4.146
   53    HB3  ARG   8           3HB      ARG   8  17.583   7.671  -3.921
   54    HG2  ARG   8           2HG      ARG   8  19.504   6.137  -4.654
   55    HG3  ARG   8           3HG      ARG   8  19.830   7.151  -3.263
   56    HD2  ARG   8           2HD      ARG   8  20.401   4.543  -3.206
   57    HD3  ARG   8           3HD      ARG   8  19.822   5.359  -1.768
   58    HE   ARG   8           HE       ARG   8  17.718   4.281  -1.996
   59   HH11  ARG   8          2HH2      ARG   8  19.786   3.585  -4.787
   60   HH12  ARG   8          1HH2      ARG   8  18.778   2.303  -5.371
   61   HH22  ARG   8          HH1       ARG   8  16.785   1.736  -4.167
   62    H    GLY   9           HN       GLY   9  14.727   7.067  -1.714
   63    HA2  GLY   9           1HA      GLY   9  15.120   9.971  -1.441
   64    HA3  GLY   9           2HA      GLY   9  13.628   9.147  -1.849
   65    H    VAL  10           HN       VAL  10  13.780   7.039   0.179
   66    HA   VAL  10           HA       VAL  10  12.642   8.475   2.331
   67    HB   VAL  10           HB       VAL  10  12.294   6.042   1.361
   68   HG11  VAL  10          1HG1      VAL  10  14.478   5.151   1.863
   69   HG12  VAL  10          2HG1      VAL  10  14.332   5.626   3.572
   70   HG13  VAL  10          3HG1      VAL  10  13.286   4.346   2.911
   71   HG21  VAL  10          3HG2      VAL  10  10.681   6.652   2.861
   72   HG22  VAL  10          1HG2      VAL  10  11.534   5.445   3.853
   73   HG23  VAL  10          2HG2      VAL  10  11.859   7.180   4.087
   74    H    ARG  11           HN       ARG  11  15.735   6.633   1.894
   75    HA   ARG  11           HA       ARG  11  16.646   7.033   4.448
   76    HB2  ARG  11           2HB      ARG  11  18.790   6.317   3.612
   77    HB3  ARG  11           3HB      ARG  11  17.601   5.498   2.619
   78    HG2  ARG  11           2HG      ARG  11  17.832   7.413   0.930
   79    HG3  ARG  11           3HG      ARG  11  19.175   8.008   1.885
   80    HD2  ARG  11           2HD      ARG  11  18.996   5.507   0.209
   81    HD3  ARG  11           3HD      ARG  11  20.300   6.672   0.319
   82    HE   ARG  11           HE       ARG  11  19.869   4.357   2.070
   83   HH11  ARG  11          2HH2      ARG  11  21.480   7.497   1.755
   84   HH12  ARG  11          1HH2      ARG  11  22.695   7.130   2.934
   85   HH22  ARG  11          HH1       ARG  11  22.671   4.994   4.020
   86    H    ASN  12           HN       ASN  12  16.896   9.054   1.478
   87    HA   ASN  12           HA       ASN  12  18.764  10.843   2.379
   88    HB2  ASN  12           2HB      ASN  12  16.642  10.766   0.295
   89    HB3  ASN  12           3HB      ASN  12  17.018  12.391   0.830
   90   HD21  ASN  12          1HD2      ASN  12  18.640   9.341  -0.033
   91   HD22  ASN  12          2HD2      ASN  12  19.952  10.034  -0.927
   92    H    ASN  13           HN       ASN  13  15.416  10.301   3.285
   93    HA   ASN  13           HA       ASN  13  15.092  12.954   4.331
   94    HB2  ASN  13           2HB      ASN  13  13.239  10.570   4.782
   95    HB3  ASN  13           3HB      ASN  13  12.818  12.270   4.833
   96   HD21  ASN  13          1HD2      ASN  13  14.309  13.090   2.553
   97   HD22  ASN  13          2HD2      ASN  13  13.524  12.491   1.129
   98    H    TYR  14           HN       TYR  14  16.297   9.828   5.266
   99    HA   TYR  14           HA       TYR  14  15.663  10.058   8.060
  100    HB2  TYR  14           2HB      TYR  14  16.193   7.809   7.809
  101    HB3  TYR  14           3HB      TYR  14  16.522   8.125   6.117
  102    HD1  TYR  14           HD1      TYR  14  18.246   8.647   9.419
  103    HD2  TYR  14           HD2      TYR  14  18.583   7.424   5.333
  104    HE1  TYR  14           HE1      TYR  14  20.697   8.078   9.784
  105    HE2  TYR  14           HE2      TYR  14  21.033   6.860   5.712
  106    HH   TYR  14           HH       TYR  14  22.799   7.985   8.052
  107    H    LYS  15           HN       LYS  15  18.562  10.478   5.939
  108    HA   LYS  15           HA       LYS  15  20.400  10.902   7.967
  109    HB2  LYS  15           2HB      LYS  15  21.616  12.209   6.112
  110    HB3  LYS  15           3HB      LYS  15  21.290  10.507   5.857
  111    HG2  LYS  15           2HG      LYS  15  19.885  10.919   4.104
  112    HG3  LYS  15           3HG      LYS  15  19.048  12.199   4.960
  113    HD2  LYS  15           2HD      LYS  15  21.849  12.666   3.885
  114    HD3  LYS  15           3HD      LYS  15  20.465  12.793   2.817
  115    HE2  LYS  15           2HE      LYS  15  19.870  14.817   3.676
  116    HE3  LYS  15           3HE      LYS  15  19.963  14.228   5.323
  117    HZ1  LYS  15           2HZ      LYS  15  22.088  14.990   5.535
  118    HZ3  LYS  15           1HZ      LYS  15  21.691  15.993   4.315
  119    H    SER  16           HN       SER  16  17.687  12.808   6.953
  120    HA   SER  16           HA       SER  16  18.766  15.304   7.691
  121    HB2  SER  16           2HB      SER  16  16.580  14.519   6.263
  122    HB3  SER  16           3HB      SER  16  15.806  14.867   7.796
  123    HG   SER  16           HG       SER  16  16.166  16.666   6.073
  124    H    ALA  17           HN       ALA  17  16.471  12.954   9.246
  125    HA   ALA  17           HA       ALA  17  16.165  14.432  11.610
  126    HB1  ALA  17           1HB      ALA  17  14.512  12.828  11.178
  127    HB2  ALA  17           2HB      ALA  17  15.700  11.573  10.751
  128    HB3  ALA  17           3HB      ALA  17  15.481  12.049  12.452
  129    H    VAL  18           HN       VAL  18  18.860  12.756  10.302
  130    HA   VAL  18           HA       VAL  18  19.944  11.881  12.803
  131    HB   VAL  18           HB       VAL  18  20.811  11.976   9.941
  132   HG11  VAL  18          1HG1      VAL  18  22.608  12.071  12.283
  133   HG12  VAL  18          2HG1      VAL  18  22.947  10.754  11.136
  134   HG13  VAL  18          3HG1      VAL  18  22.927  12.442  10.572
  135   HG21  VAL  18          3HG2      VAL  18  19.902   9.989  11.884
  136   HG22  VAL  18          1HG2      VAL  18  19.949   9.915  10.106
  137   HG23  VAL  18          2HG2      VAL  18  21.397   9.496  11.053
  138    H    GLY  19           HN       GLY  19  19.985  14.800  10.788
  139    HA2  GLY  19           1HA      GLY  19  22.291  16.042  11.688
  140    HA3  GLY  19           2HA      GLY  19  20.829  16.849  11.157
  141    HA   PRO  20           HA       PRO  20  19.768  17.799  15.271
  142    HB2  PRO  20           2HB      PRO  20  17.158  17.085  15.652
  143    HB3  PRO  20           3HB      PRO  20  17.639  18.521  14.772
  144    HG2  PRO  20           2HG      PRO  20  16.610  15.959  13.716
  145    HG3  PRO  20           3HG      PRO  20  16.691  17.520  12.923
  146    HD2  PRO  20           2HD      PRO  20  18.436  15.284  12.494
  147    HD3  PRO  20           3HD      PRO  20  18.586  16.881  11.788
  148    H    ALA  21           HN       ALA  21  19.278  14.492  14.471
  149    HA   ALA  21           HA       ALA  21  18.763  13.469  16.980
  150    HB1  ALA  21           1HB      ALA  21  18.606  12.131  14.968
  151    HB2  ALA  21           2HB      ALA  21  20.338  12.354  14.627
  152    HB3  ALA  21           3HB      ALA  21  19.825  11.390  16.032
  153    H    ASP  22           HN       ASP  22  21.655  14.973  15.674
  154    HA   ASP  22           HA       ASP  22  23.448  13.737  17.450
  155    HB2  ASP  22           2HB      ASP  22  24.514  14.678  15.591
  156    HB3  ASP  22           3HB      ASP  22  23.476  16.089  15.575
  157    HD2  ASP  22           HD2      ASP  22  25.753  14.683  17.774
  158    H    TRP  23           HN       TRP  23  21.295  16.585  17.473
  159    HA   TRP  23           HA       TRP  23  22.502  17.861  19.706
  160    HB2  TRP  23           2HB      TRP  23  20.923  19.470  19.440
  161    HB3  TRP  23           3HB      TRP  23  20.947  18.789  17.825
  162    HD1  TRP  23           HD1      TRP  23  18.564  18.275  16.898
  163    HE1  TRP  23           HE1      TRP  23  16.137  17.800  17.820
  164    HE3  TRP  23           HE3      TRP  23  19.859  18.302  21.814
  165    HZ2  TRP  23           HZ2      TRP  23  15.056  17.496  20.444
  166    HZ3  TRP  23           HZ3      TRP  23  18.058  17.908  23.492
  167    HH2  TRP  23           HH2      TRP  23  15.726  17.514  22.875
  168    H    VAL  24           HN       VAL  24  19.540  15.815  19.190
  169    HA   VAL  24           HA       VAL  24  18.746  15.734  21.841
  170    HB   VAL  24           HB       VAL  24  17.934  14.703  19.394
  171   HG11  VAL  24          1HG1      VAL  24  19.145  12.644  19.673
  172   HG12  VAL  24          2HG1      VAL  24  18.526  12.442  21.329
  173   HG13  VAL  24          3HG1      VAL  24  17.418  12.308  19.943
  174   HG21  VAL  24          3HG2      VAL  24  16.890  15.000  22.119
  175   HG22  VAL  24          1HG2      VAL  24  16.112  15.320  20.550
  176   HG23  VAL  24          2HG2      VAL  24  16.128  13.669  21.215
  177    H    ILE  25           HN       ILE  25  20.870  13.457  19.976
  178    HA   ILE  25           HA       ILE  25  21.379  11.801  22.185
  179    HB   ILE  25           HB       ILE  25  21.713  11.547  19.570
  180   HG12  ILE  25          2HG1      ILE  25  23.758   9.920  20.753
  181   HG13  ILE  25          3HG1      ILE  25  22.446  10.083  21.903
  182   HG21  ILE  25          1HG2      ILE  25  24.576  11.980  20.394
  183   HG22  ILE  25          2HG2      ILE  25  23.879  11.826  18.764
  184   HG23  ILE  25          3HG2      ILE  25  23.598  13.304  19.716
  185   HD11  ILE  25          3HD1      ILE  25  20.857   9.123  20.444
  186   HD12  ILE  25          1HD1      ILE  25  21.828   9.486  18.997
  187   HD13  ILE  25          2HD1      ILE  25  22.326   8.179  20.098
  188    H    SER  26           HN       SER  26  22.791  14.848  21.005
  189    HA   SER  26           HA       SER  26  25.126  14.663  22.530
  190    HB2  SER  26           2HB      SER  26  25.198  16.210  20.749
  191    HB3  SER  26           3HB      SER  26  23.635  16.897  21.144
  192    HG   SER  26           HG       SER  26  26.133  17.666  22.001
  193    H    ALA  27           HN       ALA  27  21.817  15.911  23.126
  194    HA   ALA  27           HA       ALA  27  22.465  17.205  25.564
  195    HB1  ALA  27           1HB      ALA  27  20.315  17.905  25.425
  196    HB2  ALA  27           2HB      ALA  27  20.335  17.163  23.807
  197    HB3  ALA  27           3HB      ALA  27  19.696  16.252  25.196
  198    H    VAL  28           HN       VAL  28  21.593  13.897  24.576
  199    HA   VAL  28           HA       VAL  28  20.922  13.002  27.174
  200    HB   VAL  28           HB       VAL  28  21.806  11.548  24.674
  201   HG11  VAL  28          1HG1      VAL  28  20.165  10.132  26.693
  202   HG12  VAL  28          2HG1      VAL  28  21.511   9.546  25.686
  203   HG13  VAL  28          3HG1      VAL  28  21.846  10.468  27.171
  204   HG21  VAL  28          3HG2      VAL  28  19.479  12.985  25.140
  205   HG22  VAL  28          1HG2      VAL  28  19.703  11.712  23.916
  206   HG23  VAL  28          2HG2      VAL  28  19.009  11.307  25.505
  207    H    ARG  29           HN       ARG  29  23.908  12.720  25.126
  208    HA   ARG  29           HA       ARG  29  25.333  11.471  27.186
  209    HB2  ARG  29           2HB      ARG  29  27.324  11.908  25.710
  210    HB3  ARG  29           3HB      ARG  29  25.988  11.190  24.833
  211    HG2  ARG  29           2HG      ARG  29  25.360  13.810  24.464
  212    HG3  ARG  29           3HG      ARG  29  27.092  13.979  24.667
  213    HD2  ARG  29           2HD      ARG  29  25.561  12.720  22.438
  214    HD3  ARG  29           3HD      ARG  29  27.106  13.548  22.400
  215    HE   ARG  29           HE       ARG  29  26.662  10.674  22.938
  216   HH11  ARG  29          2HH2      ARG  29  28.964  13.367  22.931
  217   HH12  ARG  29          1HH2      ARG  29  30.358  12.338  22.917
  218   HH22  ARG  29          HH1       ARG  29  30.062   9.960  22.910
  219    H    GLY  30           HN       GLY  30  24.607  14.814  26.322
  220    HA2  GLY  30           1HA      GLY  30  26.801  16.043  27.669
  221    HA3  GLY  30           2HA      GLY  30  25.323  16.804  27.114
  222    H    PHE  31           HN       PHE  31  23.463  15.027  28.559
  223    HA   PHE  31           HA       PHE  31  23.587  16.372  31.080
  224    HB2  PHE  31           2HB      PHE  31  21.358  16.093  30.424
  225    HB3  PHE  31           3HB      PHE  31  21.749  14.729  29.395
  226    HD1  PHE  31           HD2      PHE  31  20.875  15.746  32.816
  227    HD2  PHE  31           HD1      PHE  31  21.577  12.473  30.207
  228    HE1  PHE  31           HE2      PHE  31  19.866  14.185  34.503
  229    HE2  PHE  31           HE1      PHE  31  20.568  10.912  31.895
  230    HZ   PHE  31           HZ       PHE  31  19.725  11.787  34.022
  231    H    ILE  32           HN       ILE  32  24.414  13.180  29.782
  232    HA   ILE  32           HA       ILE  32  24.260  11.686  32.111
  233    HB   ILE  32           HB       ILE  32  24.830  11.176  29.547
  234   HG12  ILE  32          2HG1      ILE  32  25.957   9.178  31.428
  235   HG13  ILE  32          3HG1      ILE  32  24.327   9.717  31.780
  236   HG21  ILE  32          1HG2      ILE  32  27.069  10.584  29.146
  237   HG22  ILE  32          2HG2      ILE  32  27.144  12.190  29.910
  238   HG23  ILE  32          3HG2      ILE  32  27.509  10.733  30.864
  239   HD11  ILE  32          3HD1      ILE  32  23.556   9.101  29.550
  240   HD12  ILE  32          1HD1      ILE  32  25.221   8.754  29.026
  241   HD13  ILE  32          2HD1      ILE  32  24.435   7.715  30.239
  242    H    HIS  33           HN       HIS  33  26.835  13.861  30.849
  243    HA   HIS  33           HA       HIS  33  28.536  13.224  33.070
  244    HB2  HIS  33           2HB      HIS  33  30.108  14.723  32.054
  245    HB3  HIS  33           3HB      HIS  33  29.422  13.694  30.812
  246    HD1  HIS  33           HD1      HIS  33  29.208  17.263  32.124
  247    HD2  HIS  33           HD2      HIS  33  28.148  15.026  28.737
  248    HE1  HIS  33           HE1      HIS  33  28.437  18.946  30.368
  249    H    GLY  34           HN       GLY  34  25.823  15.244  32.492
  250    HA2  GLY  34           1HA      GLY  34  26.493  17.527  33.998
  251    HA3  GLY  34           2HA      GLY  34  24.883  16.939  33.632
  Start of MODEL   11
    1    H1   VAL   1           HN       VAL   1   7.634  -0.467   6.240
    2    HA   VAL   1           HA       VAL   1   7.006   1.374   5.190
    3    HB   VAL   1           HB       VAL   1   8.406   2.250   3.330
    4   HG11  VAL   1          1HG1      VAL   1   9.247   1.659   6.066
    5   HG12  VAL   1          2HG1      VAL   1  10.626   1.890   4.965
    6   HG13  VAL   1          3HG1      VAL   1   9.391   3.162   5.123
    7   HG21  VAL   1          3HG2      VAL   1   9.105   0.225   2.238
    8   HG22  VAL   1          1HG2      VAL   1  10.558   1.046   2.857
    9   HG23  VAL   1          2HG2      VAL   1   9.897  -0.364   3.719
   10    H    PHE   2           HN       PHE   2   5.868   2.155   3.176
   11    HA   PHE   2           HA       PHE   2   5.422   0.381   1.047
   12    HB2  PHE   2           2HB      PHE   2   3.141  -0.343   1.664
   13    HB3  PHE   2           3HB      PHE   2   4.212  -0.786   2.979
   14    HD1  PHE   2           HD1      PHE   2   4.329   0.784   4.997
   15    HD2  PHE   2           HD2      PHE   2   1.275   1.017   2.060
   16    HE1  PHE   2           HE1      PHE   2   2.876   2.047   6.608
   17    HE2  PHE   2           HE2      PHE   2  -0.177   2.281   3.670
   18    HZ   PHE   2           HZ       PHE   2   0.641   2.781   5.925
   19    H    HIS   3           HN       HIS   3   6.128   3.085   1.202
   20    HA   HIS   3           HA       HIS   3   4.231   4.230  -0.460
   21    HB2  HIS   3           2HB      HIS   3   2.684   4.715   1.142
   22    HB3  HIS   3           3HB      HIS   3   3.863   4.780   2.437
   23    HD1  HIS   3           HD1      HIS   3   1.610   6.944   0.875
   24    HD2  HIS   3           HD2      HIS   3   5.693   7.275   1.778
   25    HE1  HIS   3           HE1      HIS   3   2.137   9.440   0.896
   26    H    ALA   4           HN       ALA   4   6.823   4.662   1.982
   27    HA   ALA   4           HA       ALA   4   7.806   7.097   1.138
   28    HB1  ALA   4           1HB      ALA   4   9.083   4.635   2.366
   29    HB2  ALA   4           2HB      ALA   4  10.005   6.126   2.060
   30    HB3  ALA   4           3HB      ALA   4   8.610   6.153   3.165
   31    H    TYR   5           HN       TYR   5   8.622   3.751  -0.002
   32    HA   TYR   5           HA       TYR   5   9.797   3.061  -1.768
   33    HB2  TYR   5           2HB      TYR   5   7.906   5.280  -2.641
   34    HB3  TYR   5           3HB      TYR   5   9.006   4.658  -3.856
   35    HD1  TYR   5           HD1      TYR   5   6.795   3.184  -1.190
   36    HD2  TYR   5           HD2      TYR   5   8.080   3.082  -5.270
   37    HE1  TYR   5           HE1      TYR   5   5.205   1.254  -1.651
   38    HE2  TYR   5           HE2      TYR   5   6.486   1.153  -5.716
   39    HH   TYR   5           HH       TYR   5   5.343  -0.529  -4.604
   40    H    SER   6           HN       SER   6  10.901   4.195  -4.037
   41    HA   SER   6           HA       SER   6  12.844   5.004  -4.632
   42    HB2  SER   6           2HB      SER   6  11.795   7.481  -3.191
   43    HB3  SER   6           3HB      SER   6  13.068   7.482  -4.395
   44    HG   SER   6           HG       SER   6  10.405   6.473  -4.910
   45    H    ALA   7           HN       ALA   7  14.409   3.800  -3.481
   46    HA   ALA   7           HA       ALA   7  14.988   4.144  -0.781
   47    HB1  ALA   7           1HB      ALA   7  17.265   3.115  -1.642
   48    HB2  ALA   7           2HB      ALA   7  15.766   2.157  -1.709
   49    HB3  ALA   7           3HB      ALA   7  16.377   2.958  -3.177
   50    H    ARG   8           HN       ARG   8  16.078   5.860  -3.719
   51    HA   ARG   8           HA       ARG   8  18.243   7.120  -2.526
   52    HB2  ARG   8           2HB      ARG   8  16.612   7.444  -5.010
   53    HB3  ARG   8           3HB      ARG   8  17.440   8.897  -4.488
   54    HG2  ARG   8           2HG      ARG   8  19.111   7.929  -5.792
   55    HG3  ARG   8           3HG      ARG   8  19.531   7.271  -4.223
   56    HD2  ARG   8           2HD      ARG   8  17.685   5.806  -6.163
   57    HD3  ARG   8           3HD      ARG   8  19.424   5.588  -6.177
   58    HE   ARG   8           HE       ARG   8  18.128   5.229  -3.545
   59   HH11  ARG   8          2HH2      ARG   8  19.362   3.662  -6.474
   60   HH12  ARG   8          1HH2      ARG   8  19.500   2.104  -5.731
   61   HH22  ARG   8          HH1       ARG   8  18.876   1.839  -3.432
   62    H    GLY   9           HN       GLY   9  14.868   7.444  -2.009
   63    HA2  GLY   9           1HA      GLY   9  15.131  10.237  -1.090
   64    HA3  GLY   9           2HA      GLY   9  13.637   9.431  -1.527
   65    H    VAL  10           HN       VAL  10  14.438   6.858  -0.153
   66    HA   VAL  10           HA       VAL  10  13.352   7.493   2.379
   67    HB   VAL  10           HB       VAL  10  13.334   5.328   0.854
   68   HG11  VAL  10          1HG1      VAL  10  14.794   3.565   1.857
   69   HG12  VAL  10          2HG1      VAL  10  15.691   4.818   0.965
   70   HG13  VAL  10          3HG1      VAL  10  15.658   4.843   2.745
   71   HG21  VAL  10          3HG2      VAL  10  12.534   4.055   2.766
   72   HG22  VAL  10          1HG2      VAL  10  13.338   5.180   3.887
   73   HG23  VAL  10          2HG2      VAL  10  11.977   5.741   2.887
   74    H    ARG  11           HN       ARG  11  16.642   6.493   1.230
   75    HA   ARG  11           HA       ARG  11  17.761   6.541   3.762
   76    HB2  ARG  11           2HB      ARG  11  19.946   6.592   2.533
   77    HB3  ARG  11           3HB      ARG  11  18.844   5.408   1.858
   78    HG2  ARG  11           2HG      ARG  11  18.117   7.449   0.284
   79    HG3  ARG  11           3HG      ARG  11  19.697   8.073   0.715
   80    HD2  ARG  11           2HD      ARG  11  19.132   5.350  -0.555
   81    HD3  ARG  11           3HD      ARG  11  19.838   6.735  -1.364
   82    HE   ARG  11           HE       ARG  11  21.492   6.295   0.851
   83   HH11  ARG  11          2HH2      ARG  11  20.453   4.378  -1.942
   84   HH12  ARG  11          1HH2      ARG  11  21.903   3.430  -1.987
   85   HH22  ARG  11          HH1       ARG  11  23.623   3.840  -0.370
   86    H    ASN  12           HN       ASN  12  17.403   9.027   1.178
   87    HA   ASN  12           HA       ASN  12  19.067  10.923   2.279
   88    HB2  ASN  12           2HB      ASN  12  16.717  10.939   0.386
   89    HB3  ASN  12           3HB      ASN  12  17.208  12.487   1.044
   90   HD21  ASN  12          1HD2      ASN  12  18.751   9.517  -0.190
   91   HD22  ASN  12          2HD2      ASN  12  19.914  10.286  -1.218
   92    H    ASN  13           HN       ASN  13  15.939   9.693   3.245
   93    HA   ASN  13           HA       ASN  13  15.261  12.080   4.697
   94    HB2  ASN  13           2HB      ASN  13  13.917   9.434   4.096
   95    HB3  ASN  13           3HB      ASN  13  13.362  10.331   5.495
   96   HD21  ASN  13          1HD2      ASN  13  14.675  11.597   2.463
   97   HD22  ASN  13          2HD2      ASN  13  13.258  12.441   1.933
   98    H    TYR  14           HN       TYR  14  17.124   9.214   5.071
   99    HA   TYR  14           HA       TYR  14  16.582   8.787   7.862
  100    HB2  TYR  14           2HB      TYR  14  17.559   6.802   7.156
  101    HB3  TYR  14           3HB      TYR  14  17.825   7.518   5.579
  102    HD1  TYR  14           HD1      TYR  14  19.364   7.782   9.003
  103    HD2  TYR  14           HD2      TYR  14  19.994   7.387   4.790
  104    HE1  TYR  14           HE1      TYR  14  21.877   7.693   9.380
  105    HE2  TYR  14           HE2      TYR  14  22.505   7.299   5.181
  106    HH   TYR  14           HH       TYR  14  24.101   7.908   6.753
  107    H    LYS  15           HN       LYS  15  19.293  10.128   5.860
  108    HA   LYS  15           HA       LYS  15  20.902  10.731   8.090
  109    HB2  LYS  15           2HB      LYS  15  22.420  11.386   6.551
  110    HB3  LYS  15           3HB      LYS  15  21.351  10.541   5.450
  111    HG2  LYS  15           2HG      LYS  15  21.137  13.525   6.067
  112    HG3  LYS  15           3HG      LYS  15  22.004  12.875   4.690
  113    HD2  LYS  15           2HD      LYS  15  19.968  11.917   3.754
  114    HD3  LYS  15           3HD      LYS  15  19.064  12.256   5.217
  115    HE2  LYS  15           2HE      LYS  15  18.616  14.386   4.552
  116    HE3  LYS  15           3HE      LYS  15  20.304  14.706   4.203
  117    HZ1  LYS  15           2HZ      LYS  15  18.668  13.095   2.339
  118    HZ3  LYS  15           1HZ      LYS  15  20.055  13.886   2.023
  119    H    SER  16           HN       SER  16  17.991  12.113   6.860
  120    HA   SER  16           HA       SER  16  18.514  14.778   7.546
  121    HB2  SER  16           2HB      SER  16  16.692  14.708   6.151
  122    HB3  SER  16           3HB      SER  16  16.170  13.139   6.733
  123    HG   SER  16           HG       SER  16  15.495  15.728   7.653
  124    H    ALA  17           HN       ALA  17  16.529  12.185   9.165
  125    HA   ALA  17           HA       ALA  17  16.081  13.681  11.495
  126    HB1  ALA  17           1HB      ALA  17  15.987  10.711  10.854
  127    HB2  ALA  17           2HB      ALA  17  15.469  11.392  12.415
  128    HB3  ALA  17           3HB      ALA  17  14.627  11.858  10.918
  129    H    VAL  18           HN       VAL  18  18.922  12.230  10.227
  130    HA   VAL  18           HA       VAL  18  20.075  11.513  12.748
  131    HB   VAL  18           HB       VAL  18  20.936  11.624   9.886
  132   HG11  VAL  18          1HG1      VAL  18  22.713  11.942  12.224
  133   HG12  VAL  18          2HG1      VAL  18  23.177  10.639  11.104
  134   HG13  VAL  18          3HG1      VAL  18  22.997  12.305  10.505
  135   HG21  VAL  18          3HG2      VAL  18  20.312   9.486  10.080
  136   HG22  VAL  18          1HG2      VAL  18  21.750   9.242  11.100
  137   HG23  VAL  18          2HG2      VAL  18  20.179   9.614  11.850
  138    H    GLY  19           HN       GLY  19  19.878  14.375  10.652
  139    HA2  GLY  19           1HA      GLY  19  22.048  15.844  11.533
  140    HA3  GLY  19           2HA      GLY  19  20.519  16.503  10.985
  141    HA   PRO  20           HA       PRO  20  19.370  17.443  15.077
  142    HB2  PRO  20           2HB      PRO  20  16.834  16.507  15.473
  143    HB3  PRO  20           3HB      PRO  20  17.187  17.962  14.562
  144    HG2  PRO  20           2HG      PRO  20  16.392  15.296  13.561
  145    HG3  PRO  20           3HG      PRO  20  16.336  16.841  12.735
  146    HD2  PRO  20           2HD      PRO  20  18.274  14.761  12.354
  147    HD3  PRO  20           3HD      PRO  20  18.283  16.349  11.615
  148    H    ALA  21           HN       ALA  21  19.172  14.088  14.349
  149    HA   ALA  21           HA       ALA  21  18.737  13.065  16.865
  150    HB1  ALA  21           1HB      ALA  21  20.027  11.088  15.973
  151    HB2  ALA  21           2HB      ALA  21  18.750  11.679  14.883
  152    HB3  ALA  21           3HB      ALA  21  20.454  12.076  14.556
  153    H    ASP  22           HN       ASP  22  21.504  14.804  15.562
  154    HA   ASP  22           HA       ASP  22  23.388  13.792  17.366
  155    HB2  ASP  22           2HB      ASP  22  23.484  15.376  15.138
  156    HB3  ASP  22           3HB      ASP  22  23.641  16.611  16.371
  157    HD2  ASP  22           HD2      ASP  22  26.026  13.572  16.707
  158    H    TRP  23           HN       TRP  23  20.978  16.444  17.362
  159    HA   TRP  23           HA       TRP  23  22.003  17.768  19.656
  160    HB2  TRP  23           2HB      TRP  23  20.291  19.244  19.379
  161    HB3  TRP  23           3HB      TRP  23  20.463  18.628  17.747
  162    HD1  TRP  23           HD1      TRP  23  18.194  17.923  16.667
  163    HE1  TRP  23           HE1      TRP  23  15.771  17.212  17.434
  164    HE3  TRP  23           HE3      TRP  23  19.202  17.928  21.651
  165    HZ2  TRP  23           HZ2      TRP  23  14.575  16.743  19.982
  166    HZ3  TRP  23           HZ3      TRP  23  17.350  17.332  23.211
  167    HH2  TRP  23           HH2      TRP  23  15.101  16.753  22.449
  168    H    VAL  24           HN       VAL  24  19.260  15.478  18.996
  169    HA   VAL  24           HA       VAL  24  18.359  15.294  21.607
  170    HB   VAL  24           HB       VAL  24  17.756  14.221  19.118
  171   HG11  VAL  24          1HG1      VAL  24  18.469  12.002  21.062
  172   HG12  VAL  24          2HG1      VAL  24  17.439  11.782  19.626
  173   HG13  VAL  24          3HG1      VAL  24  19.138  12.279  19.436
  174   HG21  VAL  24          3HG2      VAL  24  16.567  14.394  21.793
  175   HG22  VAL  24          1HG2      VAL  24  15.833  14.649  20.192
  176   HG23  VAL  24          2HG2      VAL  24  15.976  13.003  20.853
  177    H    ILE  25           HN       ILE  25  20.764  13.243  19.824
  178    HA   ILE  25           HA       ILE  25  21.327  11.622  22.050
  179    HB   ILE  25           HB       ILE  25  21.780  11.401  19.454
  180   HG12  ILE  25          2HG1      ILE  25  23.624   9.693  20.126
  181   HG13  ILE  25          3HG1      ILE  25  23.268  10.180  21.771
  182   HG21  ILE  25          1HG2      ILE  25  23.461  13.321  19.600
  183   HG22  ILE  25          2HG2      ILE  25  24.543  12.156  20.401
  184   HG23  ILE  25          3HG2      ILE  25  23.971  11.846  18.744
  185   HD11  ILE  25          3HD1      ILE  25  20.911   9.558  21.516
  186   HD12  ILE  25          1HD1      ILE  25  21.158   9.218  19.786
  187   HD13  ILE  25          2HD1      ILE  25  21.931   8.187  21.015
  188    H    SER  26           HN       SER  26  22.516  14.783  20.921
  189    HA   SER  26           HA       SER  26  24.797  14.802  22.533
  190    HB2  SER  26           2HB      SER  26  23.172  16.875  21.064
  191    HB3  SER  26           3HB      SER  26  24.369  17.426  22.218
  192    HG   SER  26           HG       SER  26  25.819  17.109  20.686
  193    H    ALA  27           HN       ALA  27  21.368  15.725  23.018
  194    HA   ALA  27           HA       ALA  27  21.805  17.068  25.476
  195    HB1  ALA  27           1HB      ALA  27  19.154  15.861  25.043
  196    HB2  ALA  27           2HB      ALA  27  19.612  17.569  25.242
  197    HB3  ALA  27           3HB      ALA  27  19.740  16.794  23.645
  198    H    VAL  28           HN       VAL  28  21.295  13.694  24.460
  199    HA   VAL  28           HA       VAL  28  20.631  12.729  27.035
  200    HB   VAL  28           HB       VAL  28  21.736  11.377  24.566
  201   HG11  VAL  28          1HG1      VAL  28  21.611   9.354  25.568
  202   HG12  VAL  28          2HG1      VAL  28  21.797  10.299  27.065
  203   HG13  VAL  28          3HG1      VAL  28  20.177   9.797  26.525
  204   HG21  VAL  28          3HG2      VAL  28  19.603  11.119  23.807
  205   HG22  VAL  28          1HG2      VAL  28  18.909  11.038  25.444
  206   HG23  VAL  28          2HG2      VAL  28  19.357  12.612  24.744
  207    H    ARG  29           HN       ARG  29  23.696  12.747  25.087
  208    HA   ARG  29           HA       ARG  29  25.168  11.640  27.194
  209    HB2  ARG  29           2HB      ARG  29  27.154  12.274  25.785
  210    HB3  ARG  29           3HB      ARG  29  25.925  11.429  24.865
  211    HG2  ARG  29           2HG      ARG  29  25.054  13.976  24.473
  212    HG3  ARG  29           3HG      ARG  29  26.755  14.313  24.731
  213    HD2  ARG  29           2HD      ARG  29  25.426  12.914  22.457
  214    HD3  ARG  29           3HD      ARG  29  26.881  13.890  22.465
  215    HE   ARG  29           HE       ARG  29  26.709  10.985  22.994
  216   HH11  ARG  29          2HH2      ARG  29  28.731  13.894  23.056
  217   HH12  ARG  29          1HH2      ARG  29  30.219  13.010  23.087
  218   HH22  ARG  29          HH1       ARG  29  30.161  10.614  23.074
  219    H    GLY  30           HN       GLY  30  24.145  14.897  26.304
  220    HA2  GLY  30           1HA      GLY  30  26.162  16.333  27.720
  221    HA3  GLY  30           2HA      GLY  30  24.636  16.946  27.117
  222    H    PHE  31           HN       PHE  31  22.914  14.991  28.502
  223    HA   PHE  31           HA       PHE  31  22.823  16.335  31.025
  224    HB2  PHE  31           2HB      PHE  31  20.655  15.840  30.297
  225    HB3  PHE  31           3HB      PHE  31  21.211  14.523  29.283
  226    HD1  PHE  31           HD2      PHE  31  20.133  15.440  32.673
  227    HD2  PHE  31           HD1      PHE  31  21.235  12.259  30.089
  228    HE1  PHE  31           HE2      PHE  31  19.230  13.783  34.328
  229    HE2  PHE  31           HE1      PHE  31  20.331  10.602  31.744
  230    HZ   PHE  31           HZ       PHE  31  19.340  11.384  33.844
  231    H    ILE  32           HN       ILE  32  24.000  13.242  29.757
  232    HA   ILE  32           HA       ILE  32  23.920  11.736  32.081
  233    HB   ILE  32           HB       ILE  32  24.620  11.290  29.537
  234   HG12  ILE  32          2HG1      ILE  32  25.876   9.410  31.458
  235   HG13  ILE  32          3HG1      ILE  32  24.189   9.783  31.752
  236   HG21  ILE  32          1HG2      ILE  32  27.286  11.109  30.941
  237   HG22  ILE  32          2HG2      ILE  32  26.918  10.922  29.210
  238   HG23  ILE  32          3HG2      ILE  32  26.809  12.526  29.974
  239   HD11  ILE  32          3HD1      ILE  32  25.312   8.862  29.066
  240   HD12  ILE  32          1HD1      ILE  32  24.475   7.815  30.238
  241   HD13  ILE  32          2HD1      ILE  32  23.596   9.144  29.446
  242    H    HIS  33           HN       HIS  33  26.307  14.157  30.902
  243    HA   HIS  33           HA       HIS  33  27.990  13.685  33.177
  244    HB2  HIS  33           2HB      HIS  33  29.439  15.333  32.211
  245    HB3  HIS  33           3HB      HIS  33  28.898  14.245  30.948
  246    HD1  HIS  33           HD1      HIS  33  28.291  17.772  32.251
  247    HD2  HIS  33           HD2      HIS  33  27.568  15.451  28.832
  248    HE1  HIS  33           HE1      HIS  33  27.416  19.376  30.470
  249    H    GLY  34           HN       GLY  34  25.112  15.431  32.508
  250    HA2  GLY  34           1HA      GLY  34  24.160  16.341  34.618
  251    HA3  GLY  34           2HA      GLY  34  25.642  17.264  34.771
  Start of MODEL   12
    1    H1   VAL   1           HN       VAL   1   4.894   3.344   0.038
    2    HA   VAL   1           HA       VAL   1   2.737   1.461  -0.183
    3    HB   VAL   1           HB       VAL   1   4.101   2.921  -2.433
    4   HG11  VAL   1          1HG1      VAL   1   1.443   1.635  -1.953
    5   HG12  VAL   1          2HG1      VAL   1   1.508   3.064  -3.013
    6   HG13  VAL   1          3HG1      VAL   1   2.478   1.623  -3.401
    7   HG21  VAL   1          3HG2      VAL   1   2.449   4.053  -0.208
    8   HG22  VAL   1          1HG2      VAL   1   3.805   4.772  -1.109
    9   HG23  VAL   1          2HG2      VAL   1   2.192   4.676  -1.855
   10    H    PHE   2           HN       PHE   2   2.871   0.020  -2.345
   11    HA   PHE   2           HA       PHE   2   5.048  -1.774  -1.821
   12    HB2  PHE   2           2HB      PHE   2   2.378  -1.878  -2.725
   13    HB3  PHE   2           3HB      PHE   2   3.276  -2.144  -4.206
   14    HD1  PHE   2           HD1      PHE   2   5.270  -3.925  -3.919
   15    HD2  PHE   2           HD2      PHE   2   1.782  -3.739  -1.510
   16    HE1  PHE   2           HE1      PHE   2   5.564  -6.342  -3.306
   17    HE2  PHE   2           HE2      PHE   2   2.075  -6.155  -0.897
   18    HZ   PHE   2           HZ       PHE   2   3.963  -7.428  -1.803
   19    H    HIS   3           HN       HIS   3   4.999   1.069  -3.453
   20    HA   HIS   3           HA       HIS   3   7.303   0.522  -4.891
   21    HB2  HIS   3           2HB      HIS   3   6.183  -0.714  -6.511
   22    HB3  HIS   3           3HB      HIS   3   4.746   0.287  -6.446
   23    HD1  HIS   3           HD1      HIS   3   7.248  -0.452  -8.746
   24    HD2  HIS   3           HD2      HIS   3   5.739   3.183  -7.297
   25    HE1  HIS   3           HE1      HIS   3   7.844   1.314 -10.488
   26    H    ALA   4           HN       ALA   4   4.293   2.444  -4.546
   27    HA   ALA   4           HA       ALA   4   5.203   4.811  -5.662
   28    HB1  ALA   4           1HB      ALA   4   3.506   5.287  -3.370
   29    HB2  ALA   4           2HB      ALA   4   3.107   5.389  -5.102
   30    HB3  ALA   4           3HB      ALA   4   2.944   3.840  -4.240
   31    H    TYR   5           HN       TYR   5   6.129   3.145  -2.727
   32    HA   TYR   5           HA       TYR   5   6.926   5.314  -1.169
   33    HB2  TYR   5           2HB      TYR   5   7.998   3.541   0.073
   34    HB3  TYR   5           3HB      TYR   5   6.712   2.700  -0.771
   35    HD1  TYR   5           HD2      TYR   5   7.204   1.190  -2.638
   36    HD2  TYR   5           HD1      TYR   5  10.341   3.233  -0.567
   37    HE1  TYR   5           HE2      TYR   5   8.919  -0.373  -3.678
   38    HE2  TYR   5           HE1      TYR   5  12.045   1.663  -1.614
   39    HH   TYR   5           HH       TYR   5  11.497  -1.105  -2.727
   40    H    SER   6           HN       SER   6   9.163   6.026  -0.665
   41    HA   SER   6           HA       SER   6  10.928   5.719  -2.955
   42    HB2  SER   6           2HB      SER   6  10.149   8.322  -1.577
   43    HB3  SER   6           3HB      SER   6  11.552   8.184  -2.619
   44    HG   SER   6           HG       SER   6   9.076   8.708  -3.387
   45    H    ALA   7           HN       ALA   7  12.310   4.290  -1.807
   46    HA   ALA   7           HA       ALA   7  13.064   4.633   0.851
   47    HB1  ALA   7           1HB      ALA   7  13.836   3.006  -1.487
   48    HB2  ALA   7           2HB      ALA   7  15.166   3.295  -0.341
   49    HB3  ALA   7           3HB      ALA   7  13.655   2.539   0.221
   50    H    ARG   8           HN       ARG   8  14.289   6.018  -2.207
   51    HA   ARG   8           HA       ARG   8  16.691   6.933  -1.170
   52    HB2  ARG   8           2HB      ARG   8  15.149   7.188  -3.630
   53    HB3  ARG   8           3HB      ARG   8  15.799   8.757  -3.198
   54    HG2  ARG   8           2HG      ARG   8  17.315   7.283  -4.653
   55    HG3  ARG   8           3HG      ARG   8  18.060   7.961  -3.219
   56    HD2  ARG   8           2HD      ARG   8  18.343   5.374  -3.779
   57    HD3  ARG   8           3HD      ARG   8  18.165   5.901  -2.117
   58    HE   ARG   8           HE       ARG   8  16.005   4.956  -2.049
   59   HH11  ARG   8          2HH2      ARG   8  17.186   4.995  -5.389
   60   HH12  ARG   8          1HH2      ARG   8  15.910   3.985  -5.983
   61   HH22  ARG   8          HH1       ARG   8  14.237   3.191  -4.462
   62    H    GLY   9           HN       GLY   9  13.444   7.862  -0.534
   63    HA2  GLY   9           1HA      GLY   9  14.222  10.598   0.247
   64    HA3  GLY   9           2HA      GLY   9  12.593  10.031  -0.061
   65    H    VAL  10           HN       VAL  10  13.068   7.418   1.396
   66    HA   VAL  10           HA       VAL  10  12.256   8.324   3.948
   67    HB   VAL  10           HB       VAL  10  11.802   6.128   2.542
   68   HG11  VAL  10          1HG1      VAL  10  13.035   4.199   3.548
   69   HG12  VAL  10          2HG1      VAL  10  14.052   5.255   2.539
   70   HG13  VAL  10          3HG1      VAL  10  14.145   5.360   4.313
   71   HG21  VAL  10          3HG2      VAL  10  11.633   6.801   5.405
   72   HG22  VAL  10          1HG2      VAL  10  10.395   6.160   4.298
   73   HG23  VAL  10          2HG2      VAL  10  11.565   5.056   5.060
   74    H    ARG  11           HN       ARG  11  15.270   6.765   2.672
   75    HA   ARG  11           HA       ARG  11  16.535   6.783   5.147
   76    HB2  ARG  11           2HB      ARG  11  18.611   6.345   3.814
   77    HB3  ARG  11           3HB      ARG  11  17.280   5.329   3.298
   78    HG2  ARG  11           2HG      ARG  11  16.821   7.333   1.586
   79    HG3  ARG  11           3HG      ARG  11  18.505   7.708   1.891
   80    HD2  ARG  11           2HD      ARG  11  17.310   5.301   0.534
   81    HD3  ARG  11           3HD      ARG  11  18.727   6.232   0.091
   82    HE   ARG  11           HE       ARG  11  18.632   3.973   1.960
   83   HH11  ARG  11          2HH2      ARG  11  20.481   6.820   0.945
   84   HH12  ARG  11          1HH2      ARG  11  21.978   6.230   1.586
   85   HH22  ARG  11          HH1       ARG  11  22.028   4.096   2.676
   86    H    ASN  12           HN       ASN  12  16.450   9.079   2.370
   87    HA   ASN  12           HA       ASN  12  18.481  10.731   3.217
   88    HB2  ASN  12           2HB      ASN  12  16.084  10.973   1.416
   89    HB3  ASN  12           3HB      ASN  12  16.794  12.486   1.946
   90   HD21  ASN  12          1HD2      ASN  12  17.844   9.265   0.833
   91   HD22  ASN  12          2HD2      ASN  12  19.076   9.802  -0.259
   92    H    ASN  13           HN       ASN  13  15.254  10.157   4.437
   93    HA   ASN  13           HA       ASN  13  15.087  12.735   5.696
   94    HB2  ASN  13           2HB      ASN  13  13.277  10.328   5.398
   95    HB3  ASN  13           3HB      ASN  13  12.975  11.410   6.743
   96   HD21  ASN  13          1HD2      ASN  13  14.284  12.197   3.551
   97   HD22  ASN  13          2HD2      ASN  13  12.999  13.234   3.025
   98    H    TYR  14           HN       TYR  14  16.450   9.624   6.241
   99    HA   TYR  14           HA       TYR  14  16.024   9.533   9.083
  100    HB2  TYR  14           2HB      TYR  14  16.595   7.353   8.518
  101    HB3  TYR  14           3HB      TYR  14  16.877   7.877   6.870
  102    HD1  TYR  14           HD1      TYR  14  18.660   8.146  10.173
  103    HD2  TYR  14           HD2      TYR  14  18.934   7.298   5.989
  104    HE1  TYR  14           HE1      TYR  14  21.139   7.642  10.430
  105    HE2  TYR  14           HE2      TYR  14  21.412   6.797   6.260
  106    HH   TYR  14           HH       TYR  14  22.864   6.532   9.396
  107    H    LYS  15           HN       LYS  15  18.790  10.200   6.833
  108    HA   LYS  15           HA       LYS  15  20.621  10.688   8.916
  109    HB2  LYS  15           2HB      LYS  15  22.124  10.929   7.248
  110    HB3  LYS  15           3HB      LYS  15  20.853  10.208   6.282
  111    HG2  LYS  15           2HG      LYS  15  21.210  13.220   6.641
  112    HG3  LYS  15           3HG      LYS  15  21.859  12.318   5.286
  113    HD2  LYS  15           2HD      LYS  15  19.646  11.700   4.513
  114    HD3  LYS  15           3HD      LYS  15  18.897  12.244   6.001
  115    HE2  LYS  15           2HE      LYS  15  18.750  14.386   5.246
  116    HE3  LYS  15           3HE      LYS  15  20.443  14.417   4.797
  117    HZ1  LYS  15           2HZ      LYS  15  18.721  12.851   3.049
  118    HZ3  LYS  15           1HZ      LYS  15  19.945  13.851   2.657
  119    H    SER  16           HN       SER  16  17.920  12.462   7.707
  120    HA   SER  16           HA       SER  16  18.971  15.032   8.182
  121    HB2  SER  16           2HB      SER  16  17.164  15.221   6.775
  122    HB3  SER  16           3HB      SER  16  16.347  13.830   7.458
  123    HG   SER  16           HG       SER  16  16.459  16.509   8.546
  124    H    ALA  17           HN       ALA  17  16.979  12.663  10.037
  125    HA   ALA  17           HA       ALA  17  16.655  14.450  12.251
  126    HB1  ALA  17           1HB      ALA  17  15.355  12.717  13.177
  127    HB2  ALA  17           2HB      ALA  17  15.108  12.530  11.424
  128    HB3  ALA  17           3HB      ALA  17  16.235  11.453  12.284
  129    H    VAL  18           HN       VAL  18  19.187  12.471  11.025
  130    HA   VAL  18           HA       VAL  18  20.276  11.733  13.567
  131    HB   VAL  18           HB       VAL  18  21.062  11.517  10.690
  132   HG11  VAL  18          1HG1      VAL  18  23.224  11.878  11.225
  133   HG12  VAL  18          2HG1      VAL  18  22.932  11.681  12.970
  134   HG13  VAL  18          3HG1      VAL  18  23.141  10.248  11.935
  135   HG21  VAL  18          3HG2      VAL  18  20.095   9.531  11.038
  136   HG22  VAL  18          1HG2      VAL  18  21.502   9.112  12.045
  137   HG23  VAL  18          2HG2      VAL  18  20.038   9.789  12.799
  138    H    GLY  19           HN       GLY  19  20.494  14.450  11.290
  139    HA2  GLY  19           1HA      GLY  19  22.903  15.587  12.031
  140    HA3  GLY  19           2HA      GLY  19  21.490  16.456  11.466
  141    HA   PRO  20           HA       PRO  20  20.629  17.834  15.505
  142    HB2  PRO  20           2HB      PRO  20  17.984  17.363  16.006
  143    HB3  PRO  20           3HB      PRO  20  18.548  18.677  14.994
  144    HG2  PRO  20           2HG      PRO  20  17.294  16.125  14.188
  145    HG3  PRO  20           3HG      PRO  20  17.472  17.601  13.261
  146    HD2  PRO  20           2HD      PRO  20  19.026  15.206  12.988
  147    HD3  PRO  20           3HD      PRO  20  19.278  16.720  12.143
  148    H    ALA  21           HN       ALA  21  19.858  14.520  15.007
  149    HA   ALA  21           HA       ALA  21  19.330  13.746  17.594
  150    HB1  ALA  21           1HB      ALA  21  20.793  12.340  15.326
  151    HB2  ALA  21           2HB      ALA  21  20.249  11.529  16.815
  152    HB3  ALA  21           3HB      ALA  21  19.057  12.254  15.710
  153    H    ASP  22           HN       ASP  22  22.310  14.909  16.129
  154    HA   ASP  22           HA       ASP  22  24.049  13.714  17.966
  155    HB2  ASP  22           2HB      ASP  22  24.344  15.113  15.633
  156    HB3  ASP  22           3HB      ASP  22  24.742  16.379  16.777
  157    HD2  ASP  22           HD2      ASP  22  25.935  13.284  15.589
  158    H    TRP  23           HN       TRP  23  22.111  16.723  17.822
  159    HA   TRP  23           HA       TRP  23  23.408  18.006  20.000
  160    HB2  TRP  23           2HB      TRP  23  21.958  19.725  19.651
  161    HB3  TRP  23           3HB      TRP  23  21.974  18.982  18.064
  162    HD1  TRP  23           HD1      TRP  23  19.586  18.599  17.082
  163    HE1  TRP  23           HE1      TRP  23  17.105  18.357  17.945
  164    HE3  TRP  23           HE3      TRP  23  20.737  18.762  22.032
  165    HZ2  TRP  23           HZ2      TRP  23  15.927  18.263  20.543
  166    HZ3  TRP  23           HZ3      TRP  23  18.862  18.588  23.666
  167    HH2  TRP  23           HH2      TRP  23  16.525  18.346  22.992
  168    H    VAL  24           HN       VAL  24  20.304  16.170  19.550
  169    HA   VAL  24           HA       VAL  24  19.464  16.308  22.185
  170    HB   VAL  24           HB       VAL  24  18.616  15.194  19.786
  171   HG11  VAL  24          1HG1      VAL  24  19.663  13.071  20.210
  172   HG12  VAL  24          2HG1      VAL  24  19.007  13.016  21.863
  173   HG13  VAL  24          3HG1      VAL  24  17.912  12.881  20.467
  174   HG21  VAL  24          3HG2      VAL  24  16.833  16.021  20.872
  175   HG22  VAL  24          1HG2      VAL  24  16.704  14.411  21.618
  176   HG23  VAL  24          2HG2      VAL  24  17.553  15.722  22.472
  177    H    ILE  25           HN       ILE  25  21.438  13.770  20.499
  178    HA   ILE  25           HA       ILE  25  21.790  12.225  22.820
  179    HB   ILE  25           HB       ILE  25  22.118  11.763  20.237
  180   HG12  ILE  25          2HG1      ILE  25  22.012   9.997  21.823
  181   HG13  ILE  25          3HG1      ILE  25  23.467   9.750  20.879
  182   HG21  ILE  25          1HG2      ILE  25  24.998  12.094  21.073
  183   HG22  ILE  25          2HG2      ILE  25  24.327  11.787  19.453
  184   HG23  ILE  25          3HG2      ILE  25  24.104  13.377  20.222
  185   HD11  ILE  25          3HD1      ILE  25  24.042   9.397  23.206
  186   HD12  ILE  25          1HD1      ILE  25  24.773  10.942  22.712
  187   HD13  ILE  25          2HD1      ILE  25  23.282  10.934  23.682
  188    H    SER  26           HN       SER  26  23.455  15.060  21.452
  189    HA   SER  26           HA       SER  26  25.756  14.797  23.013
  190    HB2  SER  26           2HB      SER  26  25.955  16.217  21.138
  191    HB3  SER  26           3HB      SER  26  24.450  17.048  21.475
  192    HG   SER  26           HG       SER  26  25.929  18.515  22.166
  193    H    ALA  27           HN       ALA  27  22.546  16.314  23.503
  194    HA   ALA  27           HA       ALA  27  23.278  17.721  25.853
  195    HB1  ALA  27           1HB      ALA  27  21.254  17.950  24.141
  196    HB2  ALA  27           2HB      ALA  27  20.462  16.838  25.285
  197    HB3  ALA  27           3HB      ALA  27  21.069  18.414  25.850
  198    H    VAL  28           HN       VAL  28  22.181  14.422  25.083
  199    HA   VAL  28           HA       VAL  28  21.447  13.751  27.731
  200    HB   VAL  28           HB       VAL  28  22.233  12.075  25.340
  201   HG11  VAL  28          1HG1      VAL  28  22.210  11.155  27.891
  202   HG12  VAL  28          2HG1      VAL  28  20.499  10.929  27.457
  203   HG13  VAL  28          3HG1      VAL  28  21.774  10.168  26.475
  204   HG21  VAL  28          3HG2      VAL  28  20.087  12.180  24.617
  205   HG22  VAL  28          1HG2      VAL  28  19.417  12.228  26.266
  206   HG23  VAL  28          2HG2      VAL  28  20.080  13.708  25.531
  207    H    ARG  29           HN       ARG  29  24.409  13.127  25.724
  208    HA   ARG  29           HA       ARG  29  25.742  11.926  27.872
  209    HB2  ARG  29           2HB      ARG  29  27.760  12.124  26.382
  210    HB3  ARG  29           3HB      ARG  29  26.378  11.440  25.548
  211    HG2  ARG  29           2HG      ARG  29  25.933  14.067  24.999
  212    HG3  ARG  29           3HG      ARG  29  27.673  14.129  25.198
  213    HD2  ARG  29           2HD      ARG  29  26.059  12.829  23.053
  214    HD3  ARG  29           3HD      ARG  29  27.656  13.545  22.965
  215    HE   ARG  29           HE       ARG  29  27.018  10.751  23.696
  216   HH11  ARG  29          2HH2      ARG  29  29.498  13.275  23.517
  217   HH12  ARG  29          1HH2      ARG  29  30.818  12.155  23.579
  218   HH22  ARG  29          HH1       ARG  29  30.360   9.808  23.732
  219    H    GLY  30           HN       GLY  30  25.249  15.244  26.780
  220    HA2  GLY  30           1HA      GLY  30  27.521  16.408  28.052
  221    HA3  GLY  30           2HA      GLY  30  26.100  17.230  27.440
  222    H    PHE  31           HN       PHE  31  24.122  15.687  28.992
  223    HA   PHE  31           HA       PHE  31  24.338  17.186  31.418
  224    HB2  PHE  31           2HB      PHE  31  22.095  17.019  30.772
  225    HB3  PHE  31           3HB      PHE  31  22.390  15.566  29.838
  226    HD1  PHE  31           HD1      PHE  31  21.589  16.867  33.179
  227    HD2  PHE  31           HD2      PHE  31  22.062  13.386  30.798
  228    HE1  PHE  31           HE1      PHE  31  20.475  15.495  34.962
  229    HE2  PHE  31           HE2      PHE  31  20.948  12.015  32.581
  230    HZ   PHE  31           HZ       PHE  31  20.168  13.086  34.641
  231    H    ILE  32           HN       ILE  32  24.938  13.863  30.341
  232    HA   ILE  32           HA       ILE  32  24.682  12.545  32.764
  233    HB   ILE  32           HB       ILE  32  25.215  11.825  30.242
  234   HG12  ILE  32          2HG1      ILE  32  26.197   9.887  32.264
  235   HG13  ILE  32          3HG1      ILE  32  24.605  10.558  32.562
  236   HG21  ILE  32          1HG2      ILE  32  27.407  11.050  29.895
  237   HG22  ILE  32          2HG2      ILE  32  27.594  12.695  30.547
  238   HG23  ILE  32          3HG2      ILE  32  27.856  11.285  31.601
  239   HD11  ILE  32          3HD1      ILE  32  23.882   9.908  30.272
  240   HD12  ILE  32          1HD1      ILE  32  25.500   9.238  29.958
  241   HD13  ILE  32          2HD1      ILE  32  24.456   8.498  31.194
  242    H    HIS  33           HN       HIS  33  27.402  14.445  31.371
  243    HA   HIS  33           HA       HIS  33  29.056  13.841  33.636
  244    HB2  HIS  33           2HB      HIS  33  30.728  15.155  32.529
  245    HB3  HIS  33           3HB      HIS  33  29.971  14.097  31.355
  246    HD1  HIS  33           HD1      HIS  33  30.002  17.751  32.429
  247    HD2  HIS  33           HD2      HIS  33  28.798  15.374  29.189
  248    HE1  HIS  33           HE1      HIS  33  29.351  19.364  30.562
  249    H    GLY  34           HN       GLY  34  26.490  16.003  32.912
  250    HA2  GLY  34           1HA      GLY  34  27.432  17.946  34.926
  251    HA3  GLY  34           2HA      GLY  34  26.255  18.259  33.666
  Start of MODEL   13
    1    H1   VAL   1           HN       VAL   1  10.207   0.757   5.137
    2    HA   VAL   1           HA       VAL   1   7.835   1.899   5.490
    3    HB   VAL   1           HB       VAL   1   8.413   3.444   3.698
    4   HG11  VAL   1          1HG1      VAL   1  11.138   2.980   4.662
    5   HG12  VAL   1          2HG1      VAL   1  10.034   4.344   4.959
    6   HG13  VAL   1          3HG1      VAL   1   9.921   2.875   5.957
    7   HG21  VAL   1          3HG2      VAL   1  10.104   1.155   2.780
    8   HG22  VAL   1          1HG2      VAL   1   9.149   2.326   1.839
    9   HG23  VAL   1          2HG2      VAL   1  10.719   2.806   2.527
   10    H    PHE   2           HN       PHE   2   6.133   2.603   3.794
   11    HA   PHE   2           HA       PHE   2   5.647   0.790   1.661
   12    HB2  PHE   2           2HB      PHE   2   4.238   0.622   4.363
   13    HB3  PHE   2           3HB      PHE   2   3.321   0.242   2.919
   14    HD1  PHE   2           HD2      PHE   2   4.200  -1.610   1.399
   15    HD2  PHE   2           HD1      PHE   2   5.652  -0.978   5.336
   16    HE1  PHE   2           HE2      PHE   2   5.103  -3.951   1.442
   17    HE2  PHE   2           HE1      PHE   2   6.556  -3.319   5.378
   18    HZ   PHE   2           HZ       PHE   2   6.271  -4.778   3.431
   19    H    HIS   3           HN       HIS   3   5.972   3.536   1.626
   20    HA   HIS   3           HA       HIS   3   3.636   4.366   0.392
   21    HB2  HIS   3           2HB      HIS   3   2.412   4.709   2.288
   22    HB3  HIS   3           3HB      HIS   3   3.819   4.990   3.294
   23    HD1  HIS   3           HD1      HIS   3   1.038   6.746   1.879
   24    HD2  HIS   3           HD2      HIS   3   5.070   7.684   2.553
   25    HE1  HIS   3           HE1      HIS   3   1.197   9.292   1.833
   26    H    ALA   4           HN       ALA   4   6.601   5.218   2.222
   27    HA   ALA   4           HA       ALA   4   6.997   7.690   0.905
   28    HB1  ALA   4           1HB      ALA   4   9.147   5.959   2.156
   29    HB2  ALA   4           2HB      ALA   4   9.045   7.735   2.090
   30    HB3  ALA   4           3HB      ALA   4   7.945   6.819   3.148
   31    H    TYR   5           HN       TYR   5   7.996   4.288   0.313
   32    HA   TYR   5           HA       TYR   5   9.023   3.320  -1.401
   33    HB2  TYR   5           2HB      TYR   5   7.368   5.612  -2.509
   34    HB3  TYR   5           3HB      TYR   5   8.455   4.829  -3.639
   35    HD1  TYR   5           HD2      TYR   5   6.257   3.498  -0.895
   36    HD2  TYR   5           HD1      TYR   5   7.250   3.444  -5.056
   37    HE1  TYR   5           HE2      TYR   5   4.537   1.668  -1.289
   38    HE2  TYR   5           HE1      TYR   5   5.527   1.614  -5.436
   39    HH   TYR   5           HH       TYR   5   3.227   0.779  -3.044
   40    H    SER   6           HN       SER   6  10.330   4.057  -3.690
   41    HA   SER   6           HA       SER   6  12.359   4.606  -4.285
   42    HB2  SER   6           2HB      SER   6  11.551   7.330  -3.173
   43    HB3  SER   6           3HB      SER   6  12.822   7.050  -4.345
   44    HG   SER   6           HG       SER   6  10.498   7.673  -5.071
   45    H    ALA   7           HN       ALA   7  13.764   3.405  -2.945
   46    HA   ALA   7           HA       ALA   7  14.274   3.985  -0.274
   47    HB1  ALA   7           1HB      ALA   7  15.623   2.423  -2.466
   48    HB2  ALA   7           2HB      ALA   7  16.480   2.674  -0.927
   49    HB3  ALA   7           3HB      ALA   7  14.902   1.850  -0.943
   50    H    ARG   8           HN       ARG   8  15.631   5.268  -3.320
   51    HA   ARG   8           HA       ARG   8  17.852   6.458  -2.151
   52    HB2  ARG   8           2HB      ARG   8  16.424   6.550  -4.752
   53    HB3  ARG   8           3HB      ARG   8  17.226   8.058  -4.360
   54    HG2  ARG   8           2HG      ARG   8  18.995   6.952  -5.380
   55    HG3  ARG   8           3HG      ARG   8  19.265   6.444  -3.725
   56    HD2  ARG   8           2HD      ARG   8  17.616   4.834  -5.732
   57    HD3  ARG   8           3HD      ARG   8  19.321   4.557  -5.438
   58    HE   ARG   8           HE       ARG   8  17.654   4.540  -3.011
   59   HH11  ARG   8          2HH2      ARG   8  19.073   2.585  -5.604
   60   HH12  ARG   8          1HH2      ARG   8  18.969   1.104  -4.713
   61   HH22  ARG   8          HH1       ARG   8  18.050   1.127  -2.499
   62    H    GLY   9           HN       GLY   9  14.492   7.147  -1.912
   63    HA2  GLY   9           1HA      GLY   9  14.963   9.994  -1.305
   64    HA3  GLY   9           2HA      GLY   9  13.424   9.257  -1.703
   65    H    VAL  10           HN       VAL  10  13.927   6.830   0.011
   66    HA   VAL  10           HA       VAL  10  12.814   7.859   2.388
   67    HB   VAL  10           HB       VAL  10  12.693   5.522   1.155
   68   HG11  VAL  10          1HG1      VAL  10  13.989   3.808   2.434
   69   HG12  VAL  10          2HG1      VAL  10  15.000   4.871   1.425
   70   HG13  VAL  10          3HG1      VAL  10  14.916   5.130   3.184
   71   HG21  VAL  10          3HG2      VAL  10  11.704   6.548   3.485
   72   HG22  VAL  10          1HG2      VAL  10  11.331   4.926   2.854
   73   HG23  VAL  10          2HG2      VAL  10  12.601   5.132   4.084
   74    H    ARG  11           HN       ARG  11  16.065   6.494   1.544
   75    HA   ARG  11           HA       ARG  11  17.070   6.836   4.112
   76    HB2  ARG  11           2HB      ARG  11  19.298   6.494   3.022
   77    HB3  ARG  11           3HB      ARG  11  18.121   5.320   2.469
   78    HG2  ARG  11           2HG      ARG  11  17.667   7.136   0.558
   79    HG3  ARG  11           3HG      ARG  11  19.272   7.692   0.989
   80    HD2  ARG  11           2HD      ARG  11  18.440   5.039  -0.199
   81    HD3  ARG  11           3HD      ARG  11  19.736   6.109  -0.696
   82    HE   ARG  11           HE       ARG  11  19.912   4.005   1.291
   83   HH11  ARG  11          2HH2      ARG  11  21.215   7.193   0.460
   84   HH12  ARG  11          1HH2      ARG  11  22.705   6.942   1.307
   85   HH22  ARG  11          HH1       ARG  11  23.073   4.866   2.445
   86    H    ASN  12           HN       ASN  12  17.046   8.888   1.150
   87    HA   ASN  12           HA       ASN  12  18.838  10.786   1.987
   88    HB2  ASN  12           2HB      ASN  12  16.588  10.630   0.020
   89    HB3  ASN  12           3HB      ASN  12  17.009  12.258   0.511
   90   HD21  ASN  12          1HD2      ASN  12  18.628   9.193  -0.322
   91   HD22  ASN  12          2HD2      ASN  12  19.855   9.863  -1.344
   92    H    ASN  13           HN       ASN  13  15.577  10.023   3.033
   93    HA   ASN  13           HA       ASN  13  15.126  12.648   4.105
   94    HB2  ASN  13           2HB      ASN  13  13.543  10.085   3.854
   95    HB3  ASN  13           3HB      ASN  13  13.070  11.201   5.119
   96   HD21  ASN  13          1HD2      ASN  13  14.438  11.803   1.897
   97   HD22  ASN  13          2HD2      ASN  13  13.127  12.745   1.269
   98    H    TYR  14           HN       TYR  14  16.595   9.623   4.963
   99    HA   TYR  14           HA       TYR  14  16.043   9.770   7.780
  100    HB2  TYR  14           2HB      TYR  14  16.731   7.573   7.467
  101    HB3  TYR  14           3HB      TYR  14  17.005   7.942   5.776
  102    HD1  TYR  14           HD1      TYR  14  18.743   8.559   9.055
  103    HD2  TYR  14           HD2      TYR  14  19.098   7.406   4.950
  104    HE1  TYR  14           HE1      TYR  14  21.237   8.180   9.369
  105    HE2  TYR  14           HE2      TYR  14  21.591   7.031   5.278
  106    HH   TYR  14           HH       TYR  14  23.076   6.451   7.261
  107    H    LYS  15           HN       LYS  15  18.822  10.449   5.567
  108    HA   LYS  15           HA       LYS  15  20.690  11.000   7.537
  109    HB2  LYS  15           2HB      LYS  15  21.737  12.414   5.665
  110    HB3  LYS  15           3HB      LYS  15  21.523  10.697   5.384
  111    HG2  LYS  15           2HG      LYS  15  20.129  11.077   3.632
  112    HG3  LYS  15           3HG      LYS  15  19.107  12.127   4.594
  113    HD2  LYS  15           2HD      LYS  15  21.365  13.714   4.191
  114    HD3  LYS  15           3HD      LYS  15  21.262  12.831   2.681
  115    HE2  LYS  15           2HE      LYS  15  19.050  13.642   2.220
  116    HE3  LYS  15           3HE      LYS  15  18.800  14.159   3.875
  117    HZ1  LYS  15           2HZ      LYS  15  19.998  15.613   1.754
  118    HZ3  LYS  15           1HZ      LYS  15  21.047  15.520   2.996
  119    H    SER  16           HN       SER  16  17.801  12.696   6.628
  120    HA   SER  16           HA       SER  16  18.701  15.259   7.375
  121    HB2  SER  16           2HB      SER  16  16.513  14.275   6.028
  122    HB3  SER  16           3HB      SER  16  15.790  14.653   7.578
  123    HG   SER  16           HG       SER  16  17.465  16.552   6.194
  124    H    ALA  17           HN       ALA  17  16.663  12.700   8.954
  125    HA   ALA  17           HA       ALA  17  16.284  14.117  11.346
  126    HB1  ALA  17           1HB      ALA  17  15.763  11.450  10.229
  127    HB2  ALA  17           2HB      ALA  17  16.125  11.410  11.972
  128    HB3  ALA  17           3HB      ALA  17  14.793  12.422  11.362
  129    H    VAL  18           HN       VAL  18  19.086  12.708   9.947
  130    HA   VAL  18           HA       VAL  18  20.311  11.908  12.408
  131    HB   VAL  18           HB       VAL  18  21.090  12.115   9.527
  132   HG11  VAL  18          1HG1      VAL  18  22.932  12.355  11.822
  133   HG12  VAL  18          2HG1      VAL  18  23.361  11.084  10.652
  134   HG13  VAL  18          3HG1      VAL  18  23.169  12.768  10.107
  135   HG21  VAL  18          3HG2      VAL  18  20.426  10.031  11.469
  136   HG22  VAL  18          1HG2      VAL  18  20.423   9.982   9.690
  137   HG23  VAL  18          2HG2      VAL  18  21.933   9.689  10.585
  138    H    GLY  19           HN       GLY  19  20.038  14.841  10.429
  139    HA2  GLY  19           1HA      GLY  19  22.241  16.279  11.292
  140    HA3  GLY  19           2HA      GLY  19  20.699  16.955  10.806
  141    HA   PRO  20           HA       PRO  20  19.660  17.761  14.956
  142    HB2  PRO  20           2HB      PRO  20  17.132  16.815  15.387
  143    HB3  PRO  20           3HB      PRO  20  17.464  18.299  14.516
  144    HG2  PRO  20           2HG      PRO  20  16.640  15.668  13.448
  145    HG3  PRO  20           3HG      PRO  20  16.564  17.239  12.675
  146    HD2  PRO  20           2HD      PRO  20  18.488  15.171  12.176
  147    HD3  PRO  20           3HD      PRO  20  18.480  16.783  11.489
  148    H    ALA  21           HN       ALA  21  19.461  14.436  14.119
  149    HA   ALA  21           HA       ALA  21  19.083  13.330  16.614
  150    HB1  ALA  21           1HB      ALA  21  20.727  12.418  14.222
  151    HB2  ALA  21           2HB      ALA  21  20.350  11.384  15.621
  152    HB3  ALA  21           3HB      ALA  21  19.036  12.006  14.593
  153    H    ASP  22           HN       ASP  22  21.819  15.103  15.287
  154    HA   ASP  22           HA       ASP  22  23.741  14.033  17.022
  155    HB2  ASP  22           2HB      ASP  22  23.791  15.663  14.819
  156    HB3  ASP  22           3HB      ASP  22  24.011  16.864  16.076
  157    HD2  ASP  22           HD2      ASP  22  26.560  13.881  16.274
  158    H    TRP  23           HN       TRP  23  21.320  16.658  17.142
  159    HA   TRP  23           HA       TRP  23  22.421  17.975  19.407
  160    HB2  TRP  23           2HB      TRP  23  20.697  19.439  19.198
  161    HB3  TRP  23           3HB      TRP  23  20.779  18.816  17.562
  162    HD1  TRP  23           HD1      TRP  23  18.452  18.112  16.617
  163    HE1  TRP  23           HE1      TRP  23  16.082  17.386  17.524
  164    HE3  TRP  23           HE3      TRP  23  19.753  18.104  21.533
  165    HZ2  TRP  23           HZ2      TRP  23  15.041  16.901  20.136
  166    HZ3  TRP  23           HZ3      TRP  23  18.000  17.493  23.197
  167    HH2  TRP  23           HH2      TRP  23  15.713  16.905  22.567
  168    H    VAL  24           HN       VAL  24  19.661  15.677  18.837
  169    HA   VAL  24           HA       VAL  24  18.887  15.447  21.486
  170    HB   VAL  24           HB       VAL  24  18.182  14.400  19.004
  171   HG11  VAL  24          1HG1      VAL  24  19.545  12.444  19.246
  172   HG12  VAL  24          2HG1      VAL  24  18.974  12.178  20.911
  173   HG13  VAL  24          3HG1      VAL  24  17.858  11.959  19.542
  174   HG21  VAL  24          3HG2      VAL  24  16.460  13.192  20.803
  175   HG22  VAL  24          1HG2      VAL  24  17.095  14.579  21.720
  176   HG23  VAL  24          2HG2      VAL  24  16.303  14.839  20.147
  177    H    ILE  25           HN       ILE  25  21.178  13.394  19.554
  178    HA   ILE  25           HA       ILE  25  21.851  11.717  21.676
  179    HB   ILE  25           HB       ILE  25  22.262  11.637  19.074
  180   HG12  ILE  25          2HG1      ILE  25  23.924   9.844  19.466
  181   HG13  ILE  25          3HG1      ILE  25  24.118  10.388  21.121
  182   HG21  ILE  25          1HG2      ILE  25  24.294  12.329  18.272
  183   HG22  ILE  25          2HG2      ILE  25  23.956  13.618  19.453
  184   HG23  ILE  25          3HG2      ILE  25  25.069  12.294  19.874
  185   HD11  ILE  25          3HD1      ILE  25  22.146   9.447  21.799
  186   HD12  ILE  25          1HD1      ILE  25  21.288   9.957  20.325
  187   HD13  ILE  25          2HD1      ILE  25  22.294   8.488  20.307
  188    H    SER  26           HN       SER  26  22.995  14.949  20.689
  189    HA   SER  26           HA       SER  26  25.288  14.927  22.268
  190    HB2  SER  26           2HB      SER  26  25.213  16.591  20.596
  191    HB3  SER  26           3HB      SER  26  23.578  17.074  21.002
  192    HG   SER  26           HG       SER  26  25.621  18.413  21.720
  193    H    ALA  27           HN       ALA  27  21.884  15.994  22.839
  194    HA   ALA  27           HA       ALA  27  22.414  17.019  25.429
  195    HB1  ALA  27           1HB      ALA  27  19.787  16.696  25.491
  196    HB2  ALA  27           2HB      ALA  27  20.519  17.933  24.441
  197    HB3  ALA  27           3HB      ALA  27  19.997  16.377  23.752
  198    H    VAL  28           HN       VAL  28  21.678  13.833  24.050
  199    HA   VAL  28           HA       VAL  28  20.771  12.610  26.398
  200    HB   VAL  28           HB       VAL  28  22.174  11.517  23.953
  201   HG11  VAL  28          1HG1      VAL  28  21.903   9.388  24.687
  202   HG12  VAL  28          2HG1      VAL  28  21.971  10.160  26.289
  203   HG13  VAL  28          3HG1      VAL  28  20.397   9.763  25.559
  204   HG21  VAL  28          3HG2      VAL  28  20.222  11.692  22.883
  205   HG22  VAL  28          1HG2      VAL  28  19.355  10.892  24.216
  206   HG23  VAL  28          2HG2      VAL  28  19.621  12.651  24.256
  207    H    ARG  29           HN       ARG  29  24.068  12.808  24.894
  208    HA   ARG  29           HA       ARG  29  25.249  11.424  27.019
  209    HB2  ARG  29           2HB      ARG  29  27.259  11.723  25.840
  210    HB3  ARG  29           3HB      ARG  29  26.090  11.912  24.548
  211    HG2  ARG  29           2HG      ARG  29  26.164  14.486  25.294
  212    HG3  ARG  29           3HG      ARG  29  27.722  14.030  25.955
  213    HD2  ARG  29           2HD      ARG  29  26.899  14.339  23.123
  214    HD3  ARG  29           3HD      ARG  29  28.492  14.480  23.840
  215    HE   ARG  29           HE       ARG  29  27.242  12.003  22.803
  216   HH11  ARG  29          2HH2      ARG  29  29.953  13.455  24.562
  217   HH12  ARG  29          1HH2      ARG  29  30.991  12.087  24.340
  218   HH22  ARG  29          HH1       ARG  29  30.182  10.183  23.130
  219    H    GLY  30           HN       GLY  30  24.348  14.785  26.424
  220    HA2  GLY  30           1HA      GLY  30  26.141  15.970  28.315
  221    HA3  GLY  30           2HA      GLY  30  24.756  16.712  27.539
  222    H    PHE  31           HN       PHE  31  22.806  14.628  28.361
  223    HA   PHE  31           HA       PHE  31  22.263  15.689  30.960
  224    HB2  PHE  31           2HB      PHE  31  20.267  15.304  29.794
  225    HB3  PHE  31           3HB      PHE  31  21.000  14.077  28.780
  226    HD1  PHE  31           HD1      PHE  31  19.377  14.690  32.028
  227    HD2  PHE  31           HD2      PHE  31  20.828  11.757  29.326
  228    HE1  PHE  31           HE1      PHE  31  18.192  12.902  33.332
  229    HE2  PHE  31           HE2      PHE  31  19.642   9.969  30.630
  230    HZ   PHE  31           HZ       PHE  31  18.338  10.563  32.617
  231    H    ILE  32           HN       ILE  32  23.704  12.759  29.599
  232    HA   ILE  32           HA       ILE  32  23.215  10.995  31.681
  233    HB   ILE  32           HB       ILE  32  24.363  10.820  29.283
  234   HG12  ILE  32          2HG1      ILE  32  25.367   8.749  31.132
  235   HG13  ILE  32          3HG1      ILE  32  23.654   9.088  31.283
  236   HG21  ILE  32          1HG2      ILE  32  26.759  10.531  31.095
  237   HG22  ILE  32          2HG2      ILE  32  26.693  10.522  29.316
  238   HG23  ILE  32          3HG2      ILE  32  26.407  12.035  30.210
  239   HD11  ILE  32          3HD1      ILE  32  24.128   7.304  29.594
  240   HD12  ILE  32          1HD1      ILE  32  23.318   8.714  28.870
  241   HD13  ILE  32          2HD1      ILE  32  25.068   8.480  28.645
  242    H    HIS  33           HN       HIS  33  25.737  13.525  31.248
  243    HA   HIS  33           HA       HIS  33  26.963  12.793  33.740
  244    HB2  HIS  33           2HB      HIS  33  28.555  14.522  33.246
  245    HB3  HIS  33           3HB      HIS  33  28.290  13.556  31.808
  246    HD1  HIS  33           HD1      HIS  33  27.534  16.978  33.257
  247    HD2  HIS  33           HD2      HIS  33  27.251  14.932  29.606
  248    HE1  HIS  33           HE1      HIS  33  26.973  18.736  31.495
  249    H    GLY  34           HN       GLY  34  24.252  14.625  32.718
  250    HA2  GLY  34           1HA      GLY  34  24.377  16.724  34.652
  251    HA3  GLY  34           2HA      GLY  34  22.999  16.239  33.685
  Start of MODEL   14
    1    H1   VAL   1           HN       VAL   1   1.681   0.722   2.077
    2    HA   VAL   1           HA       VAL   1   3.086  -0.562   0.945
    3    HB   VAL   1           HB       VAL   1   3.984   1.743  -0.753
    4   HG11  VAL   1          1HG1      VAL   1   3.673  -1.235  -1.074
    5   HG12  VAL   1          2HG1      VAL   1   3.693  -0.171  -2.500
    6   HG13  VAL   1          3HG1      VAL   1   5.087  -0.203  -1.394
    7   HG21  VAL   1          3HG2      VAL   1   1.266   0.413  -0.786
    8   HG22  VAL   1          1HG2      VAL   1   1.655   2.150  -0.748
    9   HG23  VAL   1          2HG2      VAL   1   1.961   1.202  -2.223
   10    H    PHE   2           HN       PHE   2   5.563  -0.798   0.448
   11    HA   PHE   2           HA       PHE   2   7.188   1.066   1.928
   12    HB2  PHE   2           2HB      PHE   2   7.025  -1.919   2.642
   13    HB3  PHE   2           3HB      PHE   2   7.974  -0.711   3.484
   14    HD1  PHE   2           HD1      PHE   2   6.798   1.055   4.822
   15    HD2  PHE   2           HD2      PHE   2   4.743  -2.276   3.181
   16    HE1  PHE   2           HE1      PHE   2   4.889   1.453   6.402
   17    HE2  PHE   2           HE2      PHE   2   2.834  -1.877   4.761
   18    HZ   PHE   2           HZ       PHE   2   2.930  -0.017   6.353
   19    H    HIS   3           HN       HIS   3   7.328   0.751  -0.756
   20    HA   HIS   3           HA       HIS   3   9.938  -0.090  -1.150
   21    HB2  HIS   3           2HB      HIS   3   9.335  -2.350  -0.968
   22    HB3  HIS   3           3HB      HIS   3   7.830  -2.126  -1.837
   23    HD1  HIS   3           HD1      HIS   3  10.951  -3.661  -2.330
   24    HD2  HIS   3           HD2      HIS   3   8.612  -1.114  -4.705
   25    HE1  HIS   3           HE1      HIS   3  11.735  -4.004  -4.734
   26    H    ALA   4           HN       ALA   4   6.650   0.418  -2.491
   27    HA   ALA   4           HA       ALA   4   7.529   1.129  -5.076
   28    HB1  ALA   4           1HB      ALA   4   5.294   1.353  -5.490
   29    HB2  ALA   4           2HB      ALA   4   5.142   0.512  -3.928
   30    HB3  ALA   4           3HB      ALA   4   5.004   2.285  -4.001
   31    H    TYR   5           HN       TYR   5   7.482   2.751  -1.965
   32    HA   TYR   5           HA       TYR   5   7.373   5.403  -2.914
   33    HB2  TYR   5           2HB      TYR   5   8.355   3.862  -0.460
   34    HB3  TYR   5           3HB      TYR   5   8.659   5.585  -0.549
   35    HD1  TYR   5           HD2      TYR   5   6.816   7.202  -0.407
   36    HD2  TYR   5           HD1      TYR   5   6.093   2.994  -0.140
   37    HE1  TYR   5           HE2      TYR   5   4.490   7.653   0.516
   38    HE2  TYR   5           HE1      TYR   5   3.769   3.459   0.782
   39    HH   TYR   5           HH       TYR   5   2.238   6.258   0.478
   40    H    SER   6           HN       SER   6   9.303   6.972  -2.424
   41    HA   SER   6           HA       SER   6  11.499   5.925  -3.959
   42    HB2  SER   6           2HB      SER   6  10.793   8.728  -2.994
   43    HB3  SER   6           3HB      SER   6  12.256   8.368  -3.889
   44    HG   SER   6           HG       SER   6   9.627   7.673  -4.871
   45    H    ALA   7           HN       ALA   7  12.739   4.618  -2.563
   46    HA   ALA   7           HA       ALA   7  13.238   5.200   0.112
   47    HB1  ALA   7           1HB      ALA   7  14.440   3.444  -2.011
   48    HB2  ALA   7           2HB      ALA   7  15.320   3.654  -0.478
   49    HB3  ALA   7           3HB      ALA   7  13.664   2.999  -0.472
   50    H    ARG   8           HN       ARG   8  14.801   6.262  -2.921
   51    HA   ARG   8           HA       ARG   8  17.116   7.222  -1.737
   52    HB2  ARG   8           2HB      ARG   8  15.733   7.442  -4.350
   53    HB3  ARG   8           3HB      ARG   8  16.665   8.874  -3.960
   54    HG2  ARG   8           2HG      ARG   8  18.342   7.610  -4.945
   55    HG3  ARG   8           3HG      ARG   8  18.537   7.074  -3.288
   56    HD2  ARG   8           2HD      ARG   8  16.784   5.634  -5.336
   57    HD3  ARG   8           3HD      ARG   8  18.445   5.190  -4.997
   58    HE   ARG   8           HE       ARG   8  16.744   5.339  -2.604
   59   HH11  ARG   8          2HH2      ARG   8  17.938   3.248  -5.204
   60   HH12  ARG   8          1HH2      ARG   8  17.643   1.783  -4.330
   61   HH22  ARG   8          HH1       ARG   8  16.711   1.899  -2.125
   62    H    GLY   9           HN       GLY   9  13.852   8.274  -1.515
   63    HA2  GLY   9           1HA      GLY   9  14.617  11.061  -0.939
   64    HA3  GLY   9           2HA      GLY   9  13.007  10.477  -1.307
   65    H    VAL  10           HN       VAL  10  13.214   8.052   0.424
   66    HA   VAL  10           HA       VAL  10  12.289   9.230   2.809
   67    HB   VAL  10           HB       VAL  10  11.855   6.917   1.603
   68   HG11  VAL  10          1HG1      VAL  10  14.043   6.265   3.603
   69   HG12  VAL  10          2HG1      VAL  10  12.946   5.064   2.880
   70   HG13  VAL  10          3HG1      VAL  10  14.067   5.983   1.846
   71   HG21  VAL  10          3HG2      VAL  10  11.422   6.121   4.204
   72   HG22  VAL  10          1HG2      VAL  10  11.502   7.893   4.354
   73   HG23  VAL  10          2HG2      VAL  10  10.332   7.146   3.240
   74    H    ARG  11           HN       ARG  11  15.328   7.460   1.930
   75    HA   ARG  11           HA       ARG  11  16.415   7.671   4.471
   76    HB2  ARG  11           2HB      ARG  11  18.570   7.090   3.337
   77    HB3  ARG  11           3HB      ARG  11  17.256   6.065   2.794
   78    HG2  ARG  11           2HG      ARG  11  16.981   7.945   0.911
   79    HG3  ARG  11           3HG      ARG  11  18.647   8.307   1.317
   80    HD2  ARG  11           2HD      ARG  11  17.515   5.682   0.267
   81    HD3  ARG  11           3HD      ARG  11  18.736   6.697  -0.475
   82    HE   ARG  11           HE       ARG  11  19.807   5.996   2.018
   83   HH11  ARG  11          2HH2      ARG  11  18.671   4.231  -0.837
   84   HH12  ARG  11          1HH2      ARG  11  19.740   2.892  -0.587
   85   HH22  ARG  11          HH1       ARG  11  21.229   2.911   1.291
   86    H    ASN  12           HN       ASN  12  16.574   9.749   1.532
   87    HA   ASN  12           HA       ASN  12  18.587  11.419   2.354
   88    HB2  ASN  12           2HB      ASN  12  16.294  11.551   0.431
   89    HB3  ASN  12           3HB      ASN  12  16.922  13.111   0.926
   90   HD21  ASN  12          1HD2      ASN  12  18.195   9.881   0.106
   91   HD22  ASN  12          2HD2      ASN  12  19.453  10.407  -0.962
   92    H    ASN  13           HN       ASN  13  15.279  11.021   3.454
   93    HA   ASN  13           HA       ASN  13  15.151  13.667   4.561
   94    HB2  ASN  13           2HB      ASN  13  13.279  11.297   4.344
   95    HB3  ASN  13           3HB      ASN  13  12.956  12.483   5.593
   96   HD21  ASN  13          1HD2      ASN  13  14.439  13.022   2.429
   97   HD22  ASN  13          2HD2      ASN  13  13.207  14.045   1.767
   98    H    TYR  14           HN       TYR  14  16.284  10.487   5.360
   99    HA   TYR  14           HA       TYR  14  15.799  10.657   8.187
  100    HB2  TYR  14           2HB      TYR  14  16.230   8.402   7.835
  101    HB3  TYR  14           3HB      TYR  14  16.519   8.760   6.144
  102    HD1  TYR  14           HD2      TYR  14  18.362   9.135   9.403
  103    HD2  TYR  14           HD1      TYR  14  18.526   8.003   5.280
  104    HE1  TYR  14           HE2      TYR  14  20.803   8.475   9.673
  105    HE2  TYR  14           HE1      TYR  14  20.966   7.346   5.565
  106    HH   TYR  14           HH       TYR  14  22.744   8.193   8.369
  107    H    LYS  15           HN       LYS  15  18.596  11.057   5.930
  108    HA   LYS  15           HA       LYS  15  20.546  11.371   7.876
  109    HB2  LYS  15           2HB      LYS  15  21.711  12.685   5.993
  110    HB3  LYS  15           3HB      LYS  15  21.318  11.000   5.715
  111    HG2  LYS  15           2HG      LYS  15  19.831  11.497   4.052
  112    HG3  LYS  15           3HG      LYS  15  19.097  12.796   4.970
  113    HD2  LYS  15           2HD      LYS  15  21.825  13.087   3.641
  114    HD3  LYS  15           3HD      LYS  15  20.334  13.465   2.803
  115    HE2  LYS  15           2HE      LYS  15  19.995  14.827   5.206
  116    HE3  LYS  15           3HE      LYS  15  21.723  14.971   4.953
  117    HZ1  LYS  15           2HZ      LYS  15  21.405  16.180   3.027
  118    HZ3  LYS  15           1HZ      LYS  15  20.065  16.648   3.826
  119    H    SER  16           HN       SER  16  17.849  13.385   7.033
  120    HA   SER  16           HA       SER  16  19.042  15.827   7.779
  121    HB2  SER  16           2HB      SER  16  17.197  16.403   6.585
  122    HB3  SER  16           3HB      SER  16  16.420  14.859   6.878
  123    HG   SER  16           HG       SER  16  15.134  15.919   8.213
  124    H    ALA  17           HN       ALA  17  16.765  13.494   9.382
  125    HA   ALA  17           HA       ALA  17  16.590  14.924  11.789
  126    HB1  ALA  17           1HB      ALA  17  15.274  13.153  12.470
  127    HB2  ALA  17           2HB      ALA  17  15.220  12.899  10.709
  128    HB3  ALA  17           3HB      ALA  17  16.329  11.936  11.714
  129    H    VAL  18           HN       VAL  18  19.192  13.226  10.327
  130    HA   VAL  18           HA       VAL  18  20.369  12.276  12.758
  131    HB   VAL  18           HB       VAL  18  21.110  12.419   9.863
  132   HG11  VAL  18          1HG1      VAL  18  23.275  11.136  10.934
  133   HG12  VAL  18          2HG1      VAL  18  23.259  12.837  10.407
  134   HG13  VAL  18          3HG1      VAL  18  23.011  12.434  12.123
  135   HG21  VAL  18          3HG2      VAL  18  20.237  10.364  10.013
  136   HG22  VAL  18          1HG2      VAL  18  21.701   9.908  10.917
  137   HG23  VAL  18          2HG2      VAL  18  20.236  10.412  11.793
  138    H    GLY  19           HN       GLY  19  20.380  15.239  10.805
  139    HA2  GLY  19           1HA      GLY  19  22.745  16.417  11.631
  140    HA3  GLY  19           2HA      GLY  19  21.278  17.263  11.180
  141    HA   PRO  20           HA       PRO  20  20.414  18.145  15.355
  142    HB2  PRO  20           2HB      PRO  20  17.806  17.479  15.830
  143    HB3  PRO  20           3HB      PRO  20  18.283  18.924  14.961
  144    HG2  PRO  20           2HG      PRO  20  17.153  16.410  13.895
  145    HG3  PRO  20           3HG      PRO  20  17.237  17.986  13.133
  146    HD2  PRO  20           2HD      PRO  20  18.911  15.723  12.583
  147    HD3  PRO  20           3HD      PRO  20  19.068  17.332  11.906
  148    H    ALA  21           HN       ALA  21  19.833  14.868  14.502
  149    HA   ALA  21           HA       ALA  21  19.384  13.790  16.997
  150    HB1  ALA  21           1HB      ALA  21  19.152  12.496  14.969
  151    HB2  ALA  21           2HB      ALA  21  20.871  12.723  14.567
  152    HB3  ALA  21           3HB      ALA  21  20.409  11.725  15.966
  153    H    ASP  22           HN       ASP  22  22.272  15.261  15.625
  154    HA   ASP  22           HA       ASP  22  24.097  13.972  17.316
  155    HB2  ASP  22           2HB      ASP  22  24.285  15.606  15.123
  156    HB3  ASP  22           3HB      ASP  22  24.661  16.764  16.383
  157    HD2  ASP  22           HD2      ASP  22  27.161  15.325  17.723
  158    H    TRP  23           HN       TRP  23  21.984  16.847  17.500
  159    HA   TRP  23           HA       TRP  23  23.266  18.015  19.751
  160    HB2  TRP  23           2HB      TRP  23  21.711  19.662  19.585
  161    HB3  TRP  23           3HB      TRP  23  21.693  19.048  17.944
  162    HD1  TRP  23           HD1      TRP  23  19.284  18.612  17.041
  163    HE1  TRP  23           HE1      TRP  23  16.867  18.145  17.990
  164    HE3  TRP  23           HE3      TRP  23  20.669  18.420  21.930
  165    HZ2  TRP  23           HZ2      TRP  23  15.828  17.756  20.620
  166    HZ3  TRP  23           HZ3      TRP  23  18.892  17.992  23.625
  167    HH2  TRP  23           HH2      TRP  23  16.542  17.665  23.037
  168    H    VAL  24           HN       VAL  24  20.259  16.041  19.222
  169    HA   VAL  24           HA       VAL  24  19.515  15.875  21.883
  170    HB   VAL  24           HB       VAL  24  18.652  14.933  19.409
  171   HG11  VAL  24          1HG1      VAL  24  18.070  12.539  19.938
  172   HG12  VAL  24          2HG1      VAL  24  19.794  12.837  19.611
  173   HG13  VAL  24          3HG1      VAL  24  19.230  12.622  21.286
  174   HG21  VAL  24          3HG2      VAL  24  16.847  13.904  21.246
  175   HG22  VAL  24          1HG2      VAL  24  17.642  15.220  22.143
  176   HG23  VAL  24          2HG2      VAL  24  16.848  15.557  20.586
  177    H    ILE  25           HN       ILE  25  21.528  13.599  19.893
  178    HA   ILE  25           HA       ILE  25  22.051  11.839  21.991
  179    HB   ILE  25           HB       ILE  25  22.401  11.737  19.381
  180   HG12  ILE  25          2HG1      ILE  25  24.431  10.022  20.270
  181   HG13  ILE  25          3HG1      ILE  25  23.372  10.202  21.655
  182   HG21  ILE  25          1HG2      ILE  25  24.311  13.515  19.740
  183   HG22  ILE  25          2HG2      ILE  25  25.279  12.073  20.129
  184   HG23  ILE  25          3HG2      ILE  25  24.482  12.208  18.543
  185   HD11  ILE  25          3HD1      ILE  25  22.806   8.342  19.922
  186   HD12  ILE  25          1HD1      ILE  25  21.475   9.383  20.480
  187   HD13  ILE  25          2HD1      ILE  25  22.225   9.673  18.893
  188    H    SER  26           HN       SER  26  23.526  14.934  21.003
  189    HA   SER  26           HA       SER  26  25.833  14.645  22.536
  190    HB2  SER  26           2HB      SER  26  25.911  16.322  20.877
  191    HB3  SER  26           3HB      SER  26  24.347  16.978  21.317
  192    HG   SER  26           HG       SER  26  25.983  18.396  22.062
  193    H    ALA  27           HN       ALA  27  22.578  16.076  23.181
  194    HA   ALA  27           HA       ALA  27  23.267  17.015  25.767
  195    HB1  ALA  27           1HB      ALA  27  20.549  16.408  24.532
  196    HB2  ALA  27           2HB      ALA  27  20.861  17.434  25.953
  197    HB3  ALA  27           3HB      ALA  27  21.441  17.938  24.347
  198    H    VAL  28           HN       VAL  28  22.157  13.941  24.381
  199    HA   VAL  28           HA       VAL  28  21.165  12.806  26.739
  200    HB   VAL  28           HB       VAL  28  22.392  11.586  24.260
  201   HG11  VAL  28          1HG1      VAL  28  21.929   9.497  24.995
  202   HG12  VAL  28          2HG1      VAL  28  22.066  10.247  26.603
  203   HG13  VAL  28          3HG1      VAL  28  20.464  10.011  25.865
  204   HG21  VAL  28          3HG2      VAL  28  19.519  11.290  24.601
  205   HG22  VAL  28          1HG2      VAL  28  20.002  13.003  24.597
  206   HG23  VAL  28          2HG2      VAL  28  20.442  11.951  23.231
  207    H    ARG  29           HN       ARG  29  24.435  12.651  25.172
  208    HA   ARG  29           HA       ARG  29  25.495  11.127  27.265
  209    HB2  ARG  29           2HB      ARG  29  27.504  11.212  26.049
  210    HB3  ARG  29           3HB      ARG  29  26.339  11.539  24.782
  211    HG2  ARG  29           2HG      ARG  29  26.711  14.083  25.542
  212    HG3  ARG  29           3HG      ARG  29  28.221  13.453  26.169
  213    HD2  ARG  29           2HD      ARG  29  27.384  13.873  23.356
  214    HD3  ARG  29           3HD      ARG  29  28.996  13.832  24.042
  215    HE   ARG  29           HE       ARG  29  27.461  11.517  23.015
  216   HH11  ARG  29          2HH2      ARG  29  30.348  12.647  24.730
  217   HH12  ARG  29          1HH2      ARG  29  31.225  11.175  24.479
  218   HH22  ARG  29          HH1       ARG  29  30.187   9.381  23.274
  219    H    GLY  30           HN       GLY  30  24.961  14.572  26.708
  220    HA2  GLY  30           1HA      GLY  30  26.908  15.536  28.572
  221    HA3  GLY  30           2HA      GLY  30  25.600  16.433  27.827
  222    H    PHE  31           HN       PHE  31  23.448  14.569  28.674
  223    HA   PHE  31           HA       PHE  31  23.072  15.663  31.289
  224    HB2  PHE  31           2HB      PHE  31  21.025  15.508  30.160
  225    HB3  PHE  31           3HB      PHE  31  21.601  14.216  29.125
  226    HD1  PHE  31           HD1      PHE  31  20.113  14.979  32.406
  227    HD2  PHE  31           HD2      PHE  31  21.186  11.924  29.663
  228    HE1  PHE  31           HE1      PHE  31  18.763  13.323  33.722
  229    HE2  PHE  31           HE2      PHE  31  19.836  10.268  30.980
  230    HZ   PHE  31           HZ       PHE  31  18.640  10.987  32.994
  231    H    ILE  32           HN       ILE  32  24.159  12.603  29.885
  232    HA   ILE  32           HA       ILE  32  23.517  10.888  31.966
  233    HB   ILE  32           HB       ILE  32  24.595  10.607  29.545
  234   HG12  ILE  32          2HG1      ILE  32  25.401   8.425  31.366
  235   HG13  ILE  32          3HG1      ILE  32  23.738   8.947  31.548
  236   HG21  ILE  32          1HG2      ILE  32  26.879  10.058  29.532
  237   HG22  ILE  32          2HG2      ILE  32  26.776  11.585  30.441
  238   HG23  ILE  32          3HG2      ILE  32  26.979  10.044  31.309
  239   HD11  ILE  32          3HD1      ILE  32  25.059   8.140  28.916
  240   HD12  ILE  32          1HD1      ILE  32  23.909   7.156  29.852
  241   HD13  ILE  32          2HD1      ILE  32  23.372   8.676  29.097
  242    H    HIS  33           HN       HIS  33  26.292  13.131  31.500
  243    HA   HIS  33           HA       HIS  33  27.474  12.250  33.966
  244    HB2  HIS  33           2HB      HIS  33  29.239  13.797  33.451
  245    HB3  HIS  33           3HB      HIS  33  28.844  12.876  32.014
  246    HD1  HIS  33           HD1      HIS  33  28.501  16.351  33.491
  247    HD2  HIS  33           HD2      HIS  33  27.917  14.372  29.839
  248    HE1  HIS  33           HE1      HIS  33  28.104  18.171  31.747
  249    H    GLY  34           HN       GLY  34  24.964  14.376  33.002
  250    HA2  GLY  34           1HA      GLY  34  25.320  16.499  34.829
  251    HA3  GLY  34           2HA      GLY  34  23.830  16.015  34.044
  Start of MODEL   15
    1    H1   VAL   1           HN       VAL   1   5.290   7.980  -3.324
    2    HA   VAL   1           HA       VAL   1   4.378   7.633  -0.775
    3    HB   VAL   1           HB       VAL   1   5.209   5.118  -0.611
    4   HG11  VAL   1          1HG1      VAL   1   2.871   6.368  -0.199
    5   HG12  VAL   1          2HG1      VAL   1   2.398   5.348  -1.578
    6   HG13  VAL   1          3HG1      VAL   1   3.047   4.599  -0.100
    7   HG21  VAL   1          3HG2      VAL   1   5.359   5.322  -3.297
    8   HG22  VAL   1          1HG2      VAL   1   5.000   3.798  -2.449
    9   HG23  VAL   1          2HG2      VAL   1   3.675   4.769  -3.135
   10    H    PHE   2           HN       PHE   2   6.263   6.773   0.709
   11    HA   PHE   2           HA       PHE   2   8.848   6.774  -0.474
   12    HB2  PHE   2           2HB      PHE   2   7.768   9.169   1.125
   13    HB3  PHE   2           3HB      PHE   2   9.481   8.919   0.854
   14    HD1  PHE   2           HD2      PHE   2  10.409   9.102  -1.437
   15    HD2  PHE   2           HD1      PHE   2   6.355  10.034  -0.602
   16    HE1  PHE   2           HE2      PHE   2  10.244  10.334  -3.617
   17    HE2  PHE   2           HE1      PHE   2   6.189  11.267  -2.782
   18    HZ   PHE   2           HZ       PHE   2   8.136  11.402  -4.264
   19    H    HIS   3           HN       HIS   3   7.727   4.811   1.031
   20    HA   HIS   3           HA       HIS   3   9.502   4.567   3.143
   21    HB2  HIS   3           2HB      HIS   3   8.366   6.118   4.458
   22    HB3  HIS   3           3HB      HIS   3   6.788   5.624   3.877
   23    HD1  HIS   3           HD1      HIS   3   8.895   5.336   6.765
   24    HD2  HIS   3           HD2      HIS   3   6.202   2.776   4.819
   25    HE1  HIS   3           HE1      HIS   3   8.265   3.538   8.462
   26    H    ALA   4           HN       ALA   4   6.315   3.751   1.713
   27    HA   ALA   4           HA       ALA   4   6.109   1.184   2.800
   28    HB1  ALA   4           1HB      ALA   4   5.076   1.996   0.072
   29    HB2  ALA   4           2HB      ALA   4   4.328   0.920   1.276
   30    HB3  ALA   4           3HB      ALA   4   4.380   2.676   1.562
   31    H    TYR   5           HN       TYR   5   8.322   2.536   0.518
   32    HA   TYR   5           HA       TYR   5   9.651   0.064   0.207
   33    HB2  TYR   5           2HB      TYR   5   9.091  -0.369  -2.104
   34    HB3  TYR   5           3HB      TYR   5   7.545   0.066  -1.403
   35    HD1  TYR   5           HD2      TYR   5   7.638   2.988  -1.266
   36    HD2  TYR   5           HD1      TYR   5   9.086   0.359  -4.315
   37    HE1  TYR   5           HE2      TYR   5   7.382   4.837  -2.992
   38    HE2  TYR   5           HE1      TYR   5   8.825   2.217  -6.031
   39    HH   TYR   5           HH       TYR   5   8.818   4.723  -5.980
   40    H    SER   6           HN       SER   6  10.705   0.884  -2.508
   41    HA   SER   6           HA       SER   6  12.581   1.871  -3.093
   42    HB2  SER   6           2HB      SER   6  10.859   4.271  -2.338
   43    HB3  SER   6           3HB      SER   6  12.340   4.404  -3.265
   44    HG   SER   6           HG       SER   6  11.419   3.134  -4.938
   45    H    ALA   7           HN       ALA   7  14.141   1.190  -1.541
   46    HA   ALA   7           HA       ALA   7  14.367   2.235   1.026
   47    HB1  ALA   7           1HB      ALA   7  15.527   0.256   0.706
   48    HB2  ALA   7           2HB      ALA   7  16.132   0.743  -0.896
   49    HB3  ALA   7           3HB      ALA   7  16.861   1.428   0.577
   50    H    ARG   8           HN       ARG   8  15.534   3.379  -2.152
   51    HA   ARG   8           HA       ARG   8  17.376   5.194  -1.178
   52    HB2  ARG   8           2HB      ARG   8  15.910   4.723  -3.739
   53    HB3  ARG   8           3HB      ARG   8  16.471   6.368  -3.519
   54    HG2  ARG   8           2HG      ARG   8  18.358   5.415  -4.509
   55    HG3  ARG   8           3HG      ARG   8  18.755   5.205  -2.815
   56    HD2  ARG   8           2HD      ARG   8  17.319   3.064  -4.451
   57    HD3  ARG   8           3HD      ARG   8  19.063   3.129  -4.297
   58    HE   ARG   8           HE       ARG   8  17.568   3.165  -1.748
   59   HH11  ARG   8          2HH2      ARG   8  19.303   1.202  -4.133
   60   HH12  ARG   8          1HH2      ARG   8  19.582  -0.109  -3.035
   61   HH22  ARG   8          HH1       ARG   8  18.769   0.051  -0.786
   62    H    GLY   9           HN       GLY   9  13.947   5.117  -0.928
   63    HA2  GLY   9           1HA      GLY   9  13.722   8.043  -0.695
   64    HA3  GLY   9           2HA      GLY   9  12.405   6.902  -0.881
   65    H    VAL  10           HN       VAL  10  13.385   4.930   1.083
   66    HA   VAL  10           HA       VAL  10  12.258   6.103   3.395
   67    HB   VAL  10           HB       VAL  10  12.395   3.629   2.465
   68   HG11  VAL  10          1HG1      VAL  10  14.759   3.802   4.362
   69   HG12  VAL  10          2HG1      VAL  10  13.988   2.283   3.844
   70   HG13  VAL  10          3HG1      VAL  10  14.784   3.331   2.645
   71   HG21  VAL  10          3HG2      VAL  10  11.274   3.038   4.349
   72   HG22  VAL  10          1HG2      VAL  10  12.525   3.693   5.433
   73   HG23  VAL  10          2HG2      VAL  10  11.348   4.787   4.669
   74    H    ARG  11           HN       ARG  11  15.611   5.082   2.470
   75    HA   ARG  11           HA       ARG  11  16.768   5.763   4.860
   76    HB2  ARG  11           2HB      ARG  11  18.903   5.789   3.587
   77    HB3  ARG  11           3HB      ARG  11  17.902   4.441   3.084
   78    HG2  ARG  11           2HG      ARG  11  17.004   6.141   1.252
   79    HG3  ARG  11           3HG      ARG  11  18.476   7.023   1.606
   80    HD2  ARG  11           2HD      ARG  11  18.179   4.236   0.447
   81    HD3  ARG  11           3HD      ARG  11  19.112   5.584  -0.174
   82    HE   ARG  11           HE       ARG  11  20.259   5.036   2.316
   83   HH11  ARG  11          2HH2      ARG  11  19.681   3.179  -0.646
   84   HH12  ARG  11          1HH2      ARG  11  21.047   2.141  -0.409
   85   HH22  ARG  11          HH1       ARG  11  22.432   2.446   1.522
   86    H    ASN  12           HN       ASN  12  16.051   7.707   1.914
   87    HA   ASN  12           HA       ASN  12  17.520   9.930   2.550
   88    HB2  ASN  12           2HB      ASN  12  15.187   9.278   0.813
   89    HB3  ASN  12           3HB      ASN  12  15.250  10.963   1.292
   90   HD21  ASN  12          1HD2      ASN  12  17.346   8.336   0.125
   91   HD22  ASN  12          2HD2      ASN  12  18.323   9.289  -0.943
   92    H    ASN  13           HN       ASN  13  14.591   8.584   3.938
   93    HA   ASN  13           HA       ASN  13  13.762  11.096   5.053
   94    HB2  ASN  13           2HB      ASN  13  12.659   8.334   5.745
   95    HB3  ASN  13           3HB      ASN  13  11.834   9.875   5.877
   96   HD21  ASN  13          1HD2      ASN  13  12.720  10.981   3.410
   97   HD22  ASN  13          2HD2      ASN  13  11.913  10.167   2.112
   98    H    TYR  14           HN       TYR  14  15.854   8.411   5.756
   99    HA   TYR  14           HA       TYR  14  15.594   8.532   8.616
  100    HB2  TYR  14           2HB      TYR  14  16.641   6.490   8.248
  101    HB3  TYR  14           3HB      TYR  14  16.642   6.849   6.533
  102    HD1  TYR  14           HD2      TYR  14  18.609   7.867   9.574
  103    HD2  TYR  14           HD1      TYR  14  18.686   6.684   5.463
  104    HE1  TYR  14           HE2      TYR  14  21.150   7.958   9.587
  105    HE2  TYR  14           HE1      TYR  14  21.226   6.779   5.490
  106    HH   TYR  14           HH       TYR  14  23.011   6.537   7.832
  107    H    LYS  15           HN       LYS  15  17.948   9.637   6.102
  108    HA   LYS  15           HA       LYS  15  19.883  10.573   7.851
  109    HB2  LYS  15           2HB      LYS  15  20.445  12.099   5.855
  110    HB3  LYS  15           3HB      LYS  15  20.536  10.364   5.629
  111    HG2  LYS  15           2HG      LYS  15  18.812  10.344   4.123
  112    HG3  LYS  15           3HG      LYS  15  17.835  11.437   5.083
  113    HD2  LYS  15           2HD      LYS  15  20.255  12.634   3.774
  114    HD3  LYS  15           3HD      LYS  15  18.963  12.139   2.699
  115    HE2  LYS  15           2HE      LYS  15  17.495  13.751   3.482
  116    HE3  LYS  15           3HE      LYS  15  18.094  13.658   5.126
  117    HZ1  LYS  15           2HZ      LYS  15  19.755  15.168   4.674
  118    HZ3  LYS  15           1HZ      LYS  15  18.670  15.703   3.583
  119    H    SER  16           HN       SER  16  16.655  11.694   7.243
  120    HA   SER  16           HA       SER  16  17.147  14.399   7.857
  121    HB2  SER  16           2HB      SER  16  15.113  13.220   6.636
  122    HB3  SER  16           3HB      SER  16  14.467  13.052   8.257
  123    HG   SER  16           HG       SER  16  13.921  15.116   8.233
  124    H    ALA  17           HN       ALA  17  15.782  11.570   9.681
  125    HA   ALA  17           HA       ALA  17  15.412  12.972  12.082
  126    HB1  ALA  17           1HB      ALA  17  14.202  10.983  11.883
  127    HB2  ALA  17           2HB      ALA  17  15.595  10.078  11.244
  128    HB3  ALA  17           3HB      ALA  17  15.526  10.502  12.972
  129    H    VAL  18           HN       VAL  18  18.256  12.034  10.401
  130    HA   VAL  18           HA       VAL  18  19.859  11.541  12.721
  131    HB   VAL  18           HB       VAL  18  20.277  11.790   9.770
  132   HG11  VAL  18          1HG1      VAL  18  22.256  12.819  10.111
  133   HG12  VAL  18          2HG1      VAL  18  22.281  12.420  11.846
  134   HG13  VAL  18          3HG1      VAL  18  22.802  11.212  10.647
  135   HG21  VAL  18          3HG2      VAL  18  20.049   9.578  10.013
  136   HG22  VAL  18          1HG2      VAL  18  21.650   9.587  10.790
  137   HG23  VAL  18          2HG2      VAL  18  20.176   9.684  11.785
  138    H    GLY  19           HN       GLY  19  18.854  14.316  10.752
  139    HA2  GLY  19           1HA      GLY  19  20.846  16.146  11.348
  140    HA3  GLY  19           2HA      GLY  19  19.166  16.524  11.026
  141    HA   PRO  20           HA       PRO  20  18.446  17.266  15.256
  142    HB2  PRO  20           2HB      PRO  20  16.188  15.903  15.973
  143    HB3  PRO  20           3HB      PRO  20  16.156  17.394  15.053
  144    HG2  PRO  20           2HG      PRO  20  15.705  14.627  14.115
  145    HG3  PRO  20           3HG      PRO  20  15.269  16.135  13.336
  146    HD2  PRO  20           2HD      PRO  20  17.467  14.423  12.653
  147    HD3  PRO  20           3HD      PRO  20  17.098  15.987  11.952
  148    H    ALA  21           HN       ALA  21  18.755  13.932  14.486
  149    HA   ALA  21           HA       ALA  21  18.848  12.856  17.020
  150    HB1  ALA  21           1HB      ALA  21  20.364  12.174  14.473
  151    HB2  ALA  21           2HB      ALA  21  20.330  11.134  15.917
  152    HB3  ALA  21           3HB      ALA  21  18.824  11.480  15.034
  153    H    ASP  22           HN       ASP  22  21.068  15.038  15.377
  154    HA   ASP  22           HA       ASP  22  23.323  14.379  16.904
  155    HB2  ASP  22           2HB      ASP  22  22.846  15.924  14.691
  156    HB3  ASP  22           3HB      ASP  22  22.982  17.183  15.902
  157    HD2  ASP  22           HD2      ASP  22  25.515  17.713  14.902
  158    H    TRP  23           HN       TRP  23  20.499  16.541  17.259
  159    HA   TRP  23           HA       TRP  23  21.581  18.099  19.374
  160    HB2  TRP  23           2HB      TRP  23  19.613  19.230  19.338
  161    HB3  TRP  23           3HB      TRP  23  19.631  18.582  17.710
  162    HD1  TRP  23           HD1      TRP  23  17.379  17.451  17.034
  163    HE1  TRP  23           HE1      TRP  23  15.286  16.348  18.203
  164    HE3  TRP  23           HE3      TRP  23  19.172  17.823  21.778
  165    HZ2  TRP  23           HZ2      TRP  23  14.629  15.769  20.919
  166    HZ3  TRP  23           HZ3      TRP  23  17.742  16.965  23.630
  167    HH2  TRP  23           HH2      TRP  23  15.543  15.965  23.262
  168    H    VAL  24           HN       VAL  24  19.229  15.336  19.136
  169    HA   VAL  24           HA       VAL  24  18.794  15.055  21.856
  170    HB   VAL  24           HB       VAL  24  18.028  13.825  19.478
  171   HG11  VAL  24          1HG1      VAL  24  19.734  12.147  19.592
  172   HG12  VAL  24          2HG1      VAL  24  19.399  11.836  21.312
  173   HG13  VAL  24          3HG1      VAL  24  18.201  11.382  20.077
  174   HG21  VAL  24          3HG2      VAL  24  16.229  13.954  20.811
  175   HG22  VAL  24          1HG2      VAL  24  16.753  12.388  21.476
  176   HG23  VAL  24          2HG2      VAL  24  17.216  13.901  22.291
  177    H    ILE  25           HN       ILE  25  21.195  13.378  19.708
  178    HA   ILE  25           HA       ILE  25  22.377  11.911  21.764
  179    HB   ILE  25           HB       ILE  25  22.517  11.824  19.133
  180   HG12  ILE  25          2HG1      ILE  25  24.851  10.615  19.573
  181   HG13  ILE  25          3HG1      ILE  25  24.398  10.859  21.248
  182   HG21  ILE  25          1HG2      ILE  25  24.297  12.837  18.105
  183   HG22  ILE  25          2HG2      ILE  25  23.863  14.082  19.301
  184   HG23  ILE  25          3HG2      ILE  25  25.231  12.988  19.613
  185   HD11  ILE  25          3HD1      ILE  25  23.589   8.707  19.813
  186   HD12  ILE  25          1HD1      ILE  25  22.616   9.395  21.134
  187   HD13  ILE  25          2HD1      ILE  25  22.245   9.814  19.445
  188    H    SER  26           HN       SER  26  22.817  15.261  20.619
  189    HA   SER  26           HA       SER  26  25.232  15.691  21.937
  190    HB2  SER  26           2HB      SER  26  24.677  17.260  20.259
  191    HB3  SER  26           3HB      SER  26  23.041  17.470  20.850
  192    HG   SER  26           HG       SER  26  24.654  19.247  21.306
  193    H    ALA  27           HN       ALA  27  21.772  16.160  22.867
  194    HA   ALA  27           HA       ALA  27  22.382  17.342  25.371
  195    HB1  ALA  27           1HB      ALA  27  19.806  16.111  25.392
  196    HB2  ALA  27           2HB      ALA  27  20.202  17.829  25.146
  197    HB3  ALA  27           3HB      ALA  27  20.084  16.734  23.748
  198    H    VAL  28           HN       VAL  28  22.084  14.035  24.117
  199    HA   VAL  28           HA       VAL  28  21.664  12.746  26.566
  200    HB   VAL  28           HB       VAL  28  22.972  11.839  23.995
  201   HG11  VAL  28          1HG1      VAL  28  23.114   9.700  24.765
  202   HG12  VAL  28          2HG1      VAL  28  23.297  10.536  26.326
  203   HG13  VAL  28          3HG1      VAL  28  21.714   9.876  25.850
  204   HG21  VAL  28          3HG2      VAL  28  20.302  12.517  24.566
  205   HG22  VAL  28          1HG2      VAL  28  20.919  11.646  23.141
  206   HG23  VAL  28          2HG2      VAL  28  20.353  10.737  24.563
  207    H    ARG  29           HN       ARG  29  24.693  13.474  24.705
  208    HA   ARG  29           HA       ARG  29  26.321  12.384  26.701
  209    HB2  ARG  29           2HB      ARG  29  28.109  12.996  25.304
  210    HB3  ARG  29           3HB      ARG  29  26.794  12.939  24.148
  211    HG2  ARG  29           2HG      ARG  29  26.489  15.506  24.855
  212    HG3  ARG  29           3HG      ARG  29  28.164  15.350  25.345
  213    HD2  ARG  29           2HD      ARG  29  27.003  15.427  22.618
  214    HD3  ARG  29           3HD      ARG  29  28.613  15.866  23.154
  215    HE   ARG  29           HE       ARG  29  27.718  13.180  22.286
  216   HH11  ARG  29          2HH2      ARG  29  30.301  15.135  23.721
  217   HH12  ARG  29          1HH2      ARG  29  31.536  13.964  23.399
  218   HH22  ARG  29          HH1       ARG  29  30.952  11.913  22.305
  219    H    GLY  30           HN       GLY  30  24.778  15.515  26.173
  220    HA2  GLY  30           1HA      GLY  30  26.522  17.052  27.844
  221    HA3  GLY  30           2HA      GLY  30  24.952  17.516  27.216
  222    H    PHE  31           HN       PHE  31  23.502  15.149  28.269
  223    HA   PHE  31           HA       PHE  31  23.059  16.174  30.901
  224    HB2  PHE  31           2HB      PHE  31  21.051  15.412  29.965
  225    HB3  PHE  31           3HB      PHE  31  21.878  14.303  28.890
  226    HD1  PHE  31           HD1      PHE  31  20.516  14.718  32.284
  227    HD2  PHE  31           HD2      PHE  31  22.188  12.005  29.483
  228    HE1  PHE  31           HE1      PHE  31  19.811  12.791  33.730
  229    HE2  PHE  31           HE2      PHE  31  21.483  10.078  30.928
  230    HZ   PHE  31           HZ       PHE  31  20.303  10.494  33.034
  231    H    ILE  32           HN       ILE  32  24.844  13.503  29.420
  232    HA   ILE  32           HA       ILE  32  24.899  11.743  31.562
  233    HB   ILE  32           HB       ILE  32  25.798  11.701  29.054
  234   HG12  ILE  32          2HG1      ILE  32  27.341   9.894  30.809
  235   HG13  ILE  32          3HG1      ILE  32  25.619   9.930  31.133
  236   HG21  ILE  32          1HG2      ILE  32  28.386  11.889  30.595
  237   HG22  ILE  32          2HG2      ILE  32  28.135  11.815  28.834
  238   HG23  ILE  32          3HG2      ILE  32  27.681  13.280  29.737
  239   HD11  ILE  32          3HD1      ILE  32  25.138   9.476  28.736
  240   HD12  ILE  32          1HD1      ILE  32  26.884   9.460  28.393
  241   HD13  ILE  32          2HD1      ILE  32  26.170   8.207  29.437
  242    H    HIS  33           HN       HIS  33  26.873  14.661  30.827
  243    HA   HIS  33           HA       HIS  33  28.468  14.229  33.176
  244    HB2  HIS  33           2HB      HIS  33  29.666  16.195  32.492
  245    HB3  HIS  33           3HB      HIS  33  29.424  15.156  31.102
  246    HD1  HIS  33           HD1      HIS  33  28.228  18.432  32.594
  247    HD2  HIS  33           HD2      HIS  33  27.933  16.266  29.013
  248    HE1  HIS  33           HE1      HIS  33  27.179  20.012  30.887
  249    H    GLY  34           HN       GLY  34  25.381  15.527  32.441
  250    HA2  GLY  34           1HA      GLY  34  25.454  17.372  34.734
  251    HA3  GLY  34           2HA      GLY  34  24.262  17.346  33.450
  Start of MODEL   16
    1    H1   VAL   1           HN       VAL   1   2.650  -0.266  -1.609
    2    HA   VAL   1           HA       VAL   1   3.606   0.413   1.057
    3    HB   VAL   1           HB       VAL   1   5.945   0.458   0.168
    4   HG11  VAL   1          1HG1      VAL   1   6.074  -2.186   0.151
    5   HG12  VAL   1          2HG1      VAL   1   5.643  -1.295   1.630
    6   HG13  VAL   1          3HG1      VAL   1   4.369  -2.048   0.642
    7   HG21  VAL   1          3HG2      VAL   1   5.770   0.432  -2.164
    8   HG22  VAL   1          1HG2      VAL   1   6.304  -1.221  -1.775
    9   HG23  VAL   1          2HG2      VAL   1   4.595  -0.905  -2.161
   10    H    PHE   2           HN       PHE   2   4.444   2.593   1.189
   11    HA   PHE   2           HA       PHE   2   4.379   4.200  -1.187
   12    HB2  PHE   2           2HB      PHE   2   2.555   5.653  -0.328
   13    HB3  PHE   2           3HB      PHE   2   1.959   4.007  -0.420
   14    HD1  PHE   2           HD2      PHE   2   1.982   2.617   1.733
   15    HD2  PHE   2           HD1      PHE   2   2.478   6.831   1.693
   16    HE1  PHE   2           HE2      PHE   2   1.337   2.716   4.157
   17    HE2  PHE   2           HE1      PHE   2   1.833   6.930   4.117
   18    HZ   PHE   2           HZ       PHE   2   1.270   4.871   5.320
   19    H    HIS   3           HN       HIS   3   6.449   3.474   0.667
   20    HA   HIS   3           HA       HIS   3   7.481   5.983   1.226
   21    HB2  HIS   3           2HB      HIS   3   6.019   6.323   3.014
   22    HB3  HIS   3           3HB      HIS   3   6.072   4.646   3.520
   23    HD1  HIS   3           HD1      HIS   3   7.133   7.763   4.709
   24    HD2  HIS   3           HD2      HIS   3   9.082   4.075   4.268
   25    HE1  HIS   3           HE1      HIS   3   9.132   7.817   6.295
   26    H    ALA   4           HN       ALA   4   7.311   2.493   2.036
   27    HA   ALA   4           HA       ALA   4  10.023   2.304   2.831
   28    HB1  ALA   4           1HB      ALA   4   8.959  -0.177   1.814
   29    HB2  ALA   4           2HB      ALA   4   9.260   0.302   3.502
   30    HB3  ALA   4           3HB      ALA   4   7.694   0.668   2.738
   31    H    TYR   5           HN       TYR   5   8.285   2.306  -0.257
   32    HA   TYR   5           HA       TYR   5  10.186   0.998  -1.820
   33    HB2  TYR   5           2HB      TYR   5   8.822   1.928  -3.578
   34    HB3  TYR   5           3HB      TYR   5   7.719   1.906  -2.216
   35    HD1  TYR   5           HD2      TYR   5   8.537   4.256  -0.651
   36    HD2  TYR   5           HD1      TYR   5   8.235   3.763  -4.890
   37    HE1  TYR   5           HE2      TYR   5   8.161   6.756  -0.922
   38    HE2  TYR   5           HE1      TYR   5   7.860   6.264  -5.147
   39    HH   TYR   5           HH       TYR   5   8.462   8.443  -2.637
   40    H    SER   6           HN       SER   6  11.408   2.200  -3.679
   41    HA   SER   6           HA       SER   6  13.300   3.262  -4.037
   42    HB2  SER   6           2HB      SER   6  11.475   5.564  -3.223
   43    HB3  SER   6           3HB      SER   6  13.015   5.795  -4.027
   44    HG   SER   6           HG       SER   6  12.159   5.198  -5.907
   45    H    ALA   7           HN       ALA   7  14.692   2.422  -2.375
   46    HA   ALA   7           HA       ALA   7  14.710   3.367   0.251
   47    HB1  ALA   7           1HB      ALA   7  16.825   2.188   0.407
   48    HB2  ALA   7           2HB      ALA   7  15.726   1.238  -0.621
   49    HB3  ALA   7           3HB      ALA   7  17.018   2.212  -1.362
   50    H    ARG   8           HN       ARG   8  16.216   4.539  -2.771
   51    HA   ARG   8           HA       ARG   8  18.048   6.228  -1.590
   52    HB2  ARG   8           2HB      ARG   8  16.980   5.706  -4.246
   53    HB3  ARG   8           3HB      ARG   8  17.106   7.440  -4.021
   54    HG2  ARG   8           2HG      ARG   8  19.199   6.285  -4.953
   55    HG3  ARG   8           3HG      ARG   8  19.460   7.331  -3.572
   56    HD2  ARG   8           2HD      ARG   8  20.493   4.869  -3.626
   57    HD3  ARG   8           3HD      ARG   8  19.909   5.557  -2.124
   58    HE   ARG   8           HE       ARG   8  18.020   4.119  -2.191
   59   HH11  ARG   8          2HH2      ARG   8  19.920   3.825  -5.168
   60   HH12  ARG   8          1HH2      ARG   8  19.109   2.386  -5.690
   61   HH22  ARG   8          HH1       ARG   8  17.366   1.461  -4.329
   62    H    GLY   9           HN       GLY   9  14.615   6.316  -1.585
   63    HA2  GLY   9           1HA      GLY   9  14.505   9.240  -1.283
   64    HA3  GLY   9           2HA      GLY   9  13.154   8.163  -1.577
   65    H    VAL  10           HN       VAL  10  13.862   6.105   0.382
   66    HA   VAL  10           HA       VAL  10  12.686   7.299   2.658
   67    HB   VAL  10           HB       VAL  10  12.692   4.849   1.667
   68   HG11  VAL  10          1HG1      VAL  10  14.106   3.350   3.087
   69   HG12  VAL  10          2HG1      VAL  10  15.037   4.362   1.957
   70   HG13  VAL  10          3HG1      VAL  10  14.961   4.793   3.682
   71   HG21  VAL  10          3HG2      VAL  10  11.322   5.771   3.557
   72   HG22  VAL  10          1HG2      VAL  10  11.765   4.057   3.739
   73   HG23  VAL  10          2HG2      VAL  10  12.634   5.304   4.666
   74    H    ARG  11           HN       ARG  11  16.005   6.045   1.909
   75    HA   ARG  11           HA       ARG  11  17.060   6.582   4.380
   76    HB2  ARG  11           2HB      ARG  11  19.225   6.318   3.322
   77    HB3  ARG  11           3HB      ARG  11  18.122   5.254   2.473
   78    HG2  ARG  11           2HG      ARG  11  17.768   7.179   0.786
   79    HG3  ARG  11           3HG      ARG  11  19.118   7.987   1.559
   80    HD2  ARG  11           2HD      ARG  11  19.114   5.442  -0.072
   81    HD3  ARG  11           3HD      ARG  11  20.183   6.824  -0.193
   82    HE   ARG  11           HE       ARG  11  20.828   5.915   2.287
   83   HH11  ARG  11          2HH2      ARG  11  20.418   4.162  -0.764
   84   HH12  ARG  11          1HH2      ARG  11  21.549   2.919  -0.345
   85   HH22  ARG  11          HH1       ARG  11  22.655   3.005   1.779
   86    H    ASN  12           HN       ASN  12  16.671   8.646   1.454
   87    HA   ASN  12           HA       ASN  12  18.258  10.736   2.240
   88    HB2  ASN  12           2HB      ASN  12  16.007  10.296   0.342
   89    HB3  ASN  12           3HB      ASN  12  16.136  11.958   0.883
   90   HD21  ASN  12          1HD2      ASN  12  18.177   9.251  -0.204
   91   HD22  ASN  12          2HD2      ASN  12  19.265  10.175  -1.186
   92    H    ASN  13           HN       ASN  13  15.158   9.581   3.413
   93    HA   ASN  13           HA       ASN  13  14.450  12.120   4.550
   94    HB2  ASN  13           2HB      ASN  13  13.107   9.433   5.094
   95    HB3  ASN  13           3HB      ASN  13  12.391  11.028   5.223
   96   HD21  ASN  13          1HD2      ASN  13  13.504  12.127   2.847
   97   HD22  ASN  13          2HD2      ASN  13  12.719  11.408   1.480
   98    H    TYR  14           HN       TYR  14  16.288   9.265   5.297
   99    HA   TYR  14           HA       TYR  14  15.865   9.339   8.139
  100    HB2  TYR  14           2HB      TYR  14  16.776   7.231   7.778
  101    HB3  TYR  14           3HB      TYR  14  16.903   7.627   6.076
  102    HD1  TYR  14           HD2      TYR  14  18.762   8.420   9.249
  103    HD2  TYR  14           HD1      TYR  14  18.988   7.332   5.118
  104    HE1  TYR  14           HE2      TYR  14  21.297   8.314   9.408
  105    HE2  TYR  14           HE1      TYR  14  21.523   7.229   5.291
  106    HH   TYR  14           HH       TYR  14  23.214   7.033   6.803
  107    H    LYS  15           HN       LYS  15  18.438  10.325   5.797
  108    HA   LYS  15           HA       LYS  15  20.337  11.060   7.675
  109    HB2  LYS  15           2HB      LYS  15  21.120  12.597   5.765
  110    HB3  LYS  15           3HB      LYS  15  21.093  10.868   5.485
  111    HG2  LYS  15           2HG      LYS  15  19.466  11.028   3.886
  112    HG3  LYS  15           3HG      LYS  15  18.512  12.151   4.834
  113    HD2  LYS  15           2HD      LYS  15  21.074  13.233   3.717
  114    HD3  LYS  15           3HD      LYS  15  19.830  12.853   2.543
  115    HE2  LYS  15           2HE      LYS  15  18.931  14.887   3.032
  116    HE3  LYS  15           3HE      LYS  15  18.384  14.173   4.536
  117    HZ1  LYS  15           2HZ      LYS  15  19.813  15.494   5.630
  118    HZ3  LYS  15           1HZ      LYS  15  20.274  16.199   4.236
  119    H    SER  16           HN       SER  16  17.238  12.439   6.941
  120    HA   SER  16           HA       SER  16  17.896  15.081   7.668
  121    HB2  SER  16           2HB      SER  16  15.617  13.656   6.660
  122    HB3  SER  16           3HB      SER  16  15.098  14.495   8.108
  123    HG   SER  16           HG       SER  16  16.713  15.994   6.323
  124    H    ALA  17           HN       ALA  17  16.228  12.311   9.325
  125    HA   ALA  17           HA       ALA  17  15.836  13.666  11.750
  126    HB1  ALA  17           1HB      ALA  17  16.050  10.904  12.276
  127    HB2  ALA  17           2HB      ALA  17  14.564  11.820  11.930
  128    HB3  ALA  17           3HB      ALA  17  15.445  11.020  10.606
  129    H    VAL  18           HN       VAL  18  18.688  12.565  10.186
  130    HA   VAL  18           HA       VAL  18  20.123  11.883  12.567
  131    HB   VAL  18           HB       VAL  18  20.717  12.187   9.651
  132   HG11  VAL  18          1HG1      VAL  18  23.141  11.392  10.639
  133   HG12  VAL  18          2HG1      VAL  18  22.746  13.049  10.126
  134   HG13  VAL  18          3HG1      VAL  18  22.647  12.603  11.846
  135   HG21  VAL  18          3HG2      VAL  18  21.863   9.856  10.645
  136   HG22  VAL  18          1HG2      VAL  18  20.369  10.034  11.595
  137   HG23  VAL  18          2HG2      VAL  18  20.293   9.995   9.817
  138    H    GLY  19           HN       GLY  19  19.438  14.784  10.641
  139    HA2  GLY  19           1HA      GLY  19  21.524  16.437  11.400
  140    HA3  GLY  19           2HA      GLY  19  19.896  16.952  11.006
  141    HA   PRO  20           HA       PRO  20  19.008  17.621  15.215
  142    HB2  PRO  20           2HB      PRO  20  16.620  16.413  15.770
  143    HB3  PRO  20           3HB      PRO  20  16.748  17.929  14.900
  144    HG2  PRO  20           2HG      PRO  20  16.143  15.233  13.848
  145    HG3  PRO  20           3HG      PRO  20  15.863  16.792  13.099
  146    HD2  PRO  20           2HD      PRO  20  17.961  14.939  12.472
  147    HD3  PRO  20           3HD      PRO  20  17.748  16.546  11.806
  148    H    ALA  21           HN       ALA  21  19.110  14.297  14.351
  149    HA   ALA  21           HA       ALA  21  18.987  13.143  16.850
  150    HB1  ALA  21           1HB      ALA  21  20.393  11.346  15.767
  151    HB2  ALA  21           2HB      ALA  21  18.967  11.833  14.819
  152    HB3  ALA  21           3HB      ALA  21  20.583  12.423  14.362
  153    H    ASP  22           HN       ASP  22  21.446  15.200  15.397
  154    HA   ASP  22           HA       ASP  22  23.562  14.326  17.014
  155    HB2  ASP  22           2HB      ASP  22  23.320  15.967  14.831
  156    HB3  ASP  22           3HB      ASP  22  23.484  17.176  16.089
  157    HD2  ASP  22           HD2      ASP  22  26.793  16.255  14.790
  158    H    TRP  23           HN       TRP  23  20.891  16.683  17.296
  159    HA   TRP  23           HA       TRP  23  21.972  18.094  19.514
  160    HB2  TRP  23           2HB      TRP  23  20.097  19.371  19.415
  161    HB3  TRP  23           3HB      TRP  23  20.154  18.771  17.769
  162    HD1  TRP  23           HD1      TRP  23  17.864  17.833  16.943
  163    HE1  TRP  23           HE1      TRP  23  15.635  16.859  17.966
  164    HE3  TRP  23           HE3      TRP  23  19.425  17.930  21.781
  165    HZ2  TRP  23           HZ2      TRP  23  14.794  16.251  20.625
  166    HZ3  TRP  23           HZ3      TRP  23  17.839  17.129  23.529
  167    HH2  TRP  23           HH2      TRP  23  15.594  16.310  23.016
  168    H    VAL  24           HN       VAL  24  19.438  15.524  19.065
  169    HA   VAL  24           HA       VAL  24  18.839  15.198  21.748
  170    HB   VAL  24           HB       VAL  24  18.112  14.098  19.296
  171   HG11  VAL  24          1HG1      VAL  24  18.072  11.633  19.823
  172   HG12  VAL  24          2HG1      VAL  24  19.680  12.293  19.441
  173   HG13  VAL  24          3HG1      VAL  24  19.234  11.960  21.131
  174   HG21  VAL  24          3HG2      VAL  24  17.158  14.159  22.063
  175   HG22  VAL  24          1HG2      VAL  24  16.258  14.319  20.536
  176   HG23  VAL  24          2HG2      VAL  24  16.633  12.704  21.183
  177    H    ILE  25           HN       ILE  25  21.220  13.407  19.672
  178    HA   ILE  25           HA       ILE  25  22.179  11.795  21.735
  179    HB   ILE  25           HB       ILE  25  22.454  11.776  19.113
  180   HG12  ILE  25          2HG1      ILE  25  24.638  10.362  19.601
  181   HG13  ILE  25          3HG1      ILE  25  24.183  10.624  21.273
  182   HG21  ILE  25          1HG2      ILE  25  23.951  13.921  19.426
  183   HG22  ILE  25          2HG2      ILE  25  25.217  12.718  19.771
  184   HG23  ILE  25          3HG2      ILE  25  24.356  12.683  18.213
  185   HD11  ILE  25          3HD1      ILE  25  22.683   8.941  21.083
  186   HD12  ILE  25          1HD1      ILE  25  21.773   9.931  19.918
  187   HD13  ILE  25          2HD1      ILE  25  23.020   8.800  19.341
  188    H    SER  26           HN       SER  26  22.926  15.135  20.728
  189    HA   SER  26           HA       SER  26  25.291  15.343  22.182
  190    HB2  SER  26           2HB      SER  26  24.948  16.999  20.533
  191    HB3  SER  26           3HB      SER  26  23.300  17.311  21.040
  192    HG   SER  26           HG       SER  26  24.616  19.040  21.743
  193    H    ALA  27           HN       ALA  27  21.831  16.046  22.947
  194    HA   ALA  27           HA       ALA  27  22.391  17.103  25.518
  195    HB1  ALA  27           1HB      ALA  27  20.304  17.809  25.049
  196    HB2  ALA  27           2HB      ALA  27  20.096  16.572  23.786
  197    HB3  ALA  27           3HB      ALA  27  19.748  16.175  25.485
  198    H    VAL  28           HN       VAL  28  21.915  13.867  24.139
  199    HA   VAL  28           HA       VAL  28  21.267  12.541  26.517
  200    HB   VAL  28           HB       VAL  28  22.641  11.618  23.987
  201   HG11  VAL  28          1HG1      VAL  28  21.150   9.650  25.613
  202   HG12  VAL  28          2HG1      VAL  28  22.685   9.485  24.727
  203   HG13  VAL  28          3HG1      VAL  28  22.665  10.236  26.341
  204   HG21  VAL  28          3HG2      VAL  28  19.940  10.672  24.354
  205   HG22  VAL  28          1HG2      VAL  28  19.984  12.447  24.480
  206   HG23  VAL  28          2HG2      VAL  28  20.627  11.642  23.029
  207    H    ARG  29           HN       ARG  29  24.441  13.090  24.844
  208    HA   ARG  29           HA       ARG  29  25.870  11.822  26.887
  209    HB2  ARG  29           2HB      ARG  29  27.773  12.336  25.608
  210    HB3  ARG  29           3HB      ARG  29  26.523  12.409  24.382
  211    HG2  ARG  29           2HG      ARG  29  26.370  14.972  25.153
  212    HG3  ARG  29           3HG      ARG  29  28.000  14.677  25.725
  213    HD2  ARG  29           2HD      ARG  29  26.998  14.915  22.944
  214    HD3  ARG  29           3HD      ARG  29  28.604  15.218  23.577
  215    HE   ARG  29           HE       ARG  29  27.564  12.631  22.579
  216   HH11  ARG  29          2HH2      ARG  29  30.200  14.348  24.209
  217   HH12  ARG  29          1HH2      ARG  29  31.362  13.096  23.917
  218   HH22  ARG  29          HH1       ARG  29  30.691  11.126  22.730
  219    H    GLY  30           HN       GLY  30  24.597  15.075  26.380
  220    HA2  GLY  30           1HA      GLY  30  26.356  16.427  28.189
  221    HA3  GLY  30           2HA      GLY  30  24.863  17.027  27.495
  222    H    PHE  31           HN       PHE  31  23.186  14.745  28.393
  223    HA   PHE  31           HA       PHE  31  22.674  15.728  31.029
  224    HB2  PHE  31           2HB      PHE  31  20.671  15.142  29.964
  225    HB3  PHE  31           3HB      PHE  31  21.474  14.004  28.900
  226    HD1  PHE  31           HD2      PHE  31  19.970  14.425  32.235
  227    HD2  PHE  31           HD1      PHE  31  21.574  11.675  29.430
  228    HE1  PHE  31           HE2      PHE  31  19.048  12.517  33.580
  229    HE2  PHE  31           HE1      PHE  31  20.652   9.766  30.774
  230    HZ   PHE  31           HZ       PHE  31  19.401  10.210  32.833
  231    H    ILE  32           HN       ILE  32  24.341  12.973  29.563
  232    HA   ILE  32           HA       ILE  32  24.149  11.157  31.648
  233    HB   ILE  32           HB       ILE  32  25.182  11.117  29.192
  234   HG12  ILE  32          2HG1      ILE  32  26.494   9.154  30.965
  235   HG13  ILE  32          3HG1      ILE  32  24.765   9.309  31.206
  236   HG21  ILE  32          1HG2      ILE  32  27.132  12.536  30.025
  237   HG22  ILE  32          2HG2      ILE  32  27.687  11.074  30.875
  238   HG23  ILE  32          3HG2      ILE  32  27.530  11.067  29.102
  239   HD11  ILE  32          3HD1      ILE  32  25.268   7.598  29.487
  240   HD12  ILE  32          1HD1      ILE  32  24.378   8.963  28.771
  241   HD13  ILE  32          2HD1      ILE  32  26.134   8.816  28.520
  242    H    HIS  33           HN       HIS  33  26.366  13.941  31.113
  243    HA   HIS  33           HA       HIS  33  27.790  13.328  33.532
  244    HB2  HIS  33           2HB      HIS  33  29.165  15.217  32.975
  245    HB3  HIS  33           3HB      HIS  33  28.929  14.235  31.543
  246    HD1  HIS  33           HD1      HIS  33  27.905  17.555  33.060
  247    HD2  HIS  33           HD2      HIS  33  27.630  15.502  29.412
  248    HE1  HIS  33           HE1      HIS  33  27.070  19.251  31.346
  249    H    GLY  34           HN       GLY  34  24.853  14.871  32.668
  250    HA2  GLY  34           1HA      GLY  34  24.787  16.211  35.299
  251    HA3  GLY  34           2HA      GLY  34  24.233  17.025  33.849
  Start of MODEL   17
    1    H1   VAL   1           HN       VAL   1  10.356   2.492   2.182
    2    HA   VAL   1           HA       VAL   1   8.913   0.458   2.501
    3    HB   VAL   1           HB       VAL   1   7.224   1.930   3.914
    4   HG11  VAL   1          1HG1      VAL   1   8.943   2.062   5.694
    5   HG12  VAL   1          2HG1      VAL   1   8.942   0.489   4.862
    6   HG13  VAL   1          3HG1      VAL   1  10.198   1.694   4.487
    7   HG21  VAL   1          3HG2      VAL   1   7.624   4.144   4.100
    8   HG22  VAL   1          1HG2      VAL   1   9.389   3.940   3.990
    9   HG23  VAL   1          2HG2      VAL   1   8.400   3.957   2.509
   10    H    PHE   2           HN       PHE   2   6.195   0.589   2.947
   11    HA   PHE   2           HA       PHE   2   5.239   0.521   0.225
   12    HB2  PHE   2           2HB      PHE   2   3.902  -0.047   2.939
   13    HB3  PHE   2           3HB      PHE   2   3.268  -0.543   1.383
   14    HD1  PHE   2           HD1      PHE   2   4.329  -2.372   0.133
   15    HD2  PHE   2           HD2      PHE   2   5.706  -1.256   3.989
   16    HE1  PHE   2           HE1      PHE   2   5.577  -4.542   0.315
   17    HE2  PHE   2           HE2      PHE   2   6.954  -3.426   4.171
   18    HZ   PHE   2           HZ       PHE   2   6.875  -5.043   2.332
   19    H    HIS   3           HN       HIS   3   5.853   3.170   0.995
   20    HA   HIS   3           HA       HIS   3   3.438   4.427   0.412
   21    HB2  HIS   3           2HB      HIS   3   2.530   4.308   2.489
   22    HB3  HIS   3           3HB      HIS   3   4.078   4.131   3.290
   23    HD1  HIS   3           HD1      HIS   3   1.450   6.587   2.572
   24    HD2  HIS   3           HD2      HIS   3   5.523   6.696   3.571
   25    HE1  HIS   3           HE1      HIS   3   1.928   8.964   3.370
   26    H    ALA   4           HN       ALA   4   6.653   4.679   2.032
   27    HA   ALA   4           HA       ALA   4   7.028   7.363   1.093
   28    HB1  ALA   4           1HB      ALA   4   8.859   7.351   2.479
   29    HB2  ALA   4           2HB      ALA   4   7.980   5.983   3.203
   30    HB3  ALA   4           3HB      ALA   4   9.306   5.680   2.055
   31    H    TYR   5           HN       TYR   5   7.868   4.035   0.093
   32    HA   TYR   5           HA       TYR   5   8.972   3.242  -1.671
   33    HB2  TYR   5           2HB      TYR   5   7.339   5.649  -2.561
   34    HB3  TYR   5           3HB      TYR   5   8.405   4.939  -3.757
   35    HD1  TYR   5           HD2      TYR   5   6.091   3.539  -1.141
   36    HD2  TYR   5           HD1      TYR   5   7.266   3.594  -5.254
   37    HE1  TYR   5           HE2      TYR   5   4.333   1.782  -1.674
   38    HE2  TYR   5           HE1      TYR   5   5.503   1.836  -5.773
   39    HH   TYR   5           HH       TYR   5   3.998   0.037  -3.390
   40    H    SER   6           HN       SER   6  10.342   4.106  -3.823
   41    HA   SER   6           HA       SER   6  12.408   4.670  -4.293
   42    HB2  SER   6           2HB      SER   6  11.399   7.356  -3.257
   43    HB3  SER   6           3HB      SER   6  12.816   7.153  -4.268
   44    HG   SER   6           HG       SER   6  10.405   7.560  -5.157
   45    H    ALA   7           HN       ALA   7  13.718   3.472  -2.835
   46    HA   ALA   7           HA       ALA   7  14.095   4.122  -0.159
   47    HB1  ALA   7           1HB      ALA   7  16.369   2.822  -0.747
   48    HB2  ALA   7           2HB      ALA   7  14.799   1.988  -0.659
   49    HB3  ALA   7           3HB      ALA   7  15.468   2.461  -2.239
   50    H    ARG   8           HN       ARG   8  15.637   5.302  -3.165
   51    HA   ARG   8           HA       ARG   8  17.795   6.519  -1.933
   52    HB2  ARG   8           2HB      ARG   8  16.452   6.594  -4.582
   53    HB3  ARG   8           3HB      ARG   8  17.258   8.097  -4.179
   54    HG2  ARG   8           2HG      ARG   8  19.048   6.962  -5.128
   55    HG3  ARG   8           3HG      ARG   8  19.255   6.464  -3.461
   56    HD2  ARG   8           2HD      ARG   8  17.652   4.857  -5.508
   57    HD3  ARG   8           3HD      ARG   8  19.344   4.563  -5.159
   58    HE   ARG   8           HE       ARG   8  17.557   4.574  -2.806
   59   HH11  ARG   8          2HH2      ARG   8  19.207   2.619  -5.257
   60   HH12  ARG   8          1HH2      ARG   8  19.097   1.153  -4.340
   61   HH22  ARG   8          HH1       ARG   8  18.038   1.190  -2.191
   62    H    GLY   9           HN       GLY   9  14.431   7.229  -1.821
   63    HA2  GLY   9           1HA      GLY   9  14.880  10.085  -1.262
   64    HA3  GLY   9           2HA      GLY   9  13.350   9.323  -1.645
   65    H    VAL  10           HN       VAL  10  13.774   6.963   0.125
   66    HA   VAL  10           HA       VAL  10  12.699   8.077   2.481
   67    HB   VAL  10           HB       VAL  10  12.508   5.718   1.299
   68   HG11  VAL  10          1HG1      VAL  10  14.717   5.304   3.340
   69   HG12  VAL  10          2HG1      VAL  10  13.752   3.994   2.617
   70   HG13  VAL  10          3HG1      VAL  10  14.795   5.004   1.587
   71   HG21  VAL  10          3HG2      VAL  10  11.382   6.771   3.440
   72   HG22  VAL  10          1HG2      VAL  10  11.257   5.026   3.111
   73   HG23  VAL  10          2HG2      VAL  10  12.440   5.626   4.298
   74    H    ARG  11           HN       ARG  11  15.908   6.597   1.666
   75    HA   ARG  11           HA       ARG  11  16.931   6.940   4.218
   76    HB2  ARG  11           2HB      ARG  11  19.149   6.558   3.121
   77    HB3  ARG  11           3HB      ARG  11  17.949   5.405   2.572
   78    HG2  ARG  11           2HG      ARG  11  17.522   7.232   0.664
   79    HG3  ARG  11           3HG      ARG  11  19.140   7.755   1.089
   80    HD2  ARG  11           2HD      ARG  11  18.266   5.052   0.007
   81    HD3  ARG  11           3HD      ARG  11  19.456   6.152  -0.660
   82    HE   ARG  11           HE       ARG  11  20.241   5.325   1.996
   83   HH11  ARG  11          2HH2      ARG  11  20.106   4.169  -1.350
   84   HH12  ARG  11          1HH2      ARG  11  21.409   3.047  -1.146
   85   HH22  ARG  11          HH1       ARG  11  22.485   2.873   0.988
   86    H    ASN  12           HN       ASN  12  16.931   8.993   1.258
   87    HA   ASN  12           HA       ASN  12  18.760  10.858   2.087
   88    HB2  ASN  12           2HB      ASN  12  16.518  10.726   0.118
   89    HB3  ASN  12           3HB      ASN  12  16.928  12.354   0.622
   90   HD21  ASN  12          1HD2      ASN  12  18.581   9.304  -0.206
   91   HD22  ASN  12          2HD2      ASN  12  19.805   9.988  -1.223
   92    H    ASN  13           HN       ASN  13  15.492  10.153   3.147
   93    HA   ASN  13           HA       ASN  13  15.092  12.786   4.222
   94    HB2  ASN  13           2HB      ASN  13  13.462  10.250   3.980
   95    HB3  ASN  13           3HB      ASN  13  13.014  11.379   5.243
   96   HD21  ASN  13          1HD2      ASN  13  14.395  11.969   2.027
   97   HD22  ASN  13          2HD2      ASN  13  13.095  12.924   1.395
   98    H    TYR  14           HN       TYR  14  16.513   9.737   5.073
   99    HA   TYR  14           HA       TYR  14  15.974   9.890   7.891
  100    HB2  TYR  14           2HB      TYR  14  16.624   7.682   7.573
  101    HB3  TYR  14           3HB      TYR  14  16.900   8.048   5.882
  102    HD1  TYR  14           HD1      TYR  14  18.656   8.634   9.157
  103    HD2  TYR  14           HD2      TYR  14  18.981   7.478   5.051
  104    HE1  TYR  14           HE1      TYR  14  21.144   8.213   9.465
  105    HE2  TYR  14           HE2      TYR  14  21.468   7.061   5.373
  106    HH   TYR  14           HH       TYR  14  22.891   6.426   7.767
  107    H    LYS  15           HN       LYS  15  18.752  10.530   5.667
  108    HA   LYS  15           HA       LYS  15  20.636  11.050   7.634
  109    HB2  LYS  15           2HB      LYS  15  21.696  12.449   5.751
  110    HB3  LYS  15           3HB      LYS  15  21.470  10.732   5.487
  111    HG2  LYS  15           2HG      LYS  15  20.015  11.082   3.769
  112    HG3  LYS  15           3HG      LYS  15  19.081  12.243   4.691
  113    HD2  LYS  15           2HD      LYS  15  21.790  13.028   3.571
  114    HD3  LYS  15           3HD      LYS  15  20.378  13.039   2.532
  115    HE2  LYS  15           2HE      LYS  15  19.227  14.484   4.351
  116    HE3  LYS  15           3HE      LYS  15  20.810  14.652   5.083
  117    HZ1  LYS  15           2HZ      LYS  15  21.028  15.196   2.324
  118    HZ3  LYS  15           1HZ      LYS  15  21.290  16.217   3.565
  119    H    SER  16           HN       SER  16  17.772  12.788   6.732
  120    HA   SER  16           HA       SER  16  18.715  15.340   7.465
  121    HB2  SER  16           2HB      SER  16  16.748  15.970   6.549
  122    HB3  SER  16           3HB      SER  16  16.419  14.277   6.237
  123    HG   SER  16           HG       SER  16  14.695  14.780   7.472
  124    H    ALA  17           HN       ALA  17  16.642  12.822   9.066
  125    HA   ALA  17           HA       ALA  17  16.306  14.254  11.455
  126    HB1  ALA  17           1HB      ALA  17  16.284  11.236  11.106
  127    HB2  ALA  17           2HB      ALA  17  15.365  12.213  12.277
  128    HB3  ALA  17           3HB      ALA  17  14.959  12.284  10.546
  129    H    VAL  18           HN       VAL  18  19.071  12.787  10.044
  130    HA   VAL  18           HA       VAL  18  20.297  11.973  12.499
  131    HB   VAL  18           HB       VAL  18  21.061  12.155   9.613
  132   HG11  VAL  18          1HG1      VAL  18  23.156  12.771  10.178
  133   HG12  VAL  18          2HG1      VAL  18  22.922  12.366  11.895
  134   HG13  VAL  18          3HG1      VAL  18  23.319  11.085  10.725
  135   HG21  VAL  18          3HG2      VAL  18  20.369  10.032   9.778
  136   HG22  VAL  18          1HG2      VAL  18  21.864   9.717  10.692
  137   HG23  VAL  18          2HG2      VAL  18  20.355  10.094  11.557
  138    H    GLY  19           HN       GLY  19  20.065  14.904  10.513
  139    HA2  GLY  19           1HA      GLY  19  22.301  16.302  11.356
  140    HA3  GLY  19           2HA      GLY  19  20.769  17.006  10.878
  141    HA   PRO  20           HA       PRO  20  19.772  17.846  15.031
  142    HB2  PRO  20           2HB      PRO  20  17.230  16.949  15.481
  143    HB3  PRO  20           3HB      PRO  20  17.585  18.423  14.603
  144    HG2  PRO  20           2HG      PRO  20  16.703  15.805  13.550
  145    HG3  PRO  20           3HG      PRO  20  16.653  17.375  12.772
  146    HD2  PRO  20           2HD      PRO  20  18.534  15.269  12.268
  147    HD3  PRO  20           3HD      PRO  20  18.552  16.879  11.575
  148    H    ALA  21           HN       ALA  21  19.505  14.522  14.207
  149    HA   ALA  21           HA       ALA  21  19.123  13.432  16.708
  150    HB1  ALA  21           1HB      ALA  21  20.346  11.459  15.714
  151    HB2  ALA  21           2HB      ALA  21  19.037  12.102  14.693
  152    HB3  ALA  21           3HB      ALA  21  20.733  12.481  14.309
  153    H    ASP  22           HN       ASP  22  21.883  15.148  15.357
  154    HA   ASP  22           HA       ASP  22  23.795  14.047  17.083
  155    HB2  ASP  22           2HB      ASP  22  23.862  15.669  14.874
  156    HB3  ASP  22           3HB      ASP  22  24.113  16.870  16.126
  157    HD2  ASP  22           HD2      ASP  22  26.173  17.137  16.644
  158    H    TRP  23           HN       TRP  23  21.425  16.719  17.210
  159    HA   TRP  23           HA       TRP  23  22.566  18.022  19.463
  160    HB2  TRP  23           2HB      TRP  23  20.869  19.518  19.259
  161    HB3  TRP  23           3HB      TRP  23  20.929  18.888  17.625
  162    HD1  TRP  23           HD1      TRP  23  18.582  18.224  16.699
  163    HE1  TRP  23           HE1      TRP  23  16.205  17.547  17.624
  164    HE3  TRP  23           HE3      TRP  23  19.915  18.210  21.606
  165    HZ2  TRP  23           HZ2      TRP  23  15.172  17.091  20.245
  166    HZ3  TRP  23           HZ3      TRP  23  18.162  17.638  23.283
  167    HH2  TRP  23           HH2      TRP  23  15.860  17.091  22.671
  168    H    VAL  24           HN       VAL  24  19.759  15.775  18.919
  169    HA   VAL  24           HA       VAL  24  18.999  15.569  21.573
  170    HB   VAL  24           HB       VAL  24  18.258  14.527  19.100
  171   HG11  VAL  24          1HG1      VAL  24  19.020  12.297  21.010
  172   HG12  VAL  24          2HG1      VAL  24  17.890  12.095  19.649
  173   HG13  VAL  24          3HG1      VAL  24  19.584  12.547  19.340
  174   HG21  VAL  24          3HG2      VAL  24  16.394  15.006  20.254
  175   HG22  VAL  24          1HG2      VAL  24  16.524  13.358  20.914
  176   HG23  VAL  24          2HG2      VAL  24  17.192  14.735  21.823
  177    H    ILE  25           HN       ILE  25  21.237  13.467  19.634
  178    HA   ILE  25           HA       ILE  25  21.892  11.784  21.758
  179    HB   ILE  25           HB       ILE  25  22.284  11.688  19.153
  180   HG12  ILE  25          2HG1      ILE  25  24.296  10.051  19.811
  181   HG13  ILE  25          3HG1      ILE  25  23.688  10.355  21.427
  182   HG21  ILE  25          1HG2      ILE  25  24.323  12.339  18.336
  183   HG22  ILE  25          2HG2      ILE  25  24.018  13.637  19.514
  184   HG23  ILE  25          3HG2      ILE  25  25.109  12.294  19.932
  185   HD11  ILE  25          3HD1      ILE  25  21.688   9.264  21.039
  186   HD12  ILE  25          1HD1      ILE  25  21.629   9.757  19.330
  187   HD13  ILE  25          2HD1      ILE  25  22.681   8.412  19.833
  188    H    SER  26           HN       SER  26  23.091  14.990  20.752
  189    HA   SER  26           HA       SER  26  25.394  14.930  22.316
  190    HB2  SER  26           2HB      SER  26  25.346  16.592  20.644
  191    HB3  SER  26           3HB      SER  26  23.718  17.100  21.046
  192    HG   SER  26           HG       SER  26  26.187  17.720  22.368
  193    H    ALA  27           HN       ALA  27  22.014  16.063  22.906
  194    HA   ALA  27           HA       ALA  27  22.580  17.088  25.489
  195    HB1  ALA  27           1HB      ALA  27  19.829  16.405  25.244
  196    HB2  ALA  27           2HB      ALA  27  20.581  18.004  25.031
  197    HB3  ALA  27           3HB      ALA  27  20.375  16.924  23.631
  198    H    VAL  28           HN       VAL  28  21.775  13.911  24.125
  199    HA   VAL  28           HA       VAL  28  20.861  12.714  26.484
  200    HB   VAL  28           HB       VAL  28  22.227  11.585  24.034
  201   HG11  VAL  28          1HG1      VAL  28  20.427   9.877  25.669
  202   HG12  VAL  28          2HG1      VAL  28  21.907   9.462  24.772
  203   HG13  VAL  28          3HG1      VAL  28  22.023  10.238  26.370
  204   HG21  VAL  28          3HG2      VAL  28  20.278  11.833  22.977
  205   HG22  VAL  28          1HG2      VAL  28  19.411  10.994  24.286
  206   HG23  VAL  28          2HG2      VAL  28  19.678  12.752  24.379
  207    H    ARG  29           HN       ARG  29  24.151  12.845  24.957
  208    HA   ARG  29           HA       ARG  29  25.319  11.445  27.079
  209    HB2  ARG  29           2HB      ARG  29  27.327  11.702  25.885
  210    HB3  ARG  29           3HB      ARG  29  26.153  11.910  24.601
  211    HG2  ARG  29           2HG      ARG  29  26.282  14.484  25.339
  212    HG3  ARG  29           3HG      ARG  29  27.835  14.000  25.991
  213    HD2  ARG  29           2HD      ARG  29  26.999  14.317  23.164
  214    HD3  ARG  29           3HD      ARG  29  28.599  14.429  23.869
  215    HE   ARG  29           HE       ARG  29  27.294  11.975  22.848
  216   HH11  ARG  29          2HH2      ARG  29  30.045  13.379  24.585
  217   HH12  ARG  29          1HH2      ARG  29  31.055  11.990  24.359
  218   HH22  ARG  29          HH1       ARG  29  30.201  10.099  23.160
  219    H    GLY  30           HN       GLY  30  24.478  14.821  26.479
  220    HA2  GLY  30           1HA      GLY  30  26.305  15.977  28.355
  221    HA3  GLY  30           2HA      GLY  30  24.930  16.743  27.585
  222    H    PHE  31           HN       PHE  31  22.946  14.699  28.426
  223    HA   PHE  31           HA       PHE  31  22.439  15.778  31.024
  224    HB2  PHE  31           2HB      PHE  31  20.430  15.427  29.872
  225    HB3  PHE  31           3HB      PHE  31  21.133  14.183  28.858
  226    HD1  PHE  31           HD2      PHE  31  19.536  14.839  32.110
  227    HD2  PHE  31           HD1      PHE  31  20.926  11.867  29.418
  228    HE1  PHE  31           HE2      PHE  31  18.325  13.079  33.428
  229    HE2  PHE  31           HE1      PHE  31  19.715  10.107  30.736
  230    HZ   PHE  31           HZ       PHE  31  18.429  10.734  32.725
  231    H    ILE  32           HN       ILE  32  23.817  12.817  29.665
  232    HA   ILE  32           HA       ILE  32  23.307  11.070  31.756
  233    HB   ILE  32           HB       ILE  32  24.438  10.866  29.352
  234   HG12  ILE  32          2HG1      ILE  32  25.413   8.784  31.205
  235   HG13  ILE  32          3HG1      ILE  32  23.707   9.154  31.360
  236   HG21  ILE  32          1HG2      ILE  32  26.839  10.539  31.151
  237   HG22  ILE  32          2HG2      ILE  32  26.763  10.524  29.372
  238   HG23  ILE  32          3HG2      ILE  32  26.509  12.045  30.262
  239   HD11  ILE  32          3HD1      ILE  32  23.982   7.391  29.691
  240   HD12  ILE  32          1HD1      ILE  32  23.457   8.876  28.863
  241   HD13  ILE  32          2HD1      ILE  32  25.163   8.374  28.793
  242    H    HIS  33           HN       HIS  33  25.874  13.551  31.299
  243    HA   HIS  33           HA       HIS  33  27.101  12.804  33.787
  244    HB2  HIS  33           2HB      HIS  33  28.723  14.502  33.277
  245    HB3  HIS  33           3HB      HIS  33  28.431  13.536  31.844
  246    HD1  HIS  33           HD1      HIS  33  27.750  16.977  33.285
  247    HD2  HIS  33           HD2      HIS  33  27.403  14.923  29.643
  248    HE1  HIS  33           HE1      HIS  33  27.210  18.738  31.519
  249    H    GLY  34           HN       GLY  34  24.419  14.683  32.773
  250    HA2  GLY  34           1HA      GLY  34  24.616  16.504  35.073
  251    HA3  GLY  34           2HA      GLY  34  23.536  16.652  33.702
  Start of MODEL   18
    1    H1   VAL   1           HN       VAL   1   1.484  -1.849  -2.365
    2    HA   VAL   1           HA       VAL   1   2.166   0.572  -2.763
    3    HB   VAL   1           HB       VAL   1   2.690   1.852  -0.872
    4   HG11  VAL   1          1HG1      VAL   1   0.336   1.934  -1.313
    5   HG12  VAL   1          2HG1      VAL   1   0.055   0.416  -0.426
    6   HG13  VAL   1          3HG1      VAL   1   0.547   1.883   0.454
    7   HG21  VAL   1          3HG2      VAL   1   1.954   0.357   1.407
    8   HG22  VAL   1          1HG2      VAL   1   2.987  -0.711   0.428
    9   HG23  VAL   1          2HG2      VAL   1   3.584   0.889   0.930
   10    H    PHE   2           HN       PHE   2   4.503   0.868  -0.789
   11    HA   PHE   2           HA       PHE   2   6.547   0.078  -0.481
   12    HB2  PHE   2           2HB      PHE   2   4.981  -2.174  -0.327
   13    HB3  PHE   2           3HB      PHE   2   5.872  -2.579  -1.781
   14    HD1  PHE   2           HD2      PHE   2   6.695  -1.128   1.570
   15    HD2  PHE   2           HD1      PHE   2   7.669  -3.963  -1.434
   16    HE1  PHE   2           HE2      PHE   2   8.605  -1.956   2.972
   17    HE2  PHE   2           HE1      PHE   2   9.580  -4.791  -0.032
   18    HZ   PHE   2           HZ       PHE   2  10.025  -3.777   2.154
   19    H    HIS   3           HN       HIS   3   5.318   1.054  -3.168
   20    HA   HIS   3           HA       HIS   3   7.735   0.544  -4.671
   21    HB2  HIS   3           2HB      HIS   3   6.701  -1.089  -5.831
   22    HB3  HIS   3           3HB      HIS   3   5.095  -0.563  -5.369
   23    HD1  HIS   3           HD1      HIS   3   4.044  -0.570  -7.694
   24    HD2  HIS   3           HD2      HIS   3   7.535   1.744  -7.468
   25    HE1  HIS   3           HE1      HIS   3   4.193   0.715  -9.893
   26    H    ALA   4           HN       ALA   4   4.503   2.156  -4.480
   27    HA   ALA   4           HA       ALA   4   5.170   4.250  -6.229
   28    HB1  ALA   4           1HB      ALA   4   3.176   5.346  -5.086
   29    HB2  ALA   4           2HB      ALA   4   2.869   3.738  -5.786
   30    HB3  ALA   4           3HB      ALA   4   3.100   3.915  -4.030
   31    H    TYR   5           HN       TYR   5   6.106   3.489  -2.961
   32    HA   TYR   5           HA       TYR   5   6.552   6.174  -2.114
   33    HB2  TYR   5           2HB      TYR   5   7.362   5.010  -0.164
   34    HB3  TYR   5           3HB      TYR   5   6.209   3.871  -0.830
   35    HD1  TYR   5           HD2      TYR   5   7.982   2.943  -3.185
   36    HD2  TYR   5           HD1      TYR   5   8.745   3.442   0.995
   37    HE1  TYR   5           HE2      TYR   5   9.803   1.172  -3.299
   38    HE2  TYR   5           HE1      TYR   5  10.564   1.669   0.867
   39    HH   TYR   5           HH       TYR   5  10.829  -0.466  -1.568
   40    H    SER   6           HN       SER   6   9.035   6.384  -1.094
   41    HA   SER   6           HA       SER   6  10.891   5.654  -3.178
   42    HB2  SER   6           2HB      SER   6  10.333   8.526  -2.325
   43    HB3  SER   6           3HB      SER   6  11.782   8.053  -3.191
   44    HG   SER   6           HG       SER   6   9.240   8.498  -4.161
   45    H    ALA   7           HN       ALA   7  12.054   4.338  -1.727
   46    HA   ALA   7           HA       ALA   7  12.565   5.010   0.931
   47    HB1  ALA   7           1HB      ALA   7  12.834   2.757   0.448
   48    HB2  ALA   7           2HB      ALA   7  13.665   3.075  -1.094
   49    HB3  ALA   7           3HB      ALA   7  14.531   3.294   0.445
   50    H    ARG   8           HN       ARG   8  14.208   5.811  -2.139
   51    HA   ARG   8           HA       ARG   8  16.579   6.667  -0.987
   52    HB2  ARG   8           2HB      ARG   8  15.226   6.850  -3.619
   53    HB3  ARG   8           3HB      ARG   8  16.252   8.232  -3.293
   54    HG2  ARG   8           2HG      ARG   8  17.841   6.807  -4.203
   55    HG3  ARG   8           3HG      ARG   8  17.995   6.348  -2.519
   56    HD2  ARG   8           2HD      ARG   8  16.149   4.922  -4.495
   57    HD3  ARG   8           3HD      ARG   8  17.778   4.388  -4.132
   58    HE   ARG   8           HE       ARG   8  16.047   4.770  -1.774
   59   HH11  ARG   8          2HH2      ARG   8  17.284   2.480  -4.178
   60   HH12  ARG   8          1HH2      ARG   8  16.939   1.086  -3.210
   61   HH22  ARG   8          HH1       ARG   8  15.943   1.375  -1.049
   62    H    GLY   9           HN       GLY   9  13.396   7.947  -0.836
   63    HA2  GLY   9           1HA      GLY   9  14.340  10.706  -0.414
   64    HA3  GLY   9           2HA      GLY   9  12.692  10.202  -0.733
   65    H    VAL  10           HN       VAL  10  12.771   7.872   1.132
   66    HA   VAL  10           HA       VAL  10  11.959   9.245   3.457
   67    HB   VAL  10           HB       VAL  10  11.342   6.907   2.384
   68   HG11  VAL  10          1HG1      VAL  10  12.315   5.052   3.750
   69   HG12  VAL  10          2HG1      VAL  10  13.483   5.828   2.655
   70   HG13  VAL  10          3HG1      VAL  10  13.506   6.207   4.394
   71   HG21  VAL  10          3HG2      VAL  10  10.749   6.225   4.907
   72   HG22  VAL  10          1HG2      VAL  10  11.206   7.922   5.186
   73   HG23  VAL  10          2HG2      VAL  10   9.901   7.528   4.042
   74    H    ARG  11           HN       ARG  11  14.849   7.212   2.643
   75    HA   ARG  11           HA       ARG  11  15.986   7.479   5.156
   76    HB2  ARG  11           2HB      ARG  11  18.077   6.684   4.031
   77    HB3  ARG  11           3HB      ARG  11  16.686   5.730   3.559
   78    HG2  ARG  11           2HG      ARG  11  16.519   7.523   1.581
   79    HG3  ARG  11           3HG      ARG  11  18.212   7.783   1.949
   80    HD2  ARG  11           2HD      ARG  11  16.863   5.251   0.962
   81    HD3  ARG  11           3HD      ARG  11  18.253   6.080   0.289
   82    HE   ARG  11           HE       ARG  11  18.989   5.290   2.904
   83   HH11  ARG  11          2HH2      ARG  11  18.069   3.716  -0.133
   84   HH12  ARG  11          1HH2      ARG  11  18.990   2.284   0.186
   85   HH22  ARG  11          HH1       ARG  11  20.237   2.121   2.225
   86    H    ASN  12           HN       ASN  12  16.250   9.381   2.108
   87    HA   ASN  12           HA       ASN  12  18.389  10.943   2.817
   88    HB2  ASN  12           2HB      ASN  12  16.102  11.114   0.902
   89    HB3  ASN  12           3HB      ASN  12  16.796  12.667   1.325
   90   HD21  ASN  12          1HD2      ASN  12  17.872   9.350   0.582
   91   HD22  ASN  12          2HD2      ASN  12  19.169   9.774  -0.484
   92    H    ASN  13           HN       ASN  13  15.078  10.844   3.973
   93    HA   ASN  13           HA       ASN  13  15.157  13.547   4.938
   94    HB2  ASN  13           2HB      ASN  13  13.116  11.307   4.883
   95    HB3  ASN  13           3HB      ASN  13  12.896  12.595   6.052
   96   HD21  ASN  13          1HD2      ASN  13  14.379  12.823   2.852
   97   HD22  ASN  13          2HD2      ASN  13  13.214  13.883   2.131
   98    H    TYR  14           HN       TYR  14  16.066  10.338   5.894
   99    HA   TYR  14           HA       TYR  14  15.639  10.695   8.714
  100    HB2  TYR  14           2HB      TYR  14  15.898   8.398   8.482
  101    HB3  TYR  14           3HB      TYR  14  16.183   8.642   6.770
  102    HD1  TYR  14           HD1      TYR  14  18.106   9.053   9.978
  103    HD2  TYR  14           HD2      TYR  14  18.114   7.694   5.921
  104    HE1  TYR  14           HE1      TYR  14  20.495   8.228  10.251
  105    HE2  TYR  14           HE2      TYR  14  20.504   6.874   6.208
  106    HH   TYR  14           HH       TYR  14  22.476   7.602   7.795
  107    H    LYS  15           HN       LYS  15  18.425  10.756   6.408
  108    HA   LYS  15           HA       LYS  15  20.421  11.032   8.313
  109    HB2  LYS  15           2HB      LYS  15  21.653  12.146   6.346
  110    HB3  LYS  15           3HB      LYS  15  21.132  10.483   6.168
  111    HG2  LYS  15           2HG      LYS  15  19.710  11.000   4.465
  112    HG3  LYS  15           3HG      LYS  15  19.015  12.345   5.346
  113    HD2  LYS  15           2HD      LYS  15  21.745  12.503   3.994
  114    HD3  LYS  15           3HD      LYS  15  20.259  12.937   3.173
  115    HE2  LYS  15           2HE      LYS  15  20.027  14.342   5.570
  116    HE3  LYS  15           3HE      LYS  15  21.752  14.413   5.271
  117    HZ1  LYS  15           2HZ      LYS  15  21.417  15.820   3.557
  118    HZ3  LYS  15           1HZ      LYS  15  19.881  15.997   4.070
  119    H    SER  16           HN       SER  16  17.871  13.193   7.383
  120    HA   SER  16           HA       SER  16  19.253  15.575   7.977
  121    HB2  SER  16           2HB      SER  16  16.670  14.800   6.981
  122    HB3  SER  16           3HB      SER  16  16.403  15.864   8.348
  123    HG   SER  16           HG       SER  16  17.188  17.544   7.246
  124    H    ALA  17           HN       ALA  17  16.829  13.517   9.733
  125    HA   ALA  17           HA       ALA  17  16.798  15.088  12.056
  126    HB1  ALA  17           1HB      ALA  17  15.380  12.959  11.045
  127    HB2  ALA  17           2HB      ALA  17  16.308  12.186  12.353
  128    HB3  ALA  17           3HB      ALA  17  15.246  13.568  12.712
  129    H    VAL  18           HN       VAL  18  19.242  13.117  10.667
  130    HA   VAL  18           HA       VAL  18  20.378  12.217  13.136
  131    HB   VAL  18           HB       VAL  18  21.086  12.141  10.231
  132   HG11  VAL  18          1HG1      VAL  18  23.268  12.421  10.728
  133   HG12  VAL  18          2HG1      VAL  18  23.015  12.136  12.467
  134   HG13  VAL  18          3HG1      VAL  18  23.163  10.757  11.351
  135   HG21  VAL  18          3HG2      VAL  18  20.084  10.320  12.275
  136   HG22  VAL  18          1HG2      VAL  18  20.068  10.167  10.502
  137   HG23  VAL  18          2HG2      VAL  18  21.500   9.655  11.427
  138    H    GLY  19           HN       GLY  19  20.587  15.056  11.017
  139    HA2  GLY  19           1HA      GLY  19  23.047  16.093  11.752
  140    HA3  GLY  19           2HA      GLY  19  21.642  17.023  11.268
  141    HA   PRO  20           HA       PRO  20  20.907  18.200  15.395
  142    HB2  PRO  20           2HB      PRO  20  18.263  17.764  15.933
  143    HB3  PRO  20           3HB      PRO  20  18.836  19.118  14.979
  144    HG2  PRO  20           2HG      PRO  20  17.503  16.642  14.068
  145    HG3  PRO  20           3HG      PRO  20  17.696  18.161  13.217
  146    HD2  PRO  20           2HD      PRO  20  19.185  15.749  12.780
  147    HD3  PRO  20           3HD      PRO  20  19.454  17.301  12.011
  148    H    ALA  21           HN       ALA  21  20.067  14.935  14.735
  149    HA   ALA  21           HA       ALA  21  19.573  14.036  17.292
  150    HB1  ALA  21           1HB      ALA  21  20.939  12.723  14.911
  151    HB2  ALA  21           2HB      ALA  21  20.422  11.844  16.370
  152    HB3  ALA  21           3HB      ALA  21  19.214  12.652  15.343
  153    H    ASP  22           HN       ASP  22  22.545  15.202  15.810
  154    HA   ASP  22           HA       ASP  22  24.291  13.873  17.552
  155    HB2  ASP  22           2HB      ASP  22  24.571  15.361  15.267
  156    HB3  ASP  22           3HB      ASP  22  25.050  16.557  16.455
  157    HD2  ASP  22           HD2      ASP  22  27.467  13.638  15.404
  158    H    TRP  23           HN       TRP  23  22.404  16.908  17.594
  159    HA   TRP  23           HA       TRP  23  23.804  18.099  19.761
  160    HB2  TRP  23           2HB      TRP  23  22.377  19.848  19.517
  161    HB3  TRP  23           3HB      TRP  23  22.288  19.146  17.914
  162    HD1  TRP  23           HD1      TRP  23  19.840  18.846  17.064
  163    HE1  TRP  23           HE1      TRP  23  17.408  18.619  18.063
  164    HE3  TRP  23           HE3      TRP  23  21.279  18.823  21.940
  165    HZ2  TRP  23           HZ2      TRP  23  16.382  18.460  20.721
  166    HZ3  TRP  23           HZ3      TRP  23  19.500  18.629  23.675
  167    HH2  TRP  23           HH2      TRP  23  17.123  18.451  23.132
  168    H    VAL  24           HN       VAL  24  20.649  16.334  19.377
  169    HA   VAL  24           HA       VAL  24  19.934  16.376  22.051
  170    HB   VAL  24           HB       VAL  24  18.965  15.366  19.644
  171   HG11  VAL  24          1HG1      VAL  24  19.393  13.125  21.643
  172   HG12  VAL  24          2HG1      VAL  24  18.211  13.056  20.315
  173   HG13  VAL  24          3HG1      VAL  24  19.947  13.203  19.954
  174   HG21  VAL  24          3HG2      VAL  24  18.021  15.884  22.366
  175   HG22  VAL  24          1HG2      VAL  24  17.230  16.189  20.800
  176   HG23  VAL  24          2HG2      VAL  24  17.116  14.582  21.558
  177    H    ILE  25           HN       ILE  25  21.738  13.844  20.173
  178    HA   ILE  25           HA       ILE  25  22.158  12.170  22.363
  179    HB   ILE  25           HB       ILE  25  22.460  11.895  19.759
  180   HG12  ILE  25          2HG1      ILE  25  24.143   9.955  20.416
  181   HG13  ILE  25          3HG1      ILE  25  23.740  10.446  22.049
  182   HG21  ILE  25          1HG2      ILE  25  24.558  12.156  18.875
  183   HG22  ILE  25          2HG2      ILE  25  24.505  13.538  19.996
  184   HG23  ILE  25          3HG2      ILE  25  25.365  12.050  20.458
  185   HD11  ILE  25          3HD1      ILE  25  21.435  10.145  20.158
  186   HD12  ILE  25          1HD1      ILE  25  22.263   8.652  20.659
  187   HD13  ILE  25          2HD1      ILE  25  21.551   9.729  21.884
  188    H    SER  26           HN       SER  26  23.848  15.081  21.184
  189    HA   SER  26           HA       SER  26  26.149  14.704  22.707
  190    HB2  SER  26           2HB      SER  26  26.332  16.274  20.955
  191    HB3  SER  26           3HB      SER  26  24.827  17.070  21.370
  192    HG   SER  26           HG       SER  26  27.399  17.300  22.627
  193    H    ALA  27           HN       ALA  27  23.022  16.414  23.303
  194    HA   ALA  27           HA       ALA  27  23.818  17.441  25.823
  195    HB1  ALA  27           1HB      ALA  27  21.247  17.733  26.001
  196    HB2  ALA  27           2HB      ALA  27  22.096  18.605  24.702
  197    HB3  ALA  27           3HB      ALA  27  21.202  17.111  24.334
  198    H    VAL  28           HN       VAL  28  22.459  14.388  24.628
  199    HA   VAL  28           HA       VAL  28  21.419  13.467  27.058
  200    HB   VAL  28           HB       VAL  28  22.514  12.016  24.642
  201   HG11  VAL  28          1HG1      VAL  28  20.499  10.732  26.422
  202   HG12  VAL  28          2HG1      VAL  28  21.820  10.011  25.471
  203   HG13  VAL  28          3HG1      VAL  28  22.174  10.813  27.021
  204   HG21  VAL  28          3HG2      VAL  28  20.601  12.516  23.606
  205   HG22  VAL  28          1HG2      VAL  28  19.639  11.942  24.989
  206   HG23  VAL  28          2HG2      VAL  28  20.224  13.622  24.949
  207    H    ARG  29           HN       ARG  29  24.644  12.976  25.466
  208    HA   ARG  29           HA       ARG  29  25.617  11.494  27.630
  209    HB2  ARG  29           2HB      ARG  29  27.608  11.357  26.389
  210    HB3  ARG  29           3HB      ARG  29  26.452  11.703  25.118
  211    HG2  ARG  29           2HG      ARG  29  27.028  14.249  25.731
  212    HG3  ARG  29           3HG      ARG  29  28.494  13.539  26.377
  213    HD2  ARG  29           2HD      ARG  29  27.651  13.869  23.554
  214    HD3  ARG  29           3HD      ARG  29  29.265  13.741  24.224
  215    HE   ARG  29           HE       ARG  29  27.543  11.499  23.344
  216   HH11  ARG  29          2HH2      ARG  29  30.533  12.495  24.962
  217   HH12  ARG  29          1HH2      ARG  29  31.291  10.948  24.784
  218   HH22  ARG  29          HH1       ARG  29  30.102   9.177  23.691
  219    H    GLY  30           HN       GLY  30  25.336  14.933  26.886
  220    HA2  GLY  30           1HA      GLY  30  27.379  15.847  28.672
  221    HA3  GLY  30           2HA      GLY  30  26.130  16.799  27.892
  222    H    PHE  31           HN       PHE  31  23.855  15.158  28.865
  223    HA   PHE  31           HA       PHE  31  23.606  16.417  31.420
  224    HB2  PHE  31           2HB      PHE  31  21.536  16.363  30.323
  225    HB3  PHE  31           3HB      PHE  31  21.994  14.976  29.354
  226    HD1  PHE  31           HD1      PHE  31  20.614  16.030  32.601
  227    HD2  PHE  31           HD2      PHE  31  21.416  12.754  30.025
  228    HE1  PHE  31           HE1      PHE  31  19.159  14.558  34.021
  229    HE2  PHE  31           HE2      PHE  31  19.961  11.282  31.445
  230    HZ   PHE  31           HZ       PHE  31  18.850  12.201  33.426
  231    H    ILE  32           HN       ILE  32  24.428  13.210  30.173
  232    HA   ILE  32           HA       ILE  32  23.687  11.665  32.352
  233    HB   ILE  32           HB       ILE  32  24.702  11.170  29.938
  234   HG12  ILE  32          2HG1      ILE  32  25.359   9.034  31.870
  235   HG13  ILE  32          3HG1      ILE  32  23.744   9.694  32.034
  236   HG21  ILE  32          1HG2      ILE  32  27.060  10.514  31.704
  237   HG22  ILE  32          2HG2      ILE  32  26.935  10.440  29.929
  238   HG23  ILE  32          3HG2      ILE  32  26.967  12.017  30.754
  239   HD11  ILE  32          3HD1      ILE  32  23.323   9.313  29.610
  240   HD12  ILE  32          1HD1      ILE  32  24.966   8.650  29.437
  241   HD13  ILE  32          2HD1      ILE  32  23.764   7.800  30.438
  242    H    HIS  33           HN       HIS  33  26.622  13.653  31.731
  243    HA   HIS  33           HA       HIS  33  27.773  12.814  34.225
  244    HB2  HIS  33           2HB      HIS  33  29.643  14.189  33.606
  245    HB3  HIS  33           3HB      HIS  33  29.153  13.229  32.224
  246    HD1  HIS  33           HD1      HIS  33  29.090  16.792  33.524
  247    HD2  HIS  33           HD2      HIS  33  28.325  14.679  29.983
  248    HE1  HIS  33           HE1      HIS  33  28.809  18.546  31.692
  249    H    GLY  34           HN       GLY  34  25.419  15.076  33.181
  250    HA2  GLY  34           1HA      GLY  34  26.012  17.141  35.101
  251    HA3  GLY  34           2HA      GLY  34  24.605  17.007  34.066
  Start of MODEL   19
    1    H1   VAL   1           HN       VAL   1   5.145  -3.578  -4.425
    2    HA   VAL   1           HA       VAL   1   4.058  -1.476  -4.253
    3    HB   VAL   1           HB       VAL   1   5.204   0.058  -2.421
    4   HG11  VAL   1          1HG1      VAL   1   2.918  -0.049  -2.259
    5   HG12  VAL   1          2HG1      VAL   1   2.885  -1.828  -2.271
    6   HG13  VAL   1          3HG1      VAL   1   3.361  -0.957  -0.794
    7   HG21  VAL   1          3HG2      VAL   1   5.228  -2.562  -0.930
    8   HG22  VAL   1          1HG2      VAL   1   6.681  -1.985  -1.782
    9   HG23  VAL   1          2HG2      VAL   1   5.959  -1.001  -0.486
   10    H    PHE   2           HN       PHE   2   5.146   0.760  -4.721
   11    HA   PHE   2           HA       PHE   2   7.849   1.010  -5.113
   12    HB2  PHE   2           2HB      PHE   2   6.534  -0.809  -6.956
   13    HB3  PHE   2           3HB      PHE   2   6.918   0.639  -7.865
   14    HD1  PHE   2           HD1      PHE   2   8.962  -0.589  -5.053
   15    HD2  PHE   2           HD2      PHE   2   8.570  -0.348  -9.271
   16    HE1  PHE   2           HE1      PHE   2  11.328  -1.381  -5.318
   17    HE2  PHE   2           HE2      PHE   2  10.936  -1.141  -9.536
   18    HZ   PHE   2           HZ       PHE   2  12.288  -1.647  -7.556
   19    H    HIS   3           HN       HIS   3   5.550   2.570  -4.336
   20    HA   HIS   3           HA       HIS   3   6.085   4.903  -5.730
   21    HB2  HIS   3           2HB      HIS   3   4.938   4.311  -7.632
   22    HB3  HIS   3           3HB      HIS   3   3.794   3.298  -6.774
   23    HD1  HIS   3           HD1      HIS   3   4.022   6.494  -8.426
   24    HD2  HIS   3           HD2      HIS   3   1.910   5.007  -5.120
   25    HE1  HIS   3           HE1      HIS   3   2.092   8.114  -8.023
   26    H    ALA   4           HN       ALA   4   3.760   2.930  -3.841
   27    HA   ALA   4           HA       ALA   4   2.427   5.059  -2.618
   28    HB1  ALA   4           1HB      ALA   4   1.247   3.295  -1.886
   29    HB2  ALA   4           2HB      ALA   4   2.493   2.197  -2.527
   30    HB3  ALA   4           3HB      ALA   4   2.612   2.801  -0.857
   31    H    TYR   5           HN       TYR   5   5.685   3.910  -2.341
   32    HA   TYR   5           HA       TYR   5   6.135   5.799  -0.189
   33    HB2  TYR   5           2HB      TYR   5   7.063   4.098   1.271
   34    HB3  TYR   5           3HB      TYR   5   5.592   3.362   0.664
   35    HD1  TYR   5           HD1      TYR   5   5.939   1.997  -1.635
   36    HD2  TYR   5           HD2      TYR   5   9.000   2.822   1.238
   37    HE1  TYR   5           HE1      TYR   5   7.290   0.022  -2.496
   38    HE2  TYR   5           HE2      TYR   5  10.341   0.846   0.367
   39    HH   TYR   5           HH       TYR   5   9.079  -1.159  -2.287
   40    H    SER   6           HN       SER   6   8.463   6.274   0.107
   41    HA   SER   6           HA       SER   6  10.024   5.391  -2.187
   42    HB2  SER   6           2HB      SER   6   9.891   8.230  -1.075
   43    HB3  SER   6           3HB      SER   6  10.990   7.699  -2.333
   44    HG   SER   6           HG       SER   6   8.670   8.718  -2.795
   45    H    ALA   7           HN       ALA   7  11.331   3.943  -1.016
   46    HA   ALA   7           HA       ALA   7  12.260   4.394   1.568
   47    HB1  ALA   7           1HB      ALA   7  12.373   2.181   0.869
   48    HB2  ALA   7           2HB      ALA   7  13.001   2.610  -0.741
   49    HB3  ALA   7           3HB      ALA   7  14.072   2.679   0.679
   50    H    ARG   8           HN       ARG   8  13.463   5.407  -1.640
   51    HA   ARG   8           HA       ARG   8  16.002   6.122  -0.778
   52    HB2  ARG   8           2HB      ARG   8  14.262   6.670  -3.158
   53    HB3  ARG   8           3HB      ARG   8  15.557   7.822  -2.893
   54    HG2  ARG   8           2HG      ARG   8  16.672   6.235  -4.192
   55    HG3  ARG   8           3HG      ARG   8  17.057   5.649  -2.586
   56    HD2  ARG   8           2HD      ARG   8  14.605   4.655  -4.099
   57    HD3  ARG   8           3HD      ARG   8  16.178   3.912  -4.310
   58    HE   ARG   8           HE       ARG   8  15.283   4.199  -1.508
   59   HH11  ARG   8          2HH2      ARG   8  15.511   2.081  -4.339
   60   HH12  ARG   8          1HH2      ARG   8  15.310   0.626  -3.421
   61   HH22  ARG   8          HH1       ARG   8  15.020   0.767  -1.046
   62    H    GLY   9           HN       GLY   9  12.918   7.440  -0.067
   63    HA2  GLY   9           1HA      GLY   9  14.037  10.120   0.471
   64    HA3  GLY   9           2HA      GLY   9  12.344   9.746   0.219
   65    H    VAL  10           HN       VAL  10  12.555   7.186   1.853
   66    HA   VAL  10           HA       VAL  10  11.879   8.352   4.339
   67    HB   VAL  10           HB       VAL  10  11.176   6.122   3.098
   68   HG11  VAL  10          1HG1      VAL  10  12.212   4.149   4.232
   69   HG12  VAL  10          2HG1      VAL  10  13.322   5.017   3.144
   70   HG13  VAL  10          3HG1      VAL  10  13.449   5.238   4.905
   71   HG21  VAL  10          3HG2      VAL  10  10.547   5.209   5.437
   72   HG22  VAL  10          1HG2      VAL  10  11.315   6.689   6.059
   73   HG23  VAL  10          2HG2      VAL  10   9.924   6.805   4.954
   74    H    ARG  11           HN       ARG  11  14.694   6.395   3.159
   75    HA   ARG  11           HA       ARG  11  15.988   6.444   5.615
   76    HB2  ARG  11           2HB      ARG  11  17.992   5.717   4.297
   77    HB3  ARG  11           3HB      ARG  11  16.559   4.810   3.858
   78    HG2  ARG  11           2HG      ARG  11  16.279   6.742   2.026
   79    HG3  ARG  11           3HG      ARG  11  17.999   6.956   2.290
   80    HD2  ARG  11           2HD      ARG  11  16.536   4.608   1.102
   81    HD3  ARG  11           3HD      ARG  11  18.035   5.355   0.586
   82    HE   ARG  11           HE       ARG  11  17.745   3.210   2.546
   83   HH11  ARG  11          2HH2      ARG  11  19.827   5.889   1.525
   84   HH12  ARG  11          1HH2      ARG  11  21.256   5.211   2.231
   85   HH22  ARG  11          HH1       ARG  11  21.117   3.109   3.374
   86    H    ASN  12           HN       ASN  12  16.098   8.562   2.701
   87    HA   ASN  12           HA       ASN  12  18.298  10.047   3.428
   88    HB2  ASN  12           2HB      ASN  12  15.883  10.478   1.666
   89    HB3  ASN  12           3HB      ASN  12  16.850  11.889   2.047
   90   HD21  ASN  12          1HD2      ASN  12  17.366   8.458   1.220
   91   HD22  ASN  12          2HD2      ASN  12  18.600   8.703   0.029
   92    H    ASN  13           HN       ASN  13  15.047   9.881   4.706
   93    HA   ASN  13           HA       ASN  13  15.164  12.534   5.806
   94    HB2  ASN  13           2HB      ASN  13  13.108  10.322   5.651
   95    HB3  ASN  13           3HB      ASN  13  12.937  11.492   6.944
   96   HD21  ASN  13          1HD2      ASN  13  14.240  11.926   3.675
   97   HD22  ASN  13          2HD2      ASN  13  13.079  13.086   3.120
   98    H    TYR  14           HN       TYR  14  16.206   9.338   6.529
   99    HA   TYR  14           HA       TYR  14  15.801   9.455   9.373
  100    HB2  TYR  14           2HB      TYR  14  16.143   7.200   8.933
  101    HB3  TYR  14           3HB      TYR  14  16.462   7.597   7.256
  102    HD1  TYR  14           HD2      TYR  14  18.292   7.873  10.532
  103    HD2  TYR  14           HD1      TYR  14  18.441   6.762   6.404
  104    HE1  TYR  14           HE2      TYR  14  20.709   7.135  10.811
  105    HE2  TYR  14           HE1      TYR  14  20.858   6.028   6.696
  106    HH   TYR  14           HH       TYR  14  22.374   5.423   8.276
  107    H    LYS  15           HN       LYS  15  18.599   9.707   7.077
  108    HA   LYS  15           HA       LYS  15  20.489  10.126   9.121
  109    HB2  LYS  15           2HB      LYS  15  21.995  10.123   7.437
  110    HB3  LYS  15           3HB      LYS  15  20.651   9.469   6.524
  111    HG2  LYS  15           2HG      LYS  15  21.299  12.449   6.690
  112    HG3  LYS  15           3HG      LYS  15  21.842  11.405   5.391
  113    HD2  LYS  15           2HD      LYS  15  19.543  10.924   4.714
  114    HD3  LYS  15           3HD      LYS  15  18.900  11.725   6.134
  115    HE2  LYS  15           2HE      LYS  15  18.865  13.692   5.010
  116    HE3  LYS  15           3HE      LYS  15  20.608  13.627   4.840
  117    HZ1  LYS  15           2HZ      LYS  15  20.424  12.900   2.707
  118    HZ3  LYS  15           1HZ      LYS  15  18.916  13.512   2.763
  119    H    SER  16           HN       SER  16  17.969  12.091   7.825
  120    HA   SER  16           HA       SER  16  19.268  14.567   8.120
  121    HB2  SER  16           2HB      SER  16  17.243  14.146   6.683
  122    HB3  SER  16           3HB      SER  16  16.283  13.939   8.134
  123    HG   SER  16           HG       SER  16  17.090  16.181   8.730
  124    H    ALA  17           HN       ALA  17  16.695  12.874  10.069
  125    HA   ALA  17           HA       ALA  17  16.789  14.709  12.189
  126    HB1  ALA  17           1HB      ALA  17  15.976  11.797  12.400
  127    HB2  ALA  17           2HB      ALA  17  15.310  13.203  13.264
  128    HB3  ALA  17           3HB      ALA  17  14.981  12.987  11.528
  129    H    VAL  18           HN       VAL  18  19.043  12.356  11.107
  130    HA   VAL  18           HA       VAL  18  20.046  11.651  13.694
  131    HB   VAL  18           HB       VAL  18  20.785  11.158  10.838
  132   HG11  VAL  18          1HG1      VAL  18  22.698   9.724  12.169
  133   HG12  VAL  18          2HG1      VAL  18  22.977  11.282  11.354
  134   HG13  VAL  18          3HG1      VAL  18  22.673  11.237  13.107
  135   HG21  VAL  18          3HG2      VAL  18  19.622   9.307  11.291
  136   HG22  VAL  18          1HG2      VAL  18  20.931   8.820  12.394
  137   HG23  VAL  18          2HG2      VAL  18  19.529   9.721  13.019
  138    H    GLY  19           HN       GLY  19  20.586  14.171  11.249
  139    HA2  GLY  19           1HA      GLY  19  23.120  15.047  11.924
  140    HA3  GLY  19           2HA      GLY  19  21.823  16.046  11.301
  141    HA   PRO  20           HA       PRO  20  21.159  17.772  15.242
  142    HB2  PRO  20           2HB      PRO  20  18.478  17.663  15.765
  143    HB3  PRO  20           3HB      PRO  20  19.195  18.831  14.673
  144    HG2  PRO  20           2HG      PRO  20  17.632  16.407  14.027
  145    HG3  PRO  20           3HG      PRO  20  17.985  17.788  13.009
  146    HD2  PRO  20           2HD      PRO  20  19.231  15.207  12.892
  147    HD3  PRO  20           3HD      PRO  20  19.663  16.623  11.954
  148    H    ALA  21           HN       ALA  21  19.982  14.553  14.954
  149    HA   ALA  21           HA       ALA  21  19.376  14.016  17.582
  150    HB1  ALA  21           1HB      ALA  21  18.912  12.453  15.796
  151    HB2  ALA  21           2HB      ALA  21  20.643  12.299  15.413
  152    HB3  ALA  21           3HB      ALA  21  20.011  11.657  16.948
  153    H    ASP  22           HN       ASP  22  22.469  14.709  16.055
  154    HA   ASP  22           HA       ASP  22  24.057  13.426  17.968
  155    HB2  ASP  22           2HB      ASP  22  24.510  14.629  15.552
  156    HB3  ASP  22           3HB      ASP  22  25.067  15.906  16.615
  157    HD2  ASP  22           HD2      ASP  22  27.218  12.549  16.311
  158    H    TRP  23           HN       TRP  23  22.505  16.637  17.629
  159    HA   TRP  23           HA       TRP  23  23.960  17.884  19.726
  160    HB2  TRP  23           2HB      TRP  23  22.731  19.743  19.265
  161    HB3  TRP  23           3HB      TRP  23  22.649  18.906  17.728
  162    HD1  TRP  23           HD1      TRP  23  20.229  18.759  16.763
  163    HE1  TRP  23           HE1      TRP  23  17.740  18.879  17.631
  164    HE3  TRP  23           HE3      TRP  23  21.411  19.090  21.698
  165    HZ2  TRP  23           HZ2      TRP  23  16.571  19.094  20.225
  166    HZ3  TRP  23           HZ3      TRP  23  19.536  19.251  23.332
  167    HH2  TRP  23           HH2      TRP  23  17.184  19.257  22.666
  168    H    VAL  24           HN       VAL  24  20.652  16.420  19.383
  169    HA   VAL  24           HA       VAL  24  19.847  16.826  22.001
  170    HB   VAL  24           HB       VAL  24  18.858  15.675  19.675
  171   HG11  VAL  24          1HG1      VAL  24  18.987  13.603  21.887
  172   HG12  VAL  24          2HG1      VAL  24  17.877  13.516  20.499
  173   HG13  VAL  24          3HG1      VAL  24  19.637  13.471  20.235
  174   HG21  VAL  24          3HG2      VAL  24  17.880  16.501  22.317
  175   HG22  VAL  24          1HG2      VAL  24  17.194  16.782  20.699
  176   HG23  VAL  24          2HG2      VAL  24  16.873  15.251  21.548
  177    H    ILE  25           HN       ILE  25  21.485  13.963  20.486
  178    HA   ILE  25           HA       ILE  25  21.656  12.536  22.901
  179    HB   ILE  25           HB       ILE  25  21.912  11.875  20.353
  180   HG12  ILE  25          2HG1      ILE  25  23.347   9.848  21.333
  181   HG13  ILE  25          3HG1      ILE  25  22.927  10.601  22.859
  182   HG21  ILE  25          1HG2      ILE  25  24.814  11.904  21.176
  183   HG22  ILE  25          2HG2      ILE  25  24.105  11.575  19.577
  184   HG23  ILE  25          3HG2      ILE  25  24.080  13.227  20.239
  185   HD11  ILE  25          3HD1      ILE  25  20.507  10.568  22.196
  186   HD12  ILE  25          1HD1      ILE  25  20.960   9.736  20.690
  187   HD13  ILE  25          2HD1      ILE  25  21.220   8.939  22.259
  188    H    SER  26           HN       SER  26  23.652  15.051  21.361
  189    HA   SER  26           HA       SER  26  25.910  14.606  22.942
  190    HB2  SER  26           2HB      SER  26  26.277  15.870  20.983
  191    HB3  SER  26           3HB      SER  26  24.884  16.896  21.258
  192    HG   SER  26           HG       SER  26  27.409  17.447  21.878
  193    H    ALA  27           HN       ALA  27  22.914  16.535  23.326
  194    HA   ALA  27           HA       ALA  27  23.825  17.987  25.584
  195    HB1  ALA  27           1HB      ALA  27  20.915  17.456  25.149
  196    HB2  ALA  27           2HB      ALA  27  21.763  18.989  25.467
  197    HB3  ALA  27           3HB      ALA  27  21.794  18.277  23.836
  198    H    VAL  28           HN       VAL  28  22.326  14.806  25.021
  199    HA   VAL  28           HA       VAL  28  21.528  14.399  27.704
  200    HB   VAL  28           HB       VAL  28  22.089  12.492  25.425
  201   HG11  VAL  28          1HG1      VAL  28  20.230  11.681  27.580
  202   HG12  VAL  28          2HG1      VAL  28  21.441  10.731  26.685
  203   HG13  VAL  28          3HG1      VAL  28  21.946  11.762  28.046
  204   HG21  VAL  28          3HG2      VAL  28  20.001  12.871  24.662
  205   HG22  VAL  28          1HG2      VAL  28  19.313  12.983  26.300
  206   HG23  VAL  28          2HG2      VAL  28  20.125  14.392  25.577
  207    H    ARG  29           HN       ARG  29  24.380  13.289  25.749
  208    HA   ARG  29           HA       ARG  29  25.566  12.070  27.972
  209    HB2  ARG  29           2HB      ARG  29  27.586  11.923  26.479
  210    HB3  ARG  29           3HB      ARG  29  26.126  11.364  25.686
  211    HG2  ARG  29           2HG      ARG  29  26.006  13.986  24.971
  212    HG3  ARG  29           3HG      ARG  29  27.741  13.845  25.170
  213    HD2  ARG  29           2HD      ARG  29  25.967  12.622  23.108
  214    HD3  ARG  29           3HD      ARG  29  27.640  13.128  22.978
  215    HE   ARG  29           HE       ARG  29  26.666  10.486  23.883
  216   HH11  ARG  29          2HH2      ARG  29  29.438  12.668  23.551
  217   HH12  ARG  29          1HH2      ARG  29  30.610  11.400  23.687
  218   HH22  ARG  29          HH1       ARG  29  29.867   9.142  23.987
  219    H    GLY  30           HN       GLY  30  25.481  15.349  26.672
  220    HA2  GLY  30           1HA      GLY  30  27.885  16.301  27.874
  221    HA3  GLY  30           2HA      GLY  30  26.573  17.252  27.207
  222    H    PHE  31           HN       PHE  31  24.427  16.065  28.848
  223    HA   PHE  31           HA       PHE  31  24.837  17.677  31.174
  224    HB2  PHE  31           2HB      PHE  31  22.588  17.746  30.532
  225    HB3  PHE  31           3HB      PHE  31  22.698  16.211  29.695
  226    HD1  PHE  31           HD1      PHE  31  22.081  17.810  32.945
  227    HD2  PHE  31           HD2      PHE  31  22.107  14.154  30.789
  228    HE1  PHE  31           HE1      PHE  31  20.815  16.702  34.808
  229    HE2  PHE  31           HE2      PHE  31  20.842  13.046  32.652
  230    HZ   PHE  31           HZ       PHE  31  20.211  14.333  34.639
  231    H    ILE  32           HN       ILE  32  25.021  14.244  30.312
  232    HA   ILE  32           HA       ILE  32  24.616  13.124  32.813
  233    HB   ILE  32           HB       ILE  32  25.046  12.185  30.345
  234   HG12  ILE  32          2HG1      ILE  32  25.794  10.273  32.487
  235   HG13  ILE  32          3HG1      ILE  32  24.299  11.152  32.741
  236   HG21  ILE  32          1HG2      ILE  32  27.607  11.414  31.742
  237   HG22  ILE  32          2HG2      ILE  32  27.125  11.129  30.053
  238   HG23  ILE  32          3HG2      ILE  32  27.514  12.777  30.601
  239   HD11  ILE  32          3HD1      ILE  32  24.999   9.598  30.206
  240   HD12  ILE  32          1HD1      ILE  32  23.917   9.028  31.499
  241   HD13  ILE  32          2HD1      ILE  32  23.465  10.443  30.519
  242    H    HIS  33           HN       HIS  33  27.542  14.585  31.312
  243    HA   HIS  33           HA       HIS  33  29.119  13.929  33.617
  244    HB2  HIS  33           2HB      HIS  33  30.935  14.954  32.434
  245    HB3  HIS  33           3HB      HIS  33  30.049  13.923  31.328
  246    HD1  HIS  33           HD1      HIS  33  30.537  17.607  32.163
  247    HD2  HIS  33           HD2      HIS  33  29.028  15.193  29.082
  248    HE1  HIS  33           HE1      HIS  33  30.079  19.164  30.194
  249    H    GLY  34           HN       GLY  34  26.835  16.338  32.747
  250    HA2  GLY  34           1HA      GLY  34  26.802  17.681  35.103
  251    HA3  GLY  34           2HA      GLY  34  28.037  18.524  34.189
  Start of MODEL   20
    1    H1   VAL   1           HN       VAL   1   8.352  -1.304   4.318
    2    HA   VAL   1           HA       VAL   1   7.327   0.608   3.870
    3    HB   VAL   1           HB       VAL   1   8.268   1.903   1.962
    4   HG11  VAL   1          1HG1      VAL   1   9.677   2.426   3.622
    5   HG12  VAL   1          2HG1      VAL   1   9.712   0.753   4.227
    6   HG13  VAL   1          3HG1      VAL   1  10.800   1.245   2.907
    7   HG21  VAL   1          3HG2      VAL   1  10.317  -0.168   1.409
    8   HG22  VAL   1          1HG2      VAL   1   8.696  -0.485   0.746
    9   HG23  VAL   1          2HG2      VAL   1   9.554   1.016   0.322
   10    H    PHE   2           HN       PHE   2   5.738   1.775   2.458
   11    HA   PHE   2           HA       PHE   2   4.734   0.471   0.160
   12    HB2  PHE   2           2HB      PHE   2   2.730  -0.476   1.118
   13    HB3  PHE   2           3HB      PHE   2   3.985  -0.942   2.249
   14    HD1  PHE   2           HD1      PHE   2   4.358   0.678   4.266
   15    HD2  PHE   2           HD2      PHE   2   0.833   0.604   1.905
   16    HE1  PHE   2           HE1      PHE   2   3.085   1.776   6.131
   17    HE2  PHE   2           HE2      PHE   2  -0.439   1.702   3.769
   18    HZ   PHE   2           HZ       PHE   2   0.702   2.275   5.860
   19    H    HIS   3           HN       HIS   3   5.633   3.110   0.807
   20    HA   HIS   3           HA       HIS   3   3.535   4.597  -0.225
   21    HB2  HIS   3           2HB      HIS   3   2.285   4.701   1.680
   22    HB3  HIS   3           3HB      HIS   3   3.662   4.488   2.743
   23    HD1  HIS   3           HD1      HIS   3   1.265   6.954   1.935
   24    HD2  HIS   3           HD2      HIS   3   5.420   7.050   2.501
   25    HE1  HIS   3           HE1      HIS   3   1.860   9.381   2.451
   26    H    ALA   4           HN       ALA   4   6.499   4.473   1.792
   27    HA   ALA   4           HA       ALA   4   7.358   7.075   0.990
   28    HB1  ALA   4           1HB      ALA   4   9.037   6.731   2.514
   29    HB2  ALA   4           2HB      ALA   4   7.922   5.467   3.084
   30    HB3  ALA   4           3HB      ALA   4   9.285   5.039   2.022
   31    H    TYR   5           HN       TYR   5   8.282   3.663   0.164
   32    HA   TYR   5           HA       TYR   5   9.462   2.836  -1.530
   33    HB2  TYR   5           2HB      TYR   5   7.627   5.003  -2.574
   34    HB3  TYR   5           3HB      TYR   5   8.837   4.446  -3.713
   35    HD1  TYR   5           HD1      TYR   5   6.888   2.530  -1.146
   36    HD2  TYR   5           HD2      TYR   5   7.698   3.166  -5.298
   37    HE1  TYR   5           HE1      TYR   5   5.417   0.545  -1.745
   38    HE2  TYR   5           HE2      TYR   5   6.224   1.179  -5.883
   39    HH   TYR   5           HH       TYR   5   5.365  -1.111  -3.767
   40    H    SER   6           HN       SER   6  10.724   3.804  -3.793
   41    HA   SER   6           HA       SER   6  12.736   4.499  -4.308
   42    HB2  SER   6           2HB      SER   6  11.659   7.100  -3.129
   43    HB3  SER   6           3HB      SER   6  13.023   6.987  -4.223
   44    HG   SER   6           HG       SER   6  11.531   5.978  -5.799
   45    H    ALA   7           HN       ALA   7  14.163   3.326  -2.951
   46    HA   ALA   7           HA       ALA   7  14.588   3.896  -0.257
   47    HB1  ALA   7           1HB      ALA   7  15.356   1.809  -0.861
   48    HB2  ALA   7           2HB      ALA   7  15.971   2.370  -2.435
   49    HB3  ALA   7           3HB      ALA   7  16.889   2.710  -0.948
   50    H    ARG   8           HN       ARG   8  15.946   5.262  -3.266
   51    HA   ARG   8           HA       ARG   8  18.100   6.526  -2.058
   52    HB2  ARG   8           2HB      ARG   8  16.711   6.573  -4.671
   53    HB3  ARG   8           3HB      ARG   8  17.385   8.135  -4.252
   54    HG2  ARG   8           2HG      ARG   8  19.266   7.206  -5.231
   55    HG3  ARG   8           3HG      ARG   8  19.527   6.646  -3.591
   56    HD2  ARG   8           2HD      ARG   8  18.080   5.024  -5.741
   57    HD3  ARG   8           3HD      ARG   8  19.774   4.829  -5.338
   58    HE   ARG   8           HE       ARG   8  17.949   4.620  -3.037
   59   HH11  ARG   8          2HH2      ARG   8  19.655   2.856  -5.593
   60   HH12  ARG   8          1HH2      ARG   8  19.577   1.336  -4.766
   61   HH22  ARG   8          HH1       ARG   8  18.509   1.217  -2.624
   62    H    GLY   9           HN       GLY   9  14.716   7.071  -1.821
   63    HA2  GLY   9           1HA      GLY   9  15.066   9.926  -1.167
   64    HA3  GLY   9           2HA      GLY   9  13.560   9.133  -1.585
   65    H    VAL  10           HN       VAL  10  14.146   6.702   0.089
   66    HA   VAL  10           HA       VAL  10  12.987   7.647   2.479
   67    HB   VAL  10           HB       VAL  10  12.956   5.329   1.205
   68   HG11  VAL  10          1HG1      VAL  10  15.285   4.759   1.474
   69   HG12  VAL  10          2HG1      VAL  10  15.185   4.983   3.237
   70   HG13  VAL  10          3HG1      VAL  10  14.311   3.642   2.459
   71   HG21  VAL  10          3HG2      VAL  10  12.362   6.181   3.941
   72   HG22  VAL  10          1HG2      VAL  10  11.395   5.206   2.809
   73   HG23  VAL  10          2HG2      VAL  10  12.644   4.428   3.811
   74    H    ARG  11           HN       ARG  11  16.289   6.418   1.626
   75    HA   ARG  11           HA       ARG  11  17.268   6.758   4.206
   76    HB2  ARG  11           2HB      ARG  11  19.512   6.503   3.124
   77    HB3  ARG  11           3HB      ARG  11  18.377   5.296   2.554
   78    HG2  ARG  11           2HG      ARG  11  17.873   7.115   0.659
   79    HG3  ARG  11           3HG      ARG  11  19.456   7.720   1.104
   80    HD2  ARG  11           2HD      ARG  11  19.865   4.947   0.920
   81    HD3  ARG  11           3HD      ARG  11  18.739   5.269  -0.384
   82    HE   ARG  11           HE       ARG  11  20.584   7.287  -0.701
   83   HH11  ARG  11          2HH2      ARG  11  20.917   3.776  -0.361
   84   HH12  ARG  11          1HH2      ARG  11  22.371   3.698  -1.299
   85   HH22  ARG  11          HH1       ARG  11  23.285   5.715  -2.216
   86    H    ASN  12           HN       ASN  12  17.192   8.840   1.266
   87    HA   ASN  12           HA       ASN  12  18.916  10.787   2.132
   88    HB2  ASN  12           2HB      ASN  12  16.678  10.582   0.153
   89    HB3  ASN  12           3HB      ASN  12  17.055  12.217   0.660
   90   HD21  ASN  12          1HD2      ASN  12  18.778   9.206  -0.167
   91   HD22  ASN  12          2HD2      ASN  12  19.983   9.917  -1.188
   92    H    ASN  13           HN       ASN  13  15.677   9.906   3.152
   93    HA   ASN  13           HA       ASN  13  15.134  12.504   4.249
   94    HB2  ASN  13           2HB      ASN  13  13.636   9.876   4.022
   95    HB3  ASN  13           3HB      ASN  13  13.103  11.036   5.222
   96   HD21  ASN  13          1HD2      ASN  13  14.621  11.765   2.122
   97   HD22  ASN  13          2HD2      ASN  13  13.272  12.557   1.380
   98    H    TYR  14           HN       TYR  14  16.699   9.521   5.084
   99    HA   TYR  14           HA       TYR  14  16.126   9.619   7.898
  100    HB2  TYR  14           2HB      TYR  14  16.890   7.450   7.565
  101    HB3  TYR  14           3HB      TYR  14  17.163   7.847   5.880
  102    HD1  TYR  14           HD2      TYR  14  18.857   8.486   9.177
  103    HD2  TYR  14           HD1      TYR  14  19.278   7.391   5.063
  104    HE1  TYR  14           HE2      TYR  14  21.361   8.188   9.505
  105    HE2  TYR  14           HE1      TYR  14  21.780   7.097   5.405
  106    HH   TYR  14           HH       TYR  14  23.480   8.312   7.387
  107    H    LYS  15           HN       LYS  15  18.890  10.421   5.708
  108    HA   LYS  15           HA       LYS  15  20.727  11.014   7.697
  109    HB2  LYS  15           2HB      LYS  15  21.730  12.487   5.839
  110    HB3  LYS  15           3HB      LYS  15  21.595  10.764   5.556
  111    HG2  LYS  15           2HG      LYS  15  20.138  11.057   3.828
  112    HG3  LYS  15           3HG      LYS  15  19.138  12.159   4.753
  113    HD2  LYS  15           2HD      LYS  15  21.777  13.269   3.899
  114    HD3  LYS  15           3HD      LYS  15  20.671  12.904   2.590
  115    HE2  LYS  15           2HE      LYS  15  19.018  14.167   4.472
  116    HE3  LYS  15           3HE      LYS  15  20.527  15.045   4.623
  117    HZ1  LYS  15           2HZ      LYS  15  19.461  14.507   1.931
  118    HZ3  LYS  15           1HZ      LYS  15  20.418  15.732   2.415
  119    H    SER  16           HN       SER  16  17.786  12.615   6.787
  120    HA   SER  16           HA       SER  16  18.593  15.203   7.558
  121    HB2  SER  16           2HB      SER  16  16.138  13.856   6.635
  122    HB3  SER  16           3HB      SER  16  15.805  15.093   7.831
  123    HG   SER  16           HG       SER  16  16.390  15.422   5.210
  124    H    ALA  17           HN       ALA  17  16.632  12.567   9.108
  125    HA   ALA  17           HA       ALA  17  16.201  13.951  11.510
  126    HB1  ALA  17           1HB      ALA  17  15.560  11.704  12.349
  127    HB2  ALA  17           2HB      ALA  17  14.840  12.050  10.759
  128    HB3  ALA  17           3HB      ALA  17  16.250  10.971  10.881
  129    H    VAL  18           HN       VAL  18  19.050  12.643  10.111
  130    HA   VAL  18           HA       VAL  18  20.290  11.860  12.570
  131    HB   VAL  18           HB       VAL  18  21.074  12.115   9.694
  132   HG11  VAL  18          1HG1      VAL  18  22.899  12.378  12.003
  133   HG12  VAL  18          2HG1      VAL  18  23.370  11.141  10.813
  134   HG13  VAL  18          3HG1      VAL  18  23.129  12.827  10.296
  135   HG21  VAL  18          3HG2      VAL  18  20.443   9.997  11.602
  136   HG22  VAL  18          1HG2      VAL  18  20.486   9.959   9.823
  137   HG23  VAL  18          2HG2      VAL  18  21.981   9.705  10.756
  138    H    GLY  19           HN       GLY  19  19.920  14.801  10.624
  139    HA2  GLY  19           1HA      GLY  19  22.081  16.298  11.502
  140    HA3  GLY  19           2HA      GLY  19  20.520  16.930  11.016
  141    HA   PRO  20           HA       PRO  20  19.441  17.667  15.169
  142    HB2  PRO  20           2HB      PRO  20  16.946  16.630  15.585
  143    HB3  PRO  20           3HB      PRO  20  17.229  18.132  14.726
  144    HG2  PRO  20           2HG      PRO  20  16.498  15.483  13.637
  145    HG3  PRO  20           3HG      PRO  20  16.371  17.056  12.876
  146    HD2  PRO  20           2HD      PRO  20  18.365  15.059  12.366
  147    HD3  PRO  20           3HD      PRO  20  18.304  16.675  11.691
  148    H    ALA  21           HN       ALA  21  19.351  14.341  14.307
  149    HA   ALA  21           HA       ALA  21  19.017  13.217  16.806
  150    HB1  ALA  21           1HB      ALA  21  20.658  12.345  14.396
  151    HB2  ALA  21           2HB      ALA  21  20.301  11.300  15.792
  152    HB3  ALA  21           3HB      ALA  21  18.975  11.906  14.772
  153    H    ASP  22           HN       ASP  22  21.674  15.084  15.468
  154    HA   ASP  22           HA       ASP  22  23.642  14.043  17.186
  155    HB2  ASP  22           2HB      ASP  22  24.548  15.126  15.319
  156    HB3  ASP  22           3HB      ASP  22  23.350  16.405  15.345
  157    HD2  ASP  22           HD2      ASP  22  26.426  16.585  17.890
  158    H    TRP  23           HN       TRP  23  21.152  16.591  17.309
  159    HA   TRP  23           HA       TRP  23  22.252  17.992  19.523
  160    HB2  TRP  23           2HB      TRP  23  20.478  19.390  19.317
  161    HB3  TRP  23           3HB      TRP  23  20.532  18.726  17.696
  162    HD1  TRP  23           HD1      TRP  23  18.200  17.927  16.845
  163    HE1  TRP  23           HE1      TRP  23  15.886  17.144  17.844
  164    HE3  TRP  23           HE3      TRP  23  19.655  18.078  21.715
  165    HZ2  TRP  23           HZ2      TRP  23  14.945  16.687  20.499
  166    HZ3  TRP  23           HZ3      TRP  23  17.978  17.449  23.448
  167    HH2  TRP  23           HH2      TRP  23  15.693  16.771  22.906
  168    H    VAL  24           HN       VAL  24  19.556  15.594  19.063
  169    HA   VAL  24           HA       VAL  24  18.861  15.384  21.735
  170    HB   VAL  24           HB       VAL  24  18.123  14.275  19.291
  171   HG11  VAL  24          1HG1      VAL  24  17.895  11.834  19.870
  172   HG12  VAL  24          2HG1      VAL  24  19.557  12.369  19.525
  173   HG13  VAL  24          3HG1      VAL  24  19.037  12.109  21.208
  174   HG21  VAL  24          3HG2      VAL  24  16.500  13.037  21.170
  175   HG22  VAL  24          1HG2      VAL  24  17.103  14.477  22.026
  176   HG23  VAL  24          2HG2      VAL  24  16.256  14.656  20.471
  177    H    ILE  25           HN       ILE  25  21.168  13.377  19.774
  178    HA   ILE  25           HA       ILE  25  21.949  11.752  21.899
  179    HB   ILE  25           HB       ILE  25  22.305  11.664  19.285
  180   HG12  ILE  25          2HG1      ILE  25  24.511  10.463  20.925
  181   HG13  ILE  25          3HG1      ILE  25  22.855  10.007  21.269
  182   HG21  ILE  25          1HG2      ILE  25  23.948  13.694  19.615
  183   HG22  ILE  25          2HG2      ILE  25  25.107  12.408  20.030
  184   HG23  ILE  25          3HG2      ILE  25  24.304  12.405  18.441
  185   HD11  ILE  25          3HD1      ILE  25  22.786   8.662  19.449
  186   HD12  ILE  25          1HD1      ILE  25  23.289  10.000  18.389
  187   HD13  ILE  25          2HD1      ILE  25  24.516   8.999  19.201
  188    H    SER  26           HN       SER  26  22.954  15.010  20.854
  189    HA   SER  26           HA       SER  26  25.282  15.083  22.384
  190    HB2  SER  26           2HB      SER  26  25.127  16.721  20.695
  191    HB3  SER  26           3HB      SER  26  23.482  17.152  21.115
  192    HG   SER  26           HG       SER  26  25.922  18.051  22.215
  193    H    ALA  27           HN       ALA  27  21.856  16.052  23.006
  194    HA   ALA  27           HA       ALA  27  22.402  17.130  25.571
  195    HB1  ALA  27           1HB      ALA  27  20.215  16.911  23.736
  196    HB2  ALA  27           2HB      ALA  27  19.680  16.259  25.303
  197    HB3  ALA  27           3HB      ALA  27  20.331  17.913  25.203
  198    H    VAL  28           HN       VAL  28  21.741  13.902  24.250
  199    HA   VAL  28           HA       VAL  28  20.916  12.686  26.631
  200    HB   VAL  28           HB       VAL  28  22.310  11.603  24.176
  201   HG11  VAL  28          1HG1      VAL  28  22.144   9.484  24.953
  202   HG12  VAL  28          2HG1      VAL  28  22.173  10.278  26.546
  203   HG13  VAL  28          3HG1      VAL  28  20.620   9.804  25.816
  204   HG21  VAL  28          3HG2      VAL  28  19.530  10.873  24.473
  205   HG22  VAL  28          1HG2      VAL  28  19.712  12.643  24.537
  206   HG23  VAL  28          2HG2      VAL  28  20.338  11.732  23.141
  207    H    ARG  29           HN       ARG  29  24.179  12.965  25.064
  208    HA   ARG  29           HA       ARG  29  25.440  11.650  27.187
  209    HB2  ARG  29           2HB      ARG  29  27.419  11.995  25.967
  210    HB3  ARG  29           3HB      ARG  29  26.222  12.125  24.695
  211    HG2  ARG  29           2HG      ARG  29  26.226  14.712  25.400
  212    HG3  ARG  29           3HG      ARG  29  27.810  14.316  26.038
  213    HD2  ARG  29           2HD      ARG  29  26.924  14.551  23.217
  214    HD3  ARG  29           3HD      ARG  29  28.524  14.760  23.901
  215    HE   ARG  29           HE       ARG  29  27.343  12.224  22.930
  216   HH11  ARG  29          2HH2      ARG  29  30.033  13.800  24.612
  217   HH12  ARG  29          1HH2      ARG  29  31.115  12.465  24.393
  218   HH22  ARG  29          HH1       ARG  29  30.351  10.514  23.231
  219    H    GLY  30           HN       GLY  30  24.424  14.972  26.559
  220    HA2  GLY  30           1HA      GLY  30  26.211  16.241  28.400
  221    HA3  GLY  30           2HA      GLY  30  24.790  16.927  27.639
  222    H    PHE  31           HN       PHE  31  22.923  14.795  28.527
  223    HA   PHE  31           HA       PHE  31  22.393  15.878  31.119
  224    HB2  PHE  31           2HB      PHE  31  20.390  15.411  29.996
  225    HB3  PHE  31           3HB      PHE  31  21.144  14.193  28.988
  226    HD1  PHE  31           HD2      PHE  31  19.554  14.805  32.251
  227    HD2  PHE  31           HD1      PHE  31  21.063  11.876  29.577
  228    HE1  PHE  31           HE2      PHE  31  18.450  13.001  33.603
  229    HE2  PHE  31           HE1      PHE  31  19.960  10.072  30.929
  230    HZ   PHE  31           HZ       PHE  31  18.666  10.656  32.926
  231    H    ILE  32           HN       ILE  32  23.904  12.975  29.777
  232    HA   ILE  32           HA       ILE  32  23.509  11.229  31.894
  233    HB   ILE  32           HB       ILE  32  24.620  11.054  29.478
  234   HG12  ILE  32          2HG1      ILE  32  25.723   9.046  31.340
  235   HG13  ILE  32          3HG1      ILE  32  24.003   9.332  31.515
  236   HG21  ILE  32          1HG2      ILE  32  26.959  10.832  29.474
  237   HG22  ILE  32          2HG2      ILE  32  26.639  12.349  30.349
  238   HG23  ILE  32          3HG2      ILE  32  27.056  10.871  31.251
  239   HD11  ILE  32          3HD1      ILE  32  25.481   8.542  28.968
  240   HD12  ILE  32          1HD1      ILE  32  24.278   7.583  29.864
  241   HD13  ILE  32          2HD1      ILE  32  23.775   9.051  28.991
  242    H    HIS  33           HN       HIS  33  25.939  13.833  31.377
  243    HA   HIS  33           HA       HIS  33  27.232  13.179  33.858
  244    HB2  HIS  33           2HB      HIS  33  28.759  14.950  33.309
  245    HB3  HIS  33           3HB      HIS  33  28.501  13.953  31.891
  246    HD1  HIS  33           HD1      HIS  33  27.666  17.373  33.299
  247    HD2  HIS  33           HD2      HIS  33  27.374  15.259  29.688
  248    HE1  HIS  33           HE1      HIS  33  27.016  19.083  31.519
  249    H    GLY  34           HN       GLY  34  24.446  14.907  32.855
  250    HA2  GLY  34           1HA      GLY  34  23.119  15.603  34.843
  251    HA3  GLY  34           2HA      GLY  34  24.516  16.550  35.316