*HEADER    ANTIMICROBIAL PROTEIN                   05-JAN-16   2NAL              
*TITLE     NMR STRUCTURE OF RETRO-KR-12: A REVERSED SEQUENCE OF A MINIMALIZED    
*TITLE    2 DOMAIN DERIVED FROM HUMAN CATHELICIDIN LL-37                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RETRO-KR-12;                                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT;                            
*SOURCE   4 ORGANISM_TAXID: 32630                                                
*KEYWDS    RETRO-PEPTIDE, ANTIMICROBIAL, HELICAL, CATHELICIDIN, ANTIMICROBIAL    
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    15                                                                    
*AUTHOR    S.GUNASEKERA, U.GORANSSON                                             
*REVDAT   1   18-JAN-17 2NAL    0                                                


  2 LEU  H       2 LEU  QD1     4.17            #peak 13 #SUP 1.00
  2 LEU  H       2 LEU  QD2     4.00            #peak 14 #SUP 1.00
  2 LEU  H       2 LEU  QB      3.36            #peak 15 #SUP 1.00
  2 LEU  H       2 LEU  HG      3.63            #peak 16 #SUP 0.96 #QF 0.96
  2 LEU  QB      3 PHE  H       3.91            #peak 17 #SUP 0.72 #QF 0.72
  2 LEU  HG      3 PHE  H       3.74            #peak 18 #SUP 0.87 #QF 0.87
  2 LEU  QD1     3 PHE  H       5.05            #peak 19 #SUP 0.93 #QF 0.79
  3 PHE  H       6 ILE  QD1     5.44            #peak 19 #SUP 0.93 #QF 0.79
  2 LEU  QD2     3 PHE  H       4.38            #peak 20 #SUP 0.92 #QF 0.92
  2 LEU  HA      3 PHE  H       3.51            #peak 21 #SUP 0.99 #QF 0.99
  2 LEU  HA      2 LEU  HG      3.78            #peak 23 #SUP 0.95 #QF 0.95
  1 ARG  QD      2 LEU  H       4.90            #peak 26 #SUP 0.99 #QF 0.99
  1 ARG  HB3     2 LEU  H       3.96            #peak 27 #SUP 0.99 #QF 0.99
  1 ARG  QG      2 LEU  H       4.40            #peak 28 #SUP 1.00
  1 ARG  HB3     3 PHE  H       5.39            #peak 29 #SUP 0.94 #QF 0.94
  1 ARG  QG      3 PHE  H       5.04            #peak 30 #SUP 1.00
  1 ARG  HB2     2 LEU  H       4.42            #peak 31 #SUP 1.00
  1 ARG  QD      3 PHE  H       3.83            #peak 32 #SUP 1.00 #QF 0.50
  1 ARG  HB2     3 PHE  H       5.50            #peak 33 #SUP 1.00
  1 ARG  HA      2 LEU  H       3.30            #peak 34 #SUP 0.95 #QF 0.95
  1 ARG  HA      3 PHE  H       4.60            #peak 35 #SUP 0.99 #QF 0.99
  3 PHE  H       3 PHE  HB2     3.72            #peak 36 #SUP 0.99 #QF 0.99
  3 PHE  HB2     4 ASP  H       3.65            #peak 39 #SUP 0.84 #QF 0.84
  1 ARG  QD      4 ASP  H       4.02            #peak 40 #SUP 0.99 #QF 0.51
  3 PHE  HB3     4 ASP  H       4.56            #peak 40 #SUP 0.99 #QF 0.51
  4 ASP  H       4 ASP  HB2     3.22            #peak 41 #SUP 0.94 #QF 0.94
  4 ASP  H       4 ASP  HB3     3.36            #peak 42 #SUP 0.97 #QF 0.97
 12 LYS  H      12 LYS  QD      3.34            #peak 43 #SUP 0.83 #QF 0.83
  1 ARG  QG      4 ASP  H       4.12            #peak 44 #SUP 0.99 #QF 0.51
  1 ARG  HB3     4 ASP  H       4.11            #peak 45 #SUP 0.98 #QF 0.98
  1 ARG  HB2     4 ASP  H       4.72            #peak 46 #SUP 0.95 #QF 0.95
  4 ASP  HB2     5 LYS  H       3.70            #peak 47 #SUP 0.88 #QF 0.88
  4 ASP  HB3     5 LYS  H       3.94            #peak 48 #SUP 0.97 #QF 0.97
  5 LYS  HA      5 LYS  QE      4.34            #peak 50 #SUP 1.00
  5 LYS  HA      5 LYS  QG      3.32            #peak 52 #SUP 0.99 #QF 0.99
  5 LYS  HA      5 LYS  QD      3.37            #peak 53 #SUP 0.97 #QF 0.97
  5 LYS  H       5 LYS  QB      3.09            #peak 54 #SUP 0.70 #QF 0.70
  5 LYS  H       5 LYS  QG      3.23            #peak 55 #SUP 0.67 #QF 0.43
 11 ARG  H      11 ARG  QG      3.65            #peak 55 #SUP 0.67 #QF 0.43
  5 LYS  H       5 LYS  QD      3.99            #peak 56 #SUP 0.88 #QF 0.85
 11 ARG  H      12 LYS  QD      4.48            #peak 56 #SUP 0.88 #QF 0.85
  6 ILE  H       6 ILE  HG12    4.06            #peak 58 #SUP 0.99 #QF 0.99
  5 LYS  QD      6 ILE  H       5.12            #peak 59 #SUP 0.93 #QF 0.93
  6 ILE  H       6 ILE  HB      3.05            #peak 60 #SUP 0.70 #QF 0.70
  6 ILE  HA      6 ILE  HG12    4.01            #peak 62 #SUP 0.99 #QF 0.99
  6 ILE  HA      6 ILE  HG13    4.01            #peak 63 #SUP 1.00
  6 ILE  HA      6 ILE  QD1     3.35            #peak 64 #SUP 0.98 #QF 0.98
  6 ILE  H       6 ILE  QD1     3.68            #peak 66 #SUP 0.69 #QF 0.69
  6 ILE  H       6 ILE  HG13    4.06            #peak 67 #SUP 0.92 #QF 0.92
  6 ILE  QD1     7 ARG  H       4.24            #peak 69 #SUP 0.95 #QF 0.95
  7 ARG  H       7 ARG  HG2     4.52            #peak 71 #SUP 0.85 #QF 0.85
  6 ILE  HB      7 ARG  H       3.10            #peak 72 #SUP 0.38 #QF 0.38
  7 ARG  HA      7 ARG  QD      3.70            #peak 73 #SUP 0.99 #QF 0.99
  7 ARG  HA      7 ARG  HG2     3.70            #peak 76 #SUP 0.99 #QF 0.99
  7 ARG  HA      7 ARG  HG3     3.70            #peak 77 #SUP 1.00
  7 ARG  H       7 ARG  QD      4.23            #peak 78 #SUP 0.94 #QF 0.94
  7 ARG  H       7 ARG  HB2     3.44            #peak 79 #SUP 0.99 #QF 0.99
  7 ARG  H       7 ARG  HG3     4.52            #peak 80 #SUP 1.00
  7 ARG  HB3     8 GLN  H       3.83            #peak 82 #SUP 0.87 #QF 0.87
  7 ARG  HB2     8 GLN  H       4.14            #peak 83 #SUP 0.88 #QF 0.88
  7 ARG  HG2     8 GLN  H       5.31            #peak 84 #SUP 0.99 #QF 0.99
  7 ARG  HG3     8 GLN  H       5.31            #peak 85 #SUP 0.89 #QF 0.80
  8 GLN  H      10 ILE  HG13    5.50            #peak 85 #SUP 0.89 #QF 0.80
  8 GLN  H       8 GLN  HB3     4.04            #peak 86 #SUP 1.00
  8 GLN  HB3     9 VAL  H       4.91            #peak 88 #SUP 1.00
  8 GLN  H       8 GLN  HB2     4.13            #peak 89 #SUP 1.00
  8 GLN  HB2     9 VAL  H       5.50            #peak 90 #SUP 0.94 #QF 0.94
  9 VAL  H       9 VAL  HB      3.41            #peak 91 #SUP 0.99 #QF 0.99
  9 VAL  HA      9 VAL  QG1     3.06            #peak 97 #SUP 0.99 #QF 0.99
  9 VAL  HA      9 VAL  QG2     3.01            #peak 98 #SUP 0.98 #QF 0.98
  9 VAL  H       9 VAL  QG1     3.44            #peak 99 #SUP 0.85 #QF 0.85
  9 VAL  H       9 VAL  QG2     3.74            #peak 100 #SUP 0.91 #QF 0.91
  9 VAL  HB     10 ILE  H       3.69            #peak 102 #SUP 0.98 #QF 0.98
  9 VAL  QG1    10 ILE  H       3.88            #peak 103 #SUP 1.00
 10 ILE  H      10 ILE  QG2     3.77            #peak 104 #SUP 0.44 #QF 0.44
 10 ILE  HA     10 ILE  HG13    3.61            #peak 106 #SUP 0.99 #QF 0.99
 10 ILE  HA     10 ILE  HG12    3.53            #peak 107 #SUP 0.98 #QF 0.98
 10 ILE  HA     10 ILE  QG2     3.25            #peak 108 #SUP 0.99 #QF 0.99
 10 ILE  HA     10 ILE  QD1     3.95            #peak 109 #SUP 0.99 #QF 0.99
 10 ILE  H      10 ILE  QD1     3.77            #peak 110 #SUP 0.96 #QF 0.96
 10 ILE  H      10 ILE  HG12    3.62            #peak 111 #SUP 0.99 #QF 0.99
 10 ILE  H      10 ILE  HB      3.26            #peak 112 #SUP 0.97 #QF 0.97
 10 ILE  H      10 ILE  HG13    3.43            #peak 113 #SUP 0.88 #QF 0.88
 10 ILE  HG13   11 ARG  H       4.04            #peak 116 #SUP 0.56 #QF 0.56
 10 ILE  QG2    11 ARG  H       3.48            #peak 118 #SUP 0.92 #QF 0.92
 10 ILE  QD1    11 ARG  H       4.42            #peak 119 #SUP 0.85 #QF 0.85
 11 ARG  HA     11 ARG  HD3     3.82            #peak 120 #SUP 0.99 #QF 0.99
 11 ARG  HA     11 ARG  QG      3.21            #peak 123 #SUP 0.99 #QF 0.99
 12 LYS  H      12 LYS  QG      4.10            #peak 124 #SUP 0.96 #QF 0.96
 12 LYS  HA     12 LYS  QE      5.50            #peak 126 #SUP 1.00
 12 LYS  HA     12 LYS  QG      3.75            #peak 129 #SUP 1.00
 12 LYS  HA     12 LYS  QD      3.71            #peak 130 #SUP 0.98 #QF 0.98
  3 PHE  H       3 PHE  QD      3.95            #peak 132 #SUP 0.98 #QF 0.98
  3 PHE  QD      7 ARG  H       5.50            #peak 135 #SUP 0.80 #QF 0.80
  7 ARG  H       7 ARG  HE      5.23            #peak 136 #SUP 0.93 #QF 0.93
 11 ARG  HA     11 ARG  HD2     4.37            #peak 140 #SUP 1.00
 11 ARG  HB2    11 ARG  HE      4.37            #peak 143 #SUP 0.95 #QF 0.95
 11 ARG  HB3    11 ARG  HE      4.37            #peak 144 #SUP 0.95 #QF 0.95
 11 ARG  HA     11 ARG  HE      4.84            #peak 146 #SUP 0.97 #QF 0.97
 11 ARG  H      11 ARG  HE      4.79            #peak 147 #SUP 0.99 #QF 0.99
  3 PHE  H       4 ASP  HB2     5.35            #peak 154 #SUP 0.84 #QF 0.84
  3 PHE  H       4 ASP  HB3     5.50            #peak 155 #SUP 0.91 #QF 0.91
  4 ASP  HB3     7 ARG  H       5.50            #peak 156 #SUP 0.96 #QF 0.96
  4 ASP  HB2     7 ARG  H       5.50            #peak 157 #SUP 1.00
  4 ASP  HB3     6 ILE  H       5.50            #peak 158 #SUP 0.99 #QF 0.99
  4 ASP  HB2     6 ILE  H       5.50            #peak 159 #SUP 0.97 #QF 0.97
  4 ASP  HA      7 ARG  H       3.96            #peak 160 #SUP 0.98 #QF 0.98
  5 LYS  HA      7 ARG  H       4.75            #peak 161 #SUP 0.59 #QF 0.59
  3 PHE  HA      6 ILE  H       3.81            #peak 162 #SUP 0.78 #QF 0.78
  4 ASP  HA      8 GLN  H       4.83            #peak 163 #SUP 0.98 #QF 0.98
  6 ILE  HA      9 VAL  H       4.35            #peak 164 #SUP 0.99 #QF 0.99
  7 ARG  HA      9 VAL  H       5.01            #peak 165 #SUP 0.94 #QF 0.94
  6 ILE  HA      8 GLN  H       4.49            #peak 166 #SUP 0.99 #QF 0.99
  7 ARG  HA     10 ILE  H       4.46            #peak 168 #SUP 0.95 #QF 0.95
  5 LYS  H       6 ILE  HA      5.45            #peak 169 #SUP 0.60 #QF 0.60
  7 ARG  HA     11 ARG  H       5.23            #peak 170 #SUP 0.99 #QF 0.99
  7 ARG  H       8 GLN  HB3     5.50            #peak 172 #SUP 0.61 #QF 0.61
  4 ASP  HA      7 ARG  QD      3.85            #peak 175 #SUP 0.53 #QF 0.53
 10 ILE  QG2    10 ILE  HG13    3.32            #peak 180 #SUP 0.90 #QF 0.90
 10 ILE  QG2    10 ILE  HG12    3.15            #peak 181 #SUP 0.85 #QF 0.85
  1 ARG  QD      5 LYS  H       5.50            #peak 192 #SUP 0.94 #QF 0.52
  1 ARG  HA      1 ARG  QD      4.13            #peak 193 #SUP 0.91 #QF 0.91
  2 LEU  HA      3 PHE  HA      4.89            #peak 194 #SUP 0.95 #QF 0.95
 10 ILE  HA     11 ARG  HA      5.50            #peak 195 #SUP 1.00
  4 ASP  HA      5 LYS  HA      5.50            #peak 196 #SUP 0.84 #QF 0.84
  4 ASP  HA      7 ARG  HA      5.33            #peak 197 #SUP 0.98 #QF 0.98
  5 LYS  HA      6 ILE  HA      5.37            #peak 198 #SUP 1.00
  7 ARG  HA      8 GLN  HA      4.92            #peak 200 #SUP 0.94 #QF 0.94
  6 ILE  HA      7 ARG  HA      5.49            #peak 203 #SUP 1.00
  6 ILE  H       7 ARG  HA      5.50            #peak 204 #SUP 0.95 #QF 0.95
  9 VAL  H      10 ILE  HA      5.09            #peak 205 #SUP 1.00
  8 GLN  HA     10 ILE  H       4.47            #peak 206 #SUP 0.74 #QF 0.74
 10 ILE  HA     12 LYS  H       4.47            #peak 208 #SUP 0.75 #QF 0.75
 11 ARG  H      11 ARG  HD3     4.33            #peak 210 #SUP 0.99 #QF 0.99
  3 PHE  HB3     7 ARG  H       5.50            #peak 211 #SUP 0.96 #QF 0.96
  7 ARG  QD      8 GLN  H       4.82            #peak 212 #SUP 0.98 #QF 0.98
  4 ASP  HB3     8 GLN  H       5.50            #peak 214 #SUP 0.92 #QF 0.92
  2 LEU  HA      6 ILE  H       5.50            #peak 215 #SUP 0.97 #QF 0.97
  1 ARG  HB2     1 ARG  QD      3.42            #peak 216 #SUP 0.90 #QF 0.90
  1 ARG  HB3     1 ARG  QD      3.38            #peak 217 #SUP 0.79 #QF 0.79
  1 ARG  QG      1 ARG  QD      2.85            #peak 218 #SUP 0.88 #QF 0.88
  7 ARG  QD     10 ILE  QG2     5.50            #peak 221 #SUP 0.73 #QF 0.73
  5 LYS  QG      5 LYS  QE      3.11            #peak 224 #SUP 0.59 #QF 0.59
  1 ARG  QG      4 ASP  HB2     5.34            #peak 225 #SUP 1.00 #QF 0.99
  5 LYS  QB      5 LYS  QE      4.13            #peak 226 #SUP 0.90 #QF 0.90
  1 ARG  HB3     4 ASP  HB2     4.12            #peak 227 #SUP 0.74 #QF 0.74
 11 ARG  HB2    11 ARG  HD2     3.96            #peak 229 #SUP 0.93 #QF 0.93
 11 ARG  HB3    11 ARG  HD2     3.96            #peak 230 #SUP 0.72 #QF 0.72
  7 ARG  HB2     7 ARG  QD      3.41            #peak 234 #SUP 0.93 #QF 0.93
  7 ARG  HB3     7 ARG  QD      3.40            #peak 235 #SUP 0.84 #QF 0.84
  2 LEU  H       3 PHE  QD      5.20            #peak 236 #SUP 0.96 #QF 0.96
  2 LEU  H       3 PHE  HA      5.50            #peak 237 #SUP 0.99 #QF 0.99
  3 PHE  HB3     6 ILE  H       5.50            #peak 238 #SUP 0.97 #QF 0.97
  6 ILE  H       7 ARG  QD      5.36            #peak 239 #SUP 0.40 #QF 0.40
  1 ARG  QD      2 LEU  HA      5.22            #peak 245 #SUP 0.62 #QF 0.62
  9 VAL  HA     11 ARG  HD3     4.72            #peak 246 #SUP 0.34 #QF 0.34
  8 GLN  HA     11 ARG  HD3     4.60            #peak 248 #SUP 0.64 #QF 0.64
  4 ASP  HB3     5 LYS  HA      5.18            #peak 249 #SUP 1.00 #QF 0.80
  2 LEU  H       3 PHE  HB2     5.50            #peak 252 #SUP 0.91 #QF 0.91
 11 ARG  H      11 ARG  HD2     4.90            #peak 253 #SUP 0.52 #QF 0.52
 11 ARG  HD2    12 LYS  H       5.14            #peak 254 #SUP 0.97 #QF 0.97
  3 PHE  HA      3 PHE  QD      3.07            #peak 256 #SUP 0.84 #QF 0.84
 10 ILE  H      11 ARG  HA      5.15            #peak 257 #SUP 0.99 #QF 0.99
  7 ARG  HA      7 ARG  HE      5.49            #peak 260 #SUP 1.00
  2 LEU  H       3 PHE  H       4.08            #peak 261 #SUP 0.98 #QF 0.98
  3 PHE  H       5 LYS  H       5.07            #peak 263 #SUP 0.93 #QF 0.93
  7 ARG  HA     12 LYS  H       5.50            #peak 265 #SUP 0.97 #QF 0.97
  7 ARG  H      10 ILE  H       5.50            #peak 266 #SUP 0.91 #QF 0.91
  6 ILE  H       8 GLN  H       4.86            #peak 267 #SUP 0.94 #QF 0.94
 10 ILE  H      12 LYS  H       5.09            #peak 270 #SUP 0.91 #QF 0.91
  9 VAL  H      11 ARG  H       4.66            #peak 271 #SUP 0.93 #QF 0.93
 11 ARG  HE     12 LYS  H       5.50            #peak 273 #SUP 0.97 #QF 0.97
  6 ILE  HA      9 VAL  QG1     3.65            #peak 274 #SUP 0.89 #QF 0.89
  6 ILE  HA      9 VAL  QG2     4.13            #peak 275 #SUP 0.99 #QF 0.99
  6 ILE  HA      9 VAL  HB      4.03            #peak 276 #SUP 0.95 #QF 0.95
  8 GLN  HB2     9 VAL  QG2     5.50            #peak 281 #SUP 0.91 #QF 0.91
  8 GLN  HB3     9 VAL  QG2     5.49            #peak 282 #SUP 0.76 #QF 0.76
  7 ARG  HA      9 VAL  QG1     5.42            #peak 285 #SUP 0.82 #QF 0.82
  4 ASP  HB3     5 LYS  QD      5.50            #peak 288 #SUP 0.74 #QF 0.74
  4 ASP  HB3     5 LYS  QG      4.95            #peak 290 #SUP 0.40 #QF 0.40
  1 ARG  QG      4 ASP  HB3     5.08            #peak 291 #SUP 0.98 #QF 0.88
  4 ASP  HB3     5 LYS  QB      4.96            #peak 292 #SUP 0.78 #QF 0.78
  1 ARG  HB3     4 ASP  HB3     4.92            #peak 293 #SUP 0.78 #QF 0.78
  7 ARG  HB3     8 GLN  HB2     5.50            #peak 294 #SUP 0.78 #QF 0.78
  7 ARG  HB3     8 GLN  HB3     5.25            #peak 295 #SUP 0.77 #QF 0.77
  7 ARG  HA      9 VAL  HB      5.50            #peak 297 #SUP 0.96 #QF 0.96
  1 ARG  HB2     4 ASP  HB3     5.50            #peak 299 #SUP 0.75 #QF 0.75
  1 ARG  HB2     4 ASP  HB2     5.50            #peak 300 #SUP 0.82 #QF 0.60
  1 ARG  HB2     5 LYS  QE      5.50            #peak 300 #SUP 0.82 #QF 0.60
  7 ARG  HA     10 ILE  HG12    4.05            #peak 301 #SUP 0.99 #QF 0.99
  6 ILE  HA     10 ILE  HG12    5.50            #peak 302 #SUP 0.96 #QF 0.96
  6 ILE  HA     10 ILE  HG13    4.59            #peak 304 #SUP 0.87 #QF 0.87
  6 ILE  HA      7 ARG  QD      5.50            #peak 305 #SUP 0.37 #QF 0.37
  9 VAL  HB     10 ILE  HG12    5.34            #peak 308 #SUP 0.98 #QF 0.98
  1 ARG  HB2     5 LYS  QD      4.67            #peak 313 #SUP 0.61 #QF 0.61
  1 ARG  HB2     5 LYS  QG      4.34            #peak 314 #SUP 0.84 #QF 0.84
  1 ARG  HB2     5 LYS  QB      4.13            #peak 316 #SUP 0.39 #QF 0.39
  9 VAL  HB     10 ILE  HG13    5.32            #peak 318 #SUP 0.77 #QF 0.77
  9 VAL  HB     11 ARG  QG      5.50            #peak 319 #SUP 0.76 #QF 0.76
  4 ASP  HB3     7 ARG  QD      5.50            #peak 321 #SUP 0.99 #QF 0.99
  1 ARG  QD      2 LEU  HG      5.03            #peak 322 #SUP 0.88 #QF 0.46
  2 LEU  HG      3 PHE  HB3     5.50            #peak 322 #SUP 0.88 #QF 0.46
  2 LEU  HG      3 PHE  HB2     4.69            #peak 323 #SUP 0.69 #QF 0.69
  3 PHE  HB3     6 ILE  HB      5.13            #peak 324 #SUP 0.59 #QF 0.59
  1 ARG  HB3     3 PHE  HB2     4.99            #peak 325 #SUP 0.58 #QF 0.58
  1 ARG  QD      4 ASP  HB3     5.50            #peak 327 #SUP 0.89 #QF 0.89
  1 ARG  QD      4 ASP  HB2     5.50            #peak 328 #SUP 0.99 #QF 0.93
  9 VAL  QG1    10 ILE  HB      4.81            #peak 330 #SUP 0.92 #QF 0.92
  9 VAL  QG1    10 ILE  HG13    4.67            #peak 331 #SUP 1.00
  6 ILE  HB      9 VAL  QG1     5.18            #peak 336 #SUP 0.88 #QF 0.88
  9 VAL  QG1    11 ARG  QG      4.65            #peak 337 #SUP 0.64 #QF 0.64
  6 ILE  HB      6 ILE  QD1     3.27            #peak 338 #SUP 0.88 #QF 0.88
 10 ILE  HB     10 ILE  QD1     3.32            #peak 343 #SUP 0.92 #QF 0.92
  1 ARG  HB3     6 ILE  QD1     5.03            #peak 344 #SUP 0.79 #QF 0.79
  6 ILE  QD1     9 VAL  HB      5.50            #peak 345 #SUP 0.90 #QF 0.90
  1 ARG  HB2     6 ILE  QD1     5.50            #peak 346 #SUP 0.64 #QF 0.49
 10 ILE  QG2    12 LYS  QG      3.71            #peak 351 #SUP 0.54 #QF 0.54
 10 ILE  QG2    12 LYS  QD      4.66            #peak 353 #SUP 0.77 #QF 0.77
  1 ARG  HA      1 ARG  HB3     2.99            #peak 354 #SUP 0.98 #QF 0.98
  1 ARG  HB3     2 LEU  HA      4.61            #peak 355 #SUP 0.97 #QF 0.97
  7 ARG  HA     10 ILE  HB      3.85            #peak 357 #SUP 0.99 #QF 0.99
  2 LEU  QD2     3 PHE  QD      3.48            #peak 360 #SUP 0.69 #QF 0.69
  2 LEU  QD1     3 PHE  QD      4.05            #peak 361 #SUP 0.79 #QF 0.72
  3 PHE  QD      6 ILE  QD1     4.66            #peak 361 #SUP 0.79 #QF 0.72
  2 LEU  QD2     4 ASP  HB2     5.50            #peak 362 #SUP 0.34 #QF 0.34
  5 LYS  QE      6 ILE  QD1     5.50            #peak 363 #SUP 0.62 #QF 0.62
  1 ARG  HB3     5 LYS  QD      4.35            #peak 364 #SUP 0.99 #QF 0.99
 12 LYS  HB2    12 LYS  QD      3.37            #peak 366 #SUP 0.74 #QF 0.74
 12 LYS  HB3    12 LYS  QD      3.37            #peak 369 #SUP 0.62 #QF 0.62
  1 ARG  HB3     5 LYS  QG      3.47            #peak 370 #SUP 0.69 #QF 0.69
  5 LYS  QG      5 LYS  QD      2.66            #peak 377 #SUP 0.86 #QF 0.59
 12 LYS  QG     12 LYS  QD      2.86            #peak 377 #SUP 0.86 #QF 0.59
 10 ILE  QG2    11 ARG  HD2     5.47            #peak 380 #SUP 0.93 #QF 0.93
 10 ILE  QG2    11 ARG  HA      4.66            #peak 381 #SUP 0.91 #QF 0.91
  7 ARG  HA     10 ILE  QG2     4.30            #peak 383 #SUP 0.90 #QF 0.90
  7 ARG  HA     10 ILE  QD1     3.67            #peak 384 #SUP 0.95 #QF 0.95
  3 PHE  HA      6 ILE  QD1     3.97            #peak 386 #SUP 0.31 #QF 0.31
  5 LYS  HA      6 ILE  QD1     4.48            #peak 388 #SUP 0.85 #QF 0.85
  1 ARG  HA      2 LEU  QD2     4.65            #peak 389 #SUP 0.86 #QF 0.86
  7 ARG  HA     10 ILE  HA      5.28            #peak 397 #SUP 1.00
  2 LEU  H       4 ASP  H       5.50            #peak 400 #SUP 0.80 #QF 0.80
  3 PHE  H       4 ASP  H       3.58            #peak 402 #SUP 0.90 #QF 0.90
  7 ARG  H       9 VAL  QG1     5.38            #peak 404 #SUP 0.81 #QF 0.81
  7 ARG  H      10 ILE  HG12    5.50            #peak 406 #SUP 1.00
  7 ARG  H       8 GLN  H       3.54            #peak 408 #SUP 0.99 #QF 0.99
  6 ILE  H       7 ARG  H       3.72            #peak 409 #SUP 0.99 #QF 0.99
  1 ARG  HB2     5 LYS  H       4.93            #peak 411 #SUP 0.65 #QF 0.65
 10 ILE  HG12   11 ARG  H       4.83            #peak 413 #SUP 0.88 #QF 0.88
  9 VAL  QG1    11 ARG  H       4.92            #peak 415 #SUP 0.88 #QF 0.88
 10 ILE  H      11 ARG  H       3.61            #peak 416 #SUP 0.99 #QF 0.99
  3 PHE  QD      4 ASP  H       4.51            #peak 417 #SUP 0.95 #QF 0.95
 10 ILE  HG12   12 LYS  H       5.50            #peak 418 #SUP 0.95 #QF 0.95
 10 ILE  QG2    12 LYS  H       3.78            #peak 420 #SUP 0.85 #QF 0.85
  2 LEU  QD2     4 ASP  H       4.73            #peak 421 #SUP 0.96 #QF 0.27
 10 ILE  QD1    12 LYS  H       5.12            #peak 421 #SUP 0.96 #QF 0.27
 11 ARG  HA     12 LYS  H       3.15            #peak 422 #SUP 0.92 #QF 0.92
  1 ARG  HA      4 ASP  H       5.03            #peak 423 #SUP 0.99 #QF 0.99
  1 ARG  HB3     6 ILE  H       4.94            #peak 425 #SUP 0.94 #QF 0.94
  9 VAL  H      10 ILE  HG12    5.00            #peak 429 #SUP 0.88 #QF 0.88
  9 VAL  H      10 ILE  HG13    4.51            #peak 430 #SUP 0.91 #QF 0.91
  9 VAL  H      11 ARG  QG      4.85            #peak 431 #SUP 0.46 #QF 0.46
  9 VAL  H      10 ILE  HB      5.03            #peak 433 #SUP 0.96 #QF 0.96
  7 ARG  HB2     9 VAL  H       5.20            #peak 434 #SUP 0.95 #QF 0.95
  7 ARG  HB3    10 ILE  H       5.10            #peak 440 #SUP 0.92 #QF 0.92
  2 LEU  HA      3 PHE  QD      5.50            #peak 442 #SUP 1.00
  7 ARG  HB3     7 ARG  HE      5.01            #peak 445 #SUP 0.74 #QF 0.74
  7 ARG  HB2     7 ARG  HE      4.07            #peak 446 #SUP 0.94 #QF 0.94
  2 LEU  QB      2 LEU  QD1     2.80            #peak 451 #SUP 0.94 #QF 0.94
  8 GLN  HB2    11 ARG  QG      5.24            #peak 454 #SUP 0.49 #QF 0.49
  2 LEU  HG      3 PHE  HA      4.48            #peak 458 #SUP 0.73 #QF 0.41
 11 ARG  HA     12 LYS  QD      4.82            #peak 458 #SUP 0.73 #QF 0.41
  2 LEU  HA      5 LYS  QB      4.07            #peak 459 #SUP 0.33 #QF 0.33
  4 ASP  HA      7 ARG  HB2     4.01            #peak 461 #SUP 0.96 #QF 0.96
  6 ILE  HA      7 ARG  HB2     5.50            #peak 463 #SUP 0.94 #QF 0.94
  8 GLN  H       9 VAL  HA      5.50            #peak 466 #SUP 0.83 #QF 0.83
 11 ARG  H      12 LYS  HA      5.44            #peak 467 #SUP 0.70 #QF 0.70
  3 PHE  HB3     7 ARG  HE      4.39            #peak 469 #SUP 0.36 #QF 0.36
  4 ASP  HA      7 ARG  HE      5.02            #peak 470 #SUP 0.99 #QF 0.99
  9 VAL  QG1    10 ILE  HA      4.05            #peak 473 #SUP 0.97 #QF 0.97
  2 LEU  HA      2 LEU  QD2     4.00            #peak 475 #SUP 0.98 #QF 0.98
  2 LEU  HA      2 LEU  QD1     4.54            #peak 476 #SUP 0.99 #QF 0.98
  2 LEU  HA      6 ILE  QD1     4.74            #peak 476 #SUP 0.99 #QF 0.98
  8 GLN  H       9 VAL  HB      4.78            #peak 478 #SUP 0.96 #QF 0.96
  2 LEU  HA      4 ASP  H       5.50            #peak 479 #SUP 1.00
  6 ILE  HA     10 ILE  H       5.14            #peak 480 #SUP 0.91 #QF 0.91
  3 PHE  HA      6 ILE  QG1     5.28            #peak 387
  5 LYS  H       6 ILE  QG1     5.34            #peak 414
  5 LYS  HA      6 ILE  QG1     5.34            #peak 391
  6 ILE  H       6 ILE  QG1     3.34            #peak 67
  6 ILE  HA      6 ILE  QG1     3.39            #peak 63
  6 ILE  HA      8 GLN  QG      4.43            #peak 298
  6 ILE  QG1     7 ARG  H       4.68            #peak 70
  6 ILE  QD1     8 GLN  QG      5.34            #peak 346
  7 ARG  H       7 ARG  QG      3.92            #peak 80
  7 ARG  H       8 GLN  QG      4.97            #peak 171
  7 ARG  HA      7 ARG  QG      3.24            #peak 76
  7 ARG  HA      8 GLN  QG      5.34            #peak 296
  7 ARG  HB3     7 ARG  QG      2.49            #peak 376
  7 ARG  QG      7 ARG  HE      3.28            #peak 447
  8 GLN  H       8 GLN  QG      2.96            #peak 87
  8 GLN  QG      9 VAL  H       3.43            #peak 93
  8 GLN  QG      9 VAL  HA      3.81            #peak 359
  8 GLN  QG      9 VAL  QG1     4.72            #peak 280
  8 GLN  QG      9 VAL  QG2     3.68            #peak 279
  8 GLN  QG     10 ILE  H       4.41            #peak 439
  8 GLN  QG     11 ARG  HD3     5.34            #peak 228
 10 ILE  QG2    12 LYS  QB      3.79            #peak 352
 11 ARG  QB     11 ARG  HD2     3.45            #peak 230
 11 ARG  QB     11 ARG  HE      3.62            #peak 144
 12 LYS  H      12 LYS  QB      3.04            #peak 125
 12 LYS  QB     12 LYS  QD      2.75            #peak 366

#    2 L  -66.574  -26.023    7.375    9.940    2.407 0.736 10 12 Generous
   2   LEU  PHI     -96.6   -36.6
   2   LEU  PSI     -56.0     4.0

#    5 K  -69.166  -33.325    5.030    6.290    0.892 0.764 25 12 Strong
   5   LYS  PHI     -89.2   -49.2
   5   LYS  PSI     -53.3   -13.3

#    6 I  -68.933  -33.523    6.594    6.075    0.809 0.782 25 12 Strong
   6   ILE  PHI     -88.9   -48.9
   6   ILE  PSI     -53.5   -13.5

#    7 R  -67.157  -30.721    4.398    7.315    0.712 0.804 25 14 Strong
   7   ARG  PHI     -87.2   -47.2
   7   ARG  PSI     -50.7   -10.7

#    8 Q  -73.131  -30.664    9.455    8.754    0.744 0.797 25 15 Strong
   8   GLN  PHI     -93.1   -53.1
   8   GLN  PSI     -50.7   -10.7

#    9 V  -74.208  -30.785    8.608    9.542    0.852 0.770 25 14 Strong
   9   VAL  PHI     -94.2   -54.2
   9   VAL  PSI     -50.8   -10.8
  3 PHE  O       7 ARG  H       1.80
  3 PHE  O       7 ARG  N       2.70
  3 PHE  O       6 ILE  H       1.80
  3 PHE  O       6 ILE  N       2.70
  6 ILE  O       9 VAL  H       1.80
  6 ILE  O       9 VAL  N       2.70
  6 ILE  O      10 ILE  H       1.80
  6 ILE  O      10 ILE  N       2.70
  3 PHE  O       7 ARG  H       2.20
  3 PHE  O       7 ARG  N       3.20
  3 PHE  O       6 ILE  H       2.20
  3 PHE  O       6 ILE  N       3.20
  6 ILE  O       9 VAL  H       2.20
  6 ILE  O       9 VAL  N       3.20
  6 ILE  O      10 ILE  H       2.20
  6 ILE  O      10 ILE  N       3.20

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ARG   1           H        ARG   1   1.807   0.001   0.855
    2    HA   ARG   1           HA       ARG   1   1.520  -0.535  -1.984
    3    HB2  ARG   1           HB2      ARG   1   2.339   2.092  -0.870
    4    HB3  ARG   1           HB3      ARG   1   3.273   1.483  -2.230
    5    HG2  ARG   1           HG2      ARG   1   0.286   1.567  -2.351
    6    HG3  ARG   1           HG3      ARG   1   1.249   3.009  -2.682
    7    HD2  ARG   1           HD2      ARG   1   2.546   1.212  -4.211
    8    HD3  ARG   1           HD3      ARG   1   0.918   0.538  -4.261
    9    HE   ARG   1           HE       ARG   1   1.829   2.973  -5.495
   10   HH11  ARG   1          HH11      ARG   1  -0.926   1.218  -4.289
   11   HH12  ARG   1          HH12      ARG   1  -2.065   2.069  -5.278
   12   HH21  ARG   1          HH21      ARG   1   0.338   4.101  -6.802
   13   HH22  ARG   1          HH22      ARG   1  -1.346   3.708  -6.708
   14    H    LEU   2           H        LEU   2   3.422  -1.301  -2.962
   15    HA   LEU   2           HA       LEU   2   5.400  -2.286  -1.047
   16    HB2  LEU   2           HB2      LEU   2   6.009  -3.894  -2.702
   17    HB3  LEU   2           HB3      LEU   2   4.252  -3.869  -2.570
   18    HG   LEU   2           HG       LEU   2   5.454  -2.189  -4.693
   19   HD11  LEU   2          HD11      LEU   2   5.866  -3.980  -6.185
   20   HD12  LEU   2          HD12      LEU   2   5.225  -5.167  -5.051
   21   HD13  LEU   2          HD13      LEU   2   6.748  -4.349  -4.703
   22   HD21  LEU   2          HD21      LEU   2   3.453  -3.600  -5.808
   23   HD22  LEU   2          HD22      LEU   2   3.211  -2.094  -4.923
   24   HD23  LEU   2          HD23      LEU   2   2.953  -3.642  -4.117
   25    H    PHE   3           H        PHE   3   5.022   0.051  -3.508
   26    HA   PHE   3           HA       PHE   3   7.934   0.496  -3.550
   27    HB2  PHE   3           HB2      PHE   3   5.906   0.603  -5.737
   28    HB3  PHE   3           HB3      PHE   3   7.257   1.730  -5.798
   29    HD1  PHE   3           HD1      PHE   3   6.145  -1.535  -6.578
   30    HD2  PHE   3           HD2      PHE   3   9.619   0.709  -5.573
   31    HE1  PHE   3           HE1      PHE   3   7.560  -3.295  -7.554
   32    HE2  PHE   3           HE2      PHE   3  11.040  -1.047  -6.549
   33    HZ   PHE   3           HZ       PHE   3  10.011  -3.052  -7.542
   34    H    ASP   4           H        ASP   4   4.746   2.026  -3.683
   35    HA   ASP   4           HA       ASP   4   5.544   4.693  -3.595
   36    HB2  ASP   4           HB2      ASP   4   3.145   3.423  -3.679
   37    HB3  ASP   4           HB3      ASP   4   3.138   4.018  -2.021
   38    H    LYS   5           H        LYS   5   4.871   2.449  -0.927
   39    HA   LYS   5           HA       LYS   5   5.165   4.163   1.218
   40    HB2  LYS   5           HB2      LYS   5   5.970   1.261   0.970
   41    HB3  LYS   5           HB3      LYS   5   5.911   2.136   2.494
   42    HG2  LYS   5           HG2      LYS   5   3.568   1.689   0.656
   43    HG3  LYS   5           HG3      LYS   5   3.915   0.765   2.119
   44    HD2  LYS   5           HD2      LYS   5   3.377   3.732   1.995
   45    HD3  LYS   5           HD3      LYS   5   2.230   2.499   2.522
   46    HE2  LYS   5           HE2      LYS   5   4.852   3.217   3.829
   47    HE3  LYS   5           HE3      LYS   5   3.236   3.546   4.451
   48    HZ1  LYS   5           HZ1      LYS   5   4.178   1.628   5.537
   49    HZ2  LYS   5           HZ2      LYS   5   4.444   0.862   4.052
   50    HZ3  LYS   5           HZ3      LYS   5   2.864   1.145   4.586
   51    H    ILE   6           H        ILE   6   7.614   2.757  -0.836
   52    HA   ILE   6           HA       ILE   6   9.775   3.672   0.882
   53    HB   ILE   6           HB       ILE   6   9.858   2.302  -1.809
   54   HG12  ILE   6          HG12      ILE   6  10.867   0.476  -0.198
   55   HG13  ILE   6          HG13      ILE   6   9.953   1.348   1.027
   56   HG21  ILE   6          HG21      ILE   6  11.839   3.632  -1.528
   57   HG22  ILE   6          HG22      ILE   6  12.070   3.017   0.108
   58   HG23  ILE   6          HG23      ILE   6  12.254   1.937  -1.275
   59   HD11  ILE   6          HD11      ILE   6   8.840  -0.648  -0.084
   60   HD12  ILE   6          HD12      ILE   6   7.909   0.847   0.016
   61   HD13  ILE   6          HD13      ILE   6   8.674   0.384  -1.504
   62    H    ARG   7           H        ARG   7   8.257   4.495  -2.182
   63    HA   ARG   7           HA       ARG   7  10.070   6.256  -3.263
   64    HB2  ARG   7           HB2      ARG   7   7.249   5.730  -3.532
   65    HB3  ARG   7           HB3      ARG   7   7.552   7.460  -3.632
   66    HG2  ARG   7           HG2      ARG   7   7.679   6.724  -5.835
   67    HG3  ARG   7           HG3      ARG   7   9.365   6.860  -5.331
   68    HD2  ARG   7           HD2      ARG   7   9.694   4.606  -5.346
   69    HD3  ARG   7           HD3      ARG   7   8.021   4.250  -4.918
   70    HE   ARG   7           HE       ARG   7   7.580   4.028  -7.139
   71   HH11  ARG   7          HH11      ARG   7  10.414   6.017  -6.777
   72   HH12  ARG   7          HH12      ARG   7  10.706   6.139  -8.480
   73   HH21  ARG   7          HH21      ARG   7   7.954   4.181  -9.384
   74   HH22  ARG   7          HH22      ARG   7   9.305   5.096  -9.962
   75    H    GLN   8           H        GLN   8   7.509   7.019  -0.909
   76    HA   GLN   8           HA       GLN   8   7.969   9.728  -0.626
   77    HB2  GLN   8           HB2      GLN   8   6.779   9.617   1.411
   78    HB3  GLN   8           HB3      GLN   8   6.118   8.331   0.411
   79    HG2  GLN   8           HG2      GLN   8   7.472   6.694   1.602
   80    HG3  GLN   8           HG3      GLN   8   8.161   7.979   2.593
   81   HE21  GLN   8          HE21      GLN   8   6.075   9.487   3.285
   82   HE22  GLN   8          HE22      GLN   8   4.920   8.578   4.193
   83    H    VAL   9           H        VAL   9   9.842   7.051   0.538
   84    HA   VAL   9           HA       VAL   9  11.375   8.634   2.408
   85    HB   VAL   9           HB       VAL   9  11.082   5.823   1.808
   86   HG11  VAL   9          HG11      VAL   9  13.228   5.983   0.724
   87   HG12  VAL   9          HG12      VAL   9  13.899   6.860   2.100
   88   HG13  VAL   9          HG13      VAL   9  13.424   5.170   2.276
   89   HG21  VAL   9          HG21      VAL   9  11.832   5.588   4.113
   90   HG22  VAL   9          HG22      VAL   9  12.358   7.272   4.129
   91   HG23  VAL   9          HG23      VAL   9  10.644   6.885   3.977
   92    H    ILE  10           H        ILE  10  11.666   7.505  -0.889
   93    HA   ILE  10           HA       ILE  10  14.414   7.929  -1.268
   94    HB   ILE  10           HB       ILE  10  12.262   8.284  -3.354
   95   HG12  ILE  10          HG12      ILE  10  13.651   5.778  -2.385
   96   HG13  ILE  10          HG13      ILE  10  11.933   6.145  -2.266
   97   HG21  ILE  10          HG21      ILE  10  14.508   9.063  -3.984
   98   HG22  ILE  10          HG22      ILE  10  15.151   7.463  -3.616
   99   HG23  ILE  10          HG23      ILE  10  13.995   7.667  -4.932
  100   HD11  ILE  10          HD11      ILE  10  13.525   5.220  -4.579
  101   HD12  ILE  10          HD12      ILE  10  11.887   4.795  -4.079
  102   HD13  ILE  10          HD13      ILE  10  12.189   6.326  -4.900
  103    H    ARG  11           H        ARG  11  11.693  10.055  -2.177
  104    HA   ARG  11           HA       ARG  11  11.551  12.307  -2.461
  105    HB2  ARG  11           HB2      ARG  11  13.909  12.334  -0.567
  106    HB3  ARG  11           HB3      ARG  11  12.921  13.727  -0.987
  107    HG2  ARG  11           HG2      ARG  11  12.043  11.269   0.511
  108    HG3  ARG  11           HG3      ARG  11  12.242  12.900   1.155
  109    HD2  ARG  11           HD2      ARG  11  10.252  12.058  -0.951
  110    HD3  ARG  11           HD3      ARG  11   9.888  12.372   0.746
  111    HE   ARG  11           HE       ARG  11  10.312  14.320  -1.329
  112   HH11  ARG  11          HH11      ARG  11  10.358  13.716   2.099
  113   HH12  ARG  11          HH12      ARG  11  10.129  15.379   2.527
  114   HH21  ARG  11          HH21      ARG  11  10.011  16.513  -0.778
  115   HH22  ARG  11          HH22      ARG  11   9.931  16.969   0.890
  116    H    LYS  12           H        LYS  12  13.192  10.726  -4.273
  117    HA   LYS  12           HA       LYS  12  15.606  11.855  -4.990
  118    HB2  LYS  12           HB2      LYS  12  15.210  10.978  -7.228
  119    HB3  LYS  12           HB3      LYS  12  14.683   9.819  -6.015
  120    HG2  LYS  12           HG2      LYS  12  12.652  11.704  -7.059
  121    HG3  LYS  12           HG3      LYS  12  13.220  10.432  -8.143
  122    HD2  LYS  12           HD2      LYS  12  12.712   9.330  -5.547
  123    HD3  LYS  12           HD3      LYS  12  11.297  10.232  -6.095
  124    HE2  LYS  12           HE2      LYS  12  12.678   8.329  -7.944
  125    HE3  LYS  12           HE3      LYS  12  11.559   7.720  -6.725
  126    HZ1  LYS  12           HZ1      LYS  12  10.562   8.195  -8.950
  127    HZ2  LYS  12           HZ2      LYS  12  10.841   9.839  -8.670
  128    HZ3  LYS  12           HZ3      LYS  12   9.801   8.974  -7.655
  Start of MODEL    2
    1    H1   ARG   1           H        ARG   1   2.353  -0.242   1.478
    2    HA   ARG   1           HA       ARG   1   1.465  -0.884  -1.154
    3    HB2  ARG   1           HB2      ARG   1   2.320   1.864  -0.570
    4    HB3  ARG   1           HB3      ARG   1   3.164   1.123  -1.922
    5    HG2  ARG   1           HG2      ARG   1   0.189   0.975  -1.784
    6    HG3  ARG   1           HG3      ARG   1   0.973   2.462  -2.321
    7    HD2  ARG   1           HD2      ARG   1   1.894   1.450  -4.194
    8    HD3  ARG   1           HD3      ARG   1   1.757  -0.168  -3.508
    9    HE   ARG   1           HE       ARG   1  -0.327  -0.312  -4.419
   10   HH11  ARG   1          HH11      ARG   1   0.548   3.049  -4.179
   11   HH12  ARG   1          HH12      ARG   1  -0.866   3.611  -5.007
   12   HH21  ARG   1          HH21      ARG   1  -2.193   0.415  -5.510
   13   HH22  ARG   1          HH22      ARG   1  -2.425   2.112  -5.763
   14    H    LEU   2           H        LEU   2   3.255  -1.486  -2.577
   15    HA   LEU   2           HA       LEU   2   5.503  -2.510  -1.013
   16    HB2  LEU   2           HB2      LEU   2   5.878  -4.046  -2.800
   17    HB3  LEU   2           HB3      LEU   2   4.159  -4.053  -2.410
   18    HG   LEU   2           HG       LEU   2   5.042  -2.292  -4.628
   19   HD11  LEU   2          HD11      LEU   2   5.333  -3.972  -6.201
   20   HD12  LEU   2          HD12      LEU   2   4.624  -5.207  -5.162
   21   HD13  LEU   2          HD13      LEU   2   6.231  -4.573  -4.806
   22   HD21  LEU   2          HD21      LEU   2   2.634  -3.761  -3.745
   23   HD22  LEU   2          HD22      LEU   2   2.874  -3.611  -5.486
   24   HD23  LEU   2          HD23      LEU   2   2.788  -2.165  -4.480
   25    H    PHE   3           H        PHE   3   4.740  -0.128  -3.359
   26    HA   PHE   3           HA       PHE   3   7.611   0.405  -3.750
   27    HB2  PHE   3           HB2      PHE   3   5.321   0.589  -5.686
   28    HB3  PHE   3           HB3      PHE   3   6.770   1.562  -5.916
   29    HD1  PHE   3           HD1      PHE   3   5.279  -1.174  -7.143
   30    HD2  PHE   3           HD2      PHE   3   8.970  -0.102  -5.313
   31    HE1  PHE   3           HE1      PHE   3   6.375  -3.081  -8.245
   32    HE2  PHE   3           HE2      PHE   3  10.072  -2.006  -6.413
   33    HZ   PHE   3           HZ       PHE   3   8.775  -3.498  -7.882
   34    H    ASP   4           H        ASP   4   4.380   1.844  -3.545
   35    HA   ASP   4           HA       ASP   4   5.113   4.530  -3.517
   36    HB2  ASP   4           HB2      ASP   4   2.753   3.239  -3.419
   37    HB3  ASP   4           HB3      ASP   4   2.887   3.725  -1.731
   38    H    LYS   5           H        LYS   5   4.761   2.262  -0.809
   39    HA   LYS   5           HA       LYS   5   5.226   3.978   1.305
   40    HB2  LYS   5           HB2      LYS   5   6.073   1.097   0.971
   41    HB3  LYS   5           HB3      LYS   5   6.129   1.969   2.498
   42    HG2  LYS   5           HG2      LYS   5   3.641   1.464   0.877
   43    HG3  LYS   5           HG3      LYS   5   4.143   0.544   2.297
   44    HD2  LYS   5           HD2      LYS   5   3.526   3.499   2.241
   45    HD3  LYS   5           HD3      LYS   5   2.457   2.237   2.856
   46    HE2  LYS   5           HE2      LYS   5   4.280   1.622   4.470
   47    HE3  LYS   5           HE3      LYS   5   5.140   3.068   3.945
   48    HZ1  LYS   5           HZ1      LYS   5   2.626   3.953   4.532
   49    HZ2  LYS   5           HZ2      LYS   5   3.996   4.125   5.510
   50    HZ3  LYS   5           HZ3      LYS   5   2.942   2.824   5.753
   51    H    ILE   6           H        ILE   6   7.491   2.630  -0.985
   52    HA   ILE   6           HA       ILE   6   9.790   3.589   0.516
   53    HB   ILE   6           HB       ILE   6   9.638   2.226  -2.175
   54   HG12  ILE   6          HG12      ILE   6  10.838   0.418  -0.678
   55   HG13  ILE   6          HG13      ILE   6  10.031   1.269   0.634
   56   HG21  ILE   6          HG21      ILE   6  11.610   3.571  -2.117
   57   HG22  ILE   6          HG22      ILE   6  12.000   3.026  -0.487
   58   HG23  ILE   6          HG23      ILE   6  12.093   1.898  -1.839
   59   HD11  ILE   6          HD11      ILE   6   8.506   0.318  -1.756
   60   HD12  ILE   6          HD12      ILE   6   8.868  -0.757  -0.406
   61   HD13  ILE   6          HD13      ILE   6   7.917   0.703  -0.139
   62    H    ARG   7           H        ARG   7   7.957   4.388  -2.375
   63    HA   ARG   7           HA       ARG   7   9.615   6.186  -3.628
   64    HB2  ARG   7           HB2      ARG   7   6.795   5.602  -3.614
   65    HB3  ARG   7           HB3      ARG   7   7.046   7.339  -3.726
   66    HG2  ARG   7           HG2      ARG   7   6.955   6.603  -5.939
   67    HG3  ARG   7           HG3      ARG   7   8.676   6.817  -5.611
   68    HD2  ARG   7           HD2      ARG   7   9.081   4.543  -5.548
   69    HD3  ARG   7           HD3      ARG   7   7.405   4.152  -5.165
   70    HE   ARG   7           HE       ARG   7   6.921   4.138  -7.410
   71   HH11  ARG   7          HH11      ARG   7  10.058   5.560  -6.901
   72   HH12  ARG   7          HH12      ARG   7  10.464   5.585  -8.585
   73   HH21  ARG   7          HH21      ARG   7   7.444   4.166  -9.630
   74   HH22  ARG   7          HH22      ARG   7   8.976   4.793 -10.137
   75    H    GLN   8           H        GLN   8   7.296   6.894  -1.020
   76    HA   GLN   8           HA       GLN   8   7.730   9.610  -0.774
   77    HB2  GLN   8           HB2      GLN   8   6.760   9.471   1.377
   78    HB3  GLN   8           HB3      GLN   8   6.021   8.178   0.442
   79    HG2  GLN   8           HG2      GLN   8   7.517   6.559   1.475
   80    HG3  GLN   8           HG3      GLN   8   8.286   7.850   2.397
   81   HE21  GLN   8          HE21      GLN   8   7.697   6.588   4.262
   82   HE22  GLN   8          HE22      GLN   8   6.101   6.715   4.912
   83    H    VAL   9           H        VAL   9   9.766   6.968   0.175
   84    HA   VAL   9           HA       VAL   9  11.454   8.581   1.882
   85    HB   VAL   9           HB       VAL   9  11.148   5.764   1.318
   86   HG11  VAL   9          HG11      VAL   9  13.167   5.959   0.015
   87   HG12  VAL   9          HG12      VAL   9  13.963   6.847   1.316
   88   HG13  VAL   9          HG13      VAL   9  13.535   5.150   1.538
   89   HG21  VAL   9          HG21      VAL   9  12.649   7.223   3.491
   90   HG22  VAL   9          HG22      VAL   9  10.927   6.845   3.519
   91   HG23  VAL   9          HG23      VAL   9  12.116   5.543   3.534
   92    H    ILE  10           H        ILE  10  11.421   7.452  -1.427
   93    HA   ILE  10           HA       ILE  10  14.108   7.919  -2.089
   94    HB   ILE  10           HB       ILE  10  11.742   8.234  -3.936
   95   HG12  ILE  10          HG12      ILE  10  13.280   5.759  -3.128
   96   HG13  ILE  10          HG13      ILE  10  11.577   6.087  -2.828
   97   HG21  ILE  10          HG21      ILE  10  14.421   8.713  -4.381
   98   HG22  ILE  10          HG22      ILE  10  14.185   7.079  -5.001
   99   HG23  ILE  10          HG23      ILE  10  13.199   8.406  -5.616
  100   HD11  ILE  10          HD11      ILE  10  12.926   5.137  -5.263
  101   HD12  ILE  10          HD12      ILE  10  11.314   4.784  -4.638
  102   HD13  ILE  10          HD13      ILE  10  11.616   6.293  -5.500
  103    H    ARG  11           H        ARG  11  11.277   9.999  -2.733
  104    HA   ARG  11           HA       ARG  11  11.072  12.248  -3.002
  105    HB2  ARG  11           HB2      ARG  11  13.596  12.321  -1.338
  106    HB3  ARG  11           HB3      ARG  11  12.545  13.693  -1.660
  107    HG2  ARG  11           HG2      ARG  11  11.876  11.223  -0.079
  108    HG3  ARG  11           HG3      ARG  11  12.076  12.867   0.531
  109    HD2  ARG  11           HD2      ARG  11   9.913  11.871  -1.318
  110    HD3  ARG  11           HD3      ARG  11   9.725  12.342   0.371
  111    HE   ARG  11           HE       ARG  11  10.768  14.419  -1.332
  112   HH11  ARG  11          HH11      ARG  11   7.907  12.909  -0.045
  113   HH12  ARG  11          HH12      ARG  11   6.911  14.309  -0.265
  114   HH21  ARG  11          HH21      ARG  11   9.466  16.269  -1.628
  115   HH22  ARG  11          HH22      ARG  11   7.798  16.220  -1.167
  116    H    LYS  12           H        LYS  12  12.568  10.689  -4.957
  117    HA   LYS  12           HA       LYS  12  14.029  12.908  -6.202
  118    HB2  LYS  12           HB2      LYS  12  15.060  10.202  -5.554
  119    HB3  LYS  12           HB3      LYS  12  15.486  10.849  -7.133
  120    HG2  LYS  12           HG2      LYS  12  17.247  11.592  -5.890
  121    HG3  LYS  12           HG3      LYS  12  16.152  12.967  -5.735
  122    HD2  LYS  12           HD2      LYS  12  15.520  12.357  -3.558
  123    HD3  LYS  12           HD3      LYS  12  16.163  10.723  -3.737
  124    HE2  LYS  12           HE2      LYS  12  17.668  11.943  -2.347
  125    HE3  LYS  12           HE3      LYS  12  18.445  11.732  -3.915
  126    HZ1  LYS  12           HZ1      LYS  12  17.019  14.188  -3.045
  127    HZ2  LYS  12           HZ2      LYS  12  17.856  13.979  -4.500
  128    HZ3  LYS  12           HZ3      LYS  12  18.699  13.988  -3.033
  Start of MODEL    3
    1    H1   ARG   1           H        ARG   1   2.378  -0.267   1.603
    2    HA   ARG   1           HA       ARG   1   1.437  -0.809  -0.993
    3    HB2  ARG   1           HB2      ARG   1   2.273   1.945  -0.465
    4    HB3  ARG   1           HB3      ARG   1   3.138   1.203  -1.804
    5    HG2  ARG   1           HG2      ARG   1   0.143   1.174  -1.601
    6    HG3  ARG   1           HG3      ARG   1   1.038   2.479  -2.381
    7    HD2  ARG   1           HD2      ARG   1   2.147   0.651  -3.775
    8    HD3  ARG   1           HD3      ARG   1   0.882  -0.417  -3.167
    9    HE   ARG   1           HE       ARG   1  -0.331   1.877  -4.209
   10   HH11  ARG   1          HH11      ARG   1   1.496  -0.880  -5.297
   11   HH12  ARG   1          HH12      ARG   1   0.770  -0.905  -6.870
   12   HH21  ARG   1          HH21      ARG   1  -1.295   1.854  -6.276
   13   HH22  ARG   1          HH22      ARG   1  -0.817   0.651  -7.426
   14    H    LEU   2           H        LEU   2   3.184  -1.411  -2.479
   15    HA   LEU   2           HA       LEU   2   5.475  -2.443  -0.982
   16    HB2  LEU   2           HB2      LEU   2   5.805  -3.957  -2.818
   17    HB3  LEU   2           HB3      LEU   2   4.118  -4.005  -2.312
   18    HG   LEU   2           HG       LEU   2   4.770  -2.193  -4.559
   19   HD11  LEU   2          HD11      LEU   2   4.704  -5.185  -4.915
   20   HD12  LEU   2          HD12      LEU   2   6.145  -4.178  -5.050
   21   HD13  LEU   2          HD13      LEU   2   4.816  -3.972  -6.190
   22   HD21  LEU   2          HD21      LEU   2   2.643  -3.638  -5.308
   23   HD22  LEU   2          HD22      LEU   2   2.526  -2.213  -4.275
   24   HD23  LEU   2          HD23      LEU   2   2.519  -3.826  -3.559
   25    H    PHE   3           H        PHE   3   4.650  -0.059  -3.303
   26    HA   PHE   3           HA       PHE   3   7.510   0.466  -3.779
   27    HB2  PHE   3           HB2      PHE   3   5.164   0.694  -5.650
   28    HB3  PHE   3           HB3      PHE   3   6.645   1.605  -5.927
   29    HD1  PHE   3           HD1      PHE   3   4.964  -1.234  -6.855
   30    HD2  PHE   3           HD2      PHE   3   8.837   0.015  -5.608
   31    HE1  PHE   3           HE1      PHE   3   5.952  -3.191  -7.972
   32    HE2  PHE   3           HE2      PHE   3   9.831  -1.940  -6.723
   33    HZ   PHE   3           HZ       PHE   3   8.388  -3.546  -7.908
   34    H    ASP   4           H        ASP   4   4.290   1.919  -3.496
   35    HA   ASP   4           HA       ASP   4   5.038   4.601  -3.484
   36    HB2  ASP   4           HB2      ASP   4   2.673   3.347  -3.364
   37    HB3  ASP   4           HB3      ASP   4   2.839   3.774  -1.663
   38    H    LYS   5           H        LYS   5   4.724   2.335  -0.769
   39    HA   LYS   5           HA       LYS   5   5.238   4.044   1.337
   40    HB2  LYS   5           HB2      LYS   5   6.063   1.160   0.976
   41    HB3  LYS   5           HB3      LYS   5   6.170   2.026   2.503
   42    HG2  LYS   5           HG2      LYS   5   3.628   1.564   0.955
   43    HG3  LYS   5           HG3      LYS   5   4.168   0.609   2.338
   44    HD2  LYS   5           HD2      LYS   5   3.594   3.572   2.371
   45    HD3  LYS   5           HD3      LYS   5   2.516   2.314   2.979
   46    HE2  LYS   5           HE2      LYS   5   4.454   1.619   4.484
   47    HE3  LYS   5           HE3      LYS   5   5.201   3.153   4.040
   48    HZ1  LYS   5           HZ1      LYS   5   4.076   3.850   5.848
   49    HZ2  LYS   5           HZ2      LYS   5   2.907   2.632   5.750
   50    HZ3  LYS   5           HZ3      LYS   5   2.794   3.994   4.753
   51    H    ILE   6           H        ILE   6   7.454   2.700  -1.004
   52    HA   ILE   6           HA       ILE   6   9.785   3.647   0.455
   53    HB   ILE   6           HB       ILE   6   9.575   2.297  -2.239
   54   HG12  ILE   6          HG12      ILE   6  10.801   0.480  -0.777
   55   HG13  ILE   6          HG13      ILE   6  10.023   1.326   0.556
   56   HG21  ILE   6          HG21      ILE   6  11.598   3.272  -2.500
   57   HG22  ILE   6          HG22      ILE   6  11.836   3.495  -0.768
   58   HG23  ILE   6          HG23      ILE   6  12.124   1.917  -1.501
   59   HD11  ILE   6          HD11      ILE   6   8.455   0.378  -1.809
   60   HD12  ILE   6          HD12      ILE   6   8.831  -0.690  -0.456
   61   HD13  ILE   6          HD13      ILE   6   7.889   0.777  -0.188
   62    H    ARG   7           H        ARG   7   7.894   4.463  -2.395
   63    HA   ARG   7           HA       ARG   7   9.530   6.264  -3.673
   64    HB2  ARG   7           HB2      ARG   7   6.710   5.686  -3.604
   65    HB3  ARG   7           HB3      ARG   7   6.962   7.423  -3.712
   66    HG2  ARG   7           HG2      ARG   7   6.823   6.698  -5.926
   67    HG3  ARG   7           HG3      ARG   7   8.550   6.910  -5.633
   68    HD2  ARG   7           HD2      ARG   7   8.959   4.640  -5.603
   69    HD3  ARG   7           HD3      ARG   7   7.298   4.242  -5.165
   70    HE   ARG   7           HE       ARG   7   6.760   4.192  -7.390
   71   HH11  ARG   7          HH11      ARG   7   9.834   5.777  -6.992
   72   HH12  ARG   7          HH12      ARG   7  10.166   5.846  -8.691
   73   HH21  ARG   7          HH21      ARG   7   7.186   4.275  -9.629
   74   HH22  ARG   7          HH22      ARG   7   8.659   4.992 -10.190
   75    H    GLN   8           H        GLN   8   7.267   6.965  -1.014
   76    HA   GLN   8           HA       GLN   8   7.713   9.679  -0.765
   77    HB2  GLN   8           HB2      GLN   8   6.788   9.531   1.406
   78    HB3  GLN   8           HB3      GLN   8   6.027   8.244   0.480
   79    HG2  GLN   8           HG2      GLN   8   7.540   6.617   1.475
   80    HG3  GLN   8           HG3      GLN   8   8.332   7.902   2.385
   81   HE21  GLN   8          HE21      GLN   8   4.986   6.886   1.756
   82   HE22  GLN   8          HE22      GLN   8   4.487   6.916   3.409
   83    H    VAL   9           H        VAL   9   9.761   7.028   0.133
   84    HA   VAL   9           HA       VAL   9  11.488   8.629   1.810
   85    HB   VAL   9           HB       VAL   9  11.163   5.815   1.241
   86   HG11  VAL   9          HG11      VAL   9  13.979   6.893   1.184
   87   HG12  VAL   9          HG12      VAL   9  13.554   5.195   1.408
   88   HG13  VAL   9          HG13      VAL   9  13.156   6.013  -0.103
   89   HG21  VAL   9          HG21      VAL   9  12.205   5.588   3.432
   90   HG22  VAL   9          HG22      VAL   9  12.694   7.282   3.390
   91   HG23  VAL   9          HG23      VAL   9  10.983   6.860   3.451
   92    H    ILE  10           H        ILE  10  11.385   7.513  -1.502
   93    HA   ILE  10           HA       ILE  10  14.057   7.976  -2.218
   94    HB   ILE  10           HB       ILE  10  11.653   8.307  -4.012
   95   HG12  ILE  10          HG12      ILE  10  13.205   5.826  -3.252
   96   HG13  ILE  10          HG13      ILE  10  11.509   6.154  -2.914
   97   HG21  ILE  10          HG21      ILE  10  14.343   8.756  -4.501
   98   HG22  ILE  10          HG22      ILE  10  14.043   7.150  -5.163
   99   HG23  ILE  10          HG23      ILE  10  13.079   8.522  -5.709
  100   HD11  ILE  10          HD11      ILE  10  11.163   4.902  -4.734
  101   HD12  ILE  10          HD12      ILE  10  11.548   6.385  -5.607
  102   HD13  ILE  10          HD13      ILE  10  12.794   5.163  -5.351
  103    H    ARG  11           H        ARG  11  11.222  10.069  -2.795
  104    HA   ARG  11           HA       ARG  11  11.019  12.320  -3.047
  105    HB2  ARG  11           HB2      ARG  11  13.578  12.378  -1.436
  106    HB3  ARG  11           HB3      ARG  11  12.521  13.753  -1.727
  107    HG2  ARG  11           HG2      ARG  11  11.876  11.271  -0.154
  108    HG3  ARG  11           HG3      ARG  11  12.108  12.905   0.471
  109    HD2  ARG  11           HD2      ARG  11   9.906  12.004  -1.383
  110    HD3  ARG  11           HD3      ARG  11   9.738  12.339   0.340
  111    HE   ARG  11           HE       ARG  11   9.798  14.250  -1.787
  112   HH11  ARG  11          HH11      ARG  11  10.536  13.743   1.577
  113   HH12  ARG  11          HH12      ARG  11  10.390  15.417   1.997
  114   HH21  ARG  11          HH21      ARG  11   9.602  16.457  -1.247
  115   HH22  ARG  11          HH22      ARG  11   9.857  16.960   0.389
  116    H    LYS  12           H        LYS  12  12.509  10.746  -5.020
  117    HA   LYS  12           HA       LYS  12  13.948  12.971  -6.285
  118    HB2  LYS  12           HB2      LYS  12  14.965  10.256  -5.668
  119    HB3  LYS  12           HB3      LYS  12  15.354  10.890  -7.262
  120    HG2  LYS  12           HG2      LYS  12  17.159  11.616  -6.071
  121    HG3  LYS  12           HG3      LYS  12  16.085  13.006  -5.896
  122    HD2  LYS  12           HD2      LYS  12  15.503  12.417  -3.699
  123    HD3  LYS  12           HD3      LYS  12  16.124  10.775  -3.885
  124    HE2  LYS  12           HE2      LYS  12  18.362  11.506  -3.807
  125    HE3  LYS  12           HE3      LYS  12  17.905  13.189  -4.063
  126    HZ1  LYS  12           HZ1      LYS  12  18.440  12.947  -1.788
  127    HZ2  LYS  12           HZ2      LYS  12  17.491  11.557  -1.624
  128    HZ3  LYS  12           HZ3      LYS  12  16.753  13.060  -1.863
  Start of MODEL    4
    1    H1   ARG   1           H        ARG   1   2.074   0.475   1.438
    2    HA   ARG   1           HA       ARG   1   1.465  -0.722  -1.181
    3    HB2  ARG   1           HB2      ARG   1   2.337   1.958  -0.325
    4    HB3  ARG   1           HB3      ARG   1   3.181   1.326  -1.732
    5    HG2  ARG   1           HG2      ARG   1   0.196   1.255  -1.607
    6    HG3  ARG   1           HG3      ARG   1   1.043   2.735  -2.060
    7    HD2  ARG   1           HD2      ARG   1   2.320   0.979  -3.639
    8    HD3  ARG   1           HD3      ARG   1   0.751   0.185  -3.522
    9    HE   ARG   1           HE       ARG   1   0.545   2.970  -4.153
   10   HH11  ARG   1          HH11      ARG   1   1.083  -0.204  -5.477
   11   HH12  ARG   1          HH12      ARG   1   0.522   0.219  -7.060
   12   HH21  ARG   1          HH21      ARG   1  -0.197   3.539  -6.233
   13   HH22  ARG   1          HH22      ARG   1  -0.206   2.348  -7.490
   14    H    LEU   2           H        LEU   2   3.198  -1.426  -2.513
   15    HA   LEU   2           HA       LEU   2   5.469  -2.424  -0.968
   16    HB2  LEU   2           HB2      LEU   2   5.819  -3.982  -2.743
   17    HB3  LEU   2           HB3      LEU   2   4.107  -3.983  -2.327
   18    HG   LEU   2           HG       LEU   2   4.968  -2.256  -4.583
   19   HD11  LEU   2          HD11      LEU   2   5.149  -3.988  -6.146
   20   HD12  LEU   2          HD12      LEU   2   4.542  -5.195  -5.012
   21   HD13  LEU   2          HD13      LEU   2   6.150  -4.507  -4.790
   22   HD21  LEU   2          HD21      LEU   2   2.559  -3.718  -3.665
   23   HD22  LEU   2          HD22      LEU   2   2.774  -3.518  -5.404
   24   HD23  LEU   2          HD23      LEU   2   2.713  -2.102  -4.354
   25    H    PHE   3           H        PHE   3   4.682  -0.070  -3.333
   26    HA   PHE   3           HA       PHE   3   7.549   0.438  -3.786
   27    HB2  PHE   3           HB2      PHE   3   5.208   0.672  -5.659
   28    HB3  PHE   3           HB3      PHE   3   6.679   1.601  -5.930
   29    HD1  PHE   3           HD1      PHE   3   5.094  -1.044  -7.175
   30    HD2  PHE   3           HD2      PHE   3   8.825  -0.172  -5.321
   31    HE1  PHE   3           HE1      PHE   3   6.104  -2.983  -8.303
   32    HE2  PHE   3           HE2      PHE   3   9.841  -2.109  -6.447
   33    HZ   PHE   3           HZ       PHE   3   8.480  -3.518  -7.940
   34    H    ASP   4           H        ASP   4   4.343   1.919  -3.491
   35    HA   ASP   4           HA       ASP   4   5.126   4.595  -3.472
   36    HB2  ASP   4           HB2      ASP   4   2.744   3.369  -3.374
   37    HB3  ASP   4           HB3      ASP   4   2.903   3.790  -1.671
   38    H    LYS   5           H        LYS   5   4.851   2.281  -0.804
   39    HA   LYS   5           HA       LYS   5   5.330   3.970   1.336
   40    HB2  LYS   5           HB2      LYS   5   6.075   1.083   0.887
   41    HB3  LYS   5           HB3      LYS   5   6.363   1.902   2.417
   42    HG2  LYS   5           HG2      LYS   5   3.680   1.539   1.097
   43    HG3  LYS   5           HG3      LYS   5   4.299   0.605   2.461
   44    HD2  LYS   5           HD2      LYS   5   4.553   3.356   3.106
   45    HD3  LYS   5           HD3      LYS   5   2.921   3.097   2.484
   46    HE2  LYS   5           HE2      LYS   5   2.513   1.377   4.102
   47    HE3  LYS   5           HE3      LYS   5   4.195   1.407   4.630
   48    HZ1  LYS   5           HZ1      LYS   5   2.012   3.071   5.429
   49    HZ2  LYS   5           HZ2      LYS   5   3.350   3.980   4.939
   50    HZ3  LYS   5           HZ3      LYS   5   3.513   2.834   6.172
   51    H    ILE   6           H        ILE   6   7.558   2.676  -1.020
   52    HA   ILE   6           HA       ILE   6   9.880   3.619   0.454
   53    HB   ILE   6           HB       ILE   6   9.680   2.301  -2.256
   54   HG12  ILE   6          HG12      ILE   6  10.928   0.480  -0.817
   55   HG13  ILE   6          HG13      ILE   6  10.145   1.303   0.528
   56   HG21  ILE   6          HG21      ILE   6  12.257   1.983  -1.324
   57   HG22  ILE   6          HG22      ILE   6  11.734   3.103  -2.581
   58   HG23  ILE   6          HG23      ILE   6  11.870   3.653  -0.911
   59   HD11  ILE   6          HD11      ILE   6   8.598   0.340  -1.849
   60   HD12  ILE   6          HD12      ILE   6   8.959  -0.705  -0.475
   61   HD13  ILE   6          HD13      ILE   6   8.008   0.761  -0.242
   62    H    ARG   7           H        ARG   7   7.978   4.469  -2.375
   63    HA   ARG   7           HA       ARG   7   9.601   6.293  -3.635
   64    HB2  ARG   7           HB2      ARG   7   6.781   5.709  -3.555
   65    HB3  ARG   7           HB3      ARG   7   7.033   7.447  -3.649
   66    HG2  ARG   7           HG2      ARG   7   6.896   6.773  -5.868
   67    HG3  ARG   7           HG3      ARG   7   8.630   6.921  -5.578
   68    HD2  ARG   7           HD2      ARG   7   8.988   4.703  -5.799
   69    HD3  ARG   7           HD3      ARG   7   7.470   4.276  -5.010
   70    HE   ARG   7           HE       ARG   7   6.637   5.250  -7.373
   71   HH11  ARG   7          HH11      ARG   7   9.060   2.897  -6.526
   72   HH12  ARG   7          HH12      ARG   7   8.872   1.985  -7.986
   73   HH21  ARG   7          HH21      ARG   7   6.381   4.057  -9.301
   74   HH22  ARG   7          HH22      ARG   7   7.349   2.646  -9.565
   75    H    GLN   8           H        GLN   8   7.350   6.946  -0.954
   76    HA   GLN   8           HA       GLN   8   7.788   9.659  -0.667
   77    HB2  GLN   8           HB2      GLN   8   6.875   9.475   1.506
   78    HB3  GLN   8           HB3      GLN   8   6.113   8.200   0.565
   79    HG2  GLN   8           HG2      GLN   8   7.639   6.564   1.527
   80    HG3  GLN   8           HG3      GLN   8   8.428   7.838   2.455
   81   HE21  GLN   8          HE21      GLN   8   7.916   6.675   4.358
   82   HE22  GLN   8          HE22      GLN   8   6.326   6.731   5.031
   83    H    VAL   9           H        VAL   9   9.851   7.002   0.176
   84    HA   VAL   9           HA       VAL   9  11.581   8.584   1.870
   85    HB   VAL   9           HB       VAL   9  11.262   5.778   1.262
   86   HG11  VAL   9          HG11      VAL   9  13.655   5.162   1.405
   87   HG12  VAL   9          HG12      VAL   9  13.246   6.001  -0.093
   88   HG13  VAL   9          HG13      VAL   9  14.075   6.863   1.204
   89   HG21  VAL   9          HG21      VAL   9  12.306   5.519   3.444
   90   HG22  VAL   9          HG22      VAL   9  12.813   7.208   3.421
   91   HG23  VAL   9          HG23      VAL   9  11.098   6.803   3.488
   92    H    ILE  10           H        ILE  10  11.462   7.522  -1.458
   93    HA   ILE  10           HA       ILE  10  14.130   8.005  -2.180
   94    HB   ILE  10           HB       ILE  10  11.716   8.350  -3.960
   95   HG12  ILE  10          HG12      ILE  10  13.278   5.863  -3.238
   96   HG13  ILE  10          HG13      ILE  10  11.583   6.182  -2.888
   97   HG21  ILE  10          HG21      ILE  10  14.132   7.218  -5.110
   98   HG22  ILE  10          HG22      ILE  10  13.129   8.555  -5.673
   99   HG23  ILE  10          HG23      ILE  10  14.383   8.840  -4.466
  100   HD11  ILE  10          HD11      ILE  10  11.430   6.400  -5.501
  101   HD12  ILE  10          HD12      ILE  10  12.881   5.399  -5.437
  102   HD13  ILE  10          HD13      ILE  10  11.383   4.827  -4.704
  103    H    ARG  11           H        ARG  11  11.281  10.090  -2.715
  104    HA   ARG  11           HA       ARG  11  11.065  12.344  -2.936
  105    HB2  ARG  11           HB2      ARG  11  13.631  12.391  -1.336
  106    HB3  ARG  11           HB3      ARG  11  12.569  13.766  -1.604
  107    HG2  ARG  11           HG2      ARG  11  11.948  11.264  -0.055
  108    HG3  ARG  11           HG3      ARG  11  12.161  12.896   0.582
  109    HD2  ARG  11           HD2      ARG  11   9.951  11.931  -1.227
  110    HD3  ARG  11           HD3      ARG  11   9.807  12.369   0.474
  111    HE   ARG  11           HE       ARG  11  10.800  14.480  -1.217
  112   HH11  ARG  11          HH11      ARG  11   7.979  12.941   0.121
  113   HH12  ARG  11          HH12      ARG  11   6.974  14.343  -0.046
  114   HH21  ARG  11          HH21      ARG  11   9.488  16.333  -1.442
  115   HH22  ARG  11          HH22      ARG  11   7.834  16.271  -0.936
  116    H    LYS  12           H        LYS  12  12.517  10.823  -4.955
  117    HA   LYS  12           HA       LYS  12  13.944  13.067  -6.194
  118    HB2  LYS  12           HB2      LYS  12  14.988  10.348  -5.629
  119    HB3  LYS  12           HB3      LYS  12  15.374  11.028  -7.205
  120    HG2  LYS  12           HG2      LYS  12  17.165  11.760  -6.010
  121    HG3  LYS  12           HG3      LYS  12  16.065  13.117  -5.760
  122    HD2  LYS  12           HD2      LYS  12  15.545  12.446  -3.582
  123    HD3  LYS  12           HD3      LYS  12  16.137  10.804  -3.850
  124    HE2  LYS  12           HE2      LYS  12  17.766  11.854  -2.512
  125    HE3  LYS  12           HE3      LYS  12  18.435  11.836  -4.143
  126    HZ1  LYS  12           HZ1      LYS  12  18.784  13.997  -3.771
  127    HZ2  LYS  12           HZ2      LYS  12  17.685  14.074  -2.488
  128    HZ3  LYS  12           HZ3      LYS  12  17.132  14.190  -4.082
  Start of MODEL    5
    1    H1   ARG   1           H        ARG   1   0.868   0.920   0.479
    2    HA   ARG   1           HA       ARG   1   1.417  -0.453  -1.765
    3    HB2  ARG   1           HB2      ARG   1   2.284   2.177  -0.739
    4    HB3  ARG   1           HB3      ARG   1   3.238   1.537  -2.071
    5    HG2  ARG   1           HG2      ARG   1   0.256   1.596  -2.249
    6    HG3  ARG   1           HG3      ARG   1   1.204   3.049  -2.570
    7    HD2  ARG   1           HD2      ARG   1   2.554   1.225  -4.046
    8    HD3  ARG   1           HD3      ARG   1   0.915   0.582  -4.149
    9    HE   ARG   1           HE       ARG   1   0.778   3.310  -4.679
   10   HH11  ARG   1          HH11      ARG   1   2.175   0.445  -6.079
   11   HH12  ARG   1          HH12      ARG   1   2.090   1.039  -7.704
   12   HH21  ARG   1          HH21      ARG   1   0.660   4.103  -6.815
   13   HH22  ARG   1          HH22      ARG   1   1.228   3.120  -8.121
   14    H    LEU   2           H        LEU   2   3.277  -1.214  -2.862
   15    HA   LEU   2           HA       LEU   2   5.307  -2.281  -1.048
   16    HB2  LEU   2           HB2      LEU   2   5.818  -3.863  -2.760
   17    HB3  LEU   2           HB3      LEU   2   4.068  -3.805  -2.559
   18    HG   LEU   2           HG       LEU   2   5.237  -2.111  -4.693
   19   HD11  LEU   2          HD11      LEU   2   6.527  -4.014  -5.161
   20   HD12  LEU   2          HD12      LEU   2   5.124  -4.139  -6.222
   21   HD13  LEU   2          HD13      LEU   2   5.208  -5.113  -4.754
   22   HD21  LEU   2          HD21      LEU   2   2.714  -3.517  -4.064
   23   HD22  LEU   2          HD22      LEU   2   3.148  -3.394  -5.769
   24   HD23  LEU   2          HD23      LEU   2   2.982  -1.934  -4.793
   25    H    PHE   3           H        PHE   3   4.883   0.118  -3.440
   26    HA   PHE   3           HA       PHE   3   7.800   0.510  -3.581
   27    HB2  PHE   3           HB2      PHE   3   5.701   0.692  -5.695
   28    HB3  PHE   3           HB3      PHE   3   7.072   1.792  -5.784
   29    HD1  PHE   3           HD1      PHE   3   5.873  -1.474  -6.506
   30    HD2  PHE   3           HD2      PHE   3   9.412   0.759  -5.730
   31    HE1  PHE   3           HE1      PHE   3   7.217  -3.245  -7.559
   32    HE2  PHE   3           HE2      PHE   3  10.762  -1.008  -6.782
   33    HZ   PHE   3           HZ       PHE   3   9.665  -3.014  -7.698
   34    H    ASP   4           H        ASP   4   4.640   2.110  -3.612
   35    HA   ASP   4           HA       ASP   4   5.497   4.755  -3.491
   36    HB2  ASP   4           HB2      ASP   4   3.069   3.536  -3.538
   37    HB3  ASP   4           HB3      ASP   4   3.115   4.105  -1.872
   38    H    LYS   5           H        LYS   5   4.824   2.485  -0.844
   39    HA   LYS   5           HA       LYS   5   5.210   4.151   1.321
   40    HB2  LYS   5           HB2      LYS   5   5.944   1.237   1.003
   41    HB3  LYS   5           HB3      LYS   5   5.943   2.085   2.544
   42    HG2  LYS   5           HG2      LYS   5   3.541   1.745   0.761
   43    HG3  LYS   5           HG3      LYS   5   3.907   0.758   2.178
   44    HD2  LYS   5           HD2      LYS   5   3.457   3.743   2.187
   45    HD3  LYS   5           HD3      LYS   5   2.276   2.527   2.681
   46    HE2  LYS   5           HE2      LYS   5   3.122   2.934   4.732
   47    HE3  LYS   5           HE3      LYS   5   4.370   1.803   4.211
   48    HZ1  LYS   5           HZ1      LYS   5   4.815   4.315   5.098
   49    HZ2  LYS   5           HZ2      LYS   5   4.874   4.522   3.420
   50    HZ3  LYS   5           HZ3      LYS   5   5.900   3.406   4.170
   51    H    ILE   6           H        ILE   6   7.580   2.736  -0.817
   52    HA   ILE   6           HA       ILE   6   9.800   3.569   0.868
   53    HB   ILE   6           HB       ILE   6   9.789   2.254  -1.852
   54   HG12  ILE   6          HG12      ILE   6  10.797   0.374  -0.302
   55   HG13  ILE   6          HG13      ILE   6   9.929   1.240   0.961
   56   HG21  ILE   6          HG21      ILE   6  12.187   1.834  -1.398
   57   HG22  ILE   6          HG22      ILE   6  11.803   3.545  -1.579
   58   HG23  ILE   6          HG23      ILE   6  12.066   2.865   0.027
   59   HD11  ILE   6          HD11      ILE   6   8.749  -0.710  -0.163
   60   HD12  ILE   6          HD12      ILE   6   7.853   0.803  -0.016
   61   HD13  ILE   6          HD13      ILE   6   8.577   0.352  -1.560
   62    H    ARG   7           H        ARG   7   8.231   4.486  -2.144
   63    HA   ARG   7           HA       ARG   7  10.054   6.231  -3.230
   64    HB2  ARG   7           HB2      ARG   7   7.216   5.772  -3.442
   65    HB3  ARG   7           HB3      ARG   7   7.557   7.496  -3.519
   66    HG2  ARG   7           HG2      ARG   7   7.621   6.808  -5.736
   67    HG3  ARG   7           HG3      ARG   7   9.321   6.875  -5.267
   68    HD2  ARG   7           HD2      ARG   7   9.587   4.634  -5.414
   69    HD3  ARG   7           HD3      ARG   7   7.960   4.297  -4.826
   70    HE   ARG   7           HE       ARG   7   7.289   4.118  -6.993
   71   HH11  ARG   7          HH11      ARG   7  10.202   6.022  -6.897
   72   HH12  ARG   7          HH12      ARG   7  10.330   6.150  -8.620
   73   HH21  ARG   7          HH21      ARG   7   7.447   4.279  -9.263
   74   HH22  ARG   7          HH22      ARG   7   8.762   5.159  -9.965
   75    H    GLN   8           H        GLN   8   7.564   7.000  -0.803
   76    HA   GLN   8           HA       GLN   8   8.087   9.692  -0.477
   77    HB2  GLN   8           HB2      GLN   8   6.943   9.562   1.587
   78    HB3  GLN   8           HB3      GLN   8   6.232   8.311   0.577
   79    HG2  GLN   8           HG2      GLN   8   7.580   6.622   1.700
   80    HG3  GLN   8           HG3      GLN   8   8.319   7.871   2.701
   81   HE21  GLN   8          HE21      GLN   8   7.070   8.896   4.289
   82   HE22  GLN   8          HE22      GLN   8   5.613   8.189   4.889
   83    H    VAL   9           H        VAL   9   9.928   6.952   0.595
   84    HA   VAL   9           HA       VAL   9  11.538   8.466   2.457
   85    HB   VAL   9           HB       VAL   9  11.172   5.675   1.809
   86   HG11  VAL   9          HG11      VAL   9  13.295   5.815   0.674
   87   HG12  VAL   9          HG12      VAL   9  14.017   6.647   2.052
   88   HG13  VAL   9          HG13      VAL   9  13.510   4.964   2.203
   89   HG21  VAL   9          HG21      VAL   9  11.976   5.378   4.088
   90   HG22  VAL   9          HG22      VAL   9  12.534   7.051   4.125
   91   HG23  VAL   9          HG23      VAL   9  10.810   6.699   4.008
   92    H    ILE  10           H        ILE  10  11.738   7.383  -0.865
   93    HA   ILE  10           HA       ILE  10  14.480   7.761  -1.303
   94    HB   ILE  10           HB       ILE  10  12.286   8.212  -3.327
   95   HG12  ILE  10          HG12      ILE  10  13.647   5.655  -2.457
   96   HG13  ILE  10          HG13      ILE  10  11.943   6.055  -2.275
   97   HG21  ILE  10          HG21      ILE  10  14.525   8.960  -4.003
   98   HG22  ILE  10          HG22      ILE  10  15.153   7.346  -3.675
   99   HG23  ILE  10          HG23      ILE  10  13.970   7.587  -4.960
  100   HD11  ILE  10          HD11      ILE  10  13.442   5.165  -4.665
  101   HD12  ILE  10          HD12      ILE  10  11.819   4.744  -4.116
  102   HD13  ILE  10          HD13      ILE  10  12.109   6.294  -4.906
  103    H    ARG  11           H        ARG  11  11.787   9.971  -2.088
  104    HA   ARG  11           HA       ARG  11  11.693  12.231  -2.320
  105    HB2  ARG  11           HB2      ARG  11  14.093  12.150  -0.482
  106    HB3  ARG  11           HB3      ARG  11  13.145  13.583  -0.853
  107    HG2  ARG  11           HG2      ARG  11  12.226  11.129   0.623
  108    HG3  ARG  11           HG3      ARG  11  12.474  12.747   1.282
  109    HD2  ARG  11           HD2      ARG  11  10.400  11.913  -0.742
  110    HD3  ARG  11           HD3      ARG  11  10.114  12.359   0.940
  111    HE   ARG  11           HE       ARG  11  11.394  14.408  -0.631
  112   HH11  ARG  11          HH11      ARG  11   8.366  13.038   0.405
  113   HH12  ARG  11          HH12      ARG  11   7.468  14.497   0.147
  114   HH21  ARG  11          HH21      ARG  11  10.223  16.335  -0.975
  115   HH22  ARG  11          HH22      ARG  11   8.525  16.371  -0.640
  116    H    LYS  12           H        LYS  12  13.237  10.663  -4.218
  117    HA   LYS  12           HA       LYS  12  15.663  11.731  -4.973
  118    HB2  LYS  12           HB2      LYS  12  15.174  10.944  -7.223
  119    HB3  LYS  12           HB3      LYS  12  14.620   9.768  -6.038
  120    HG2  LYS  12           HG2      LYS  12  12.677  11.791  -7.011
  121    HG3  LYS  12           HG3      LYS  12  13.135  10.478  -8.097
  122    HD2  LYS  12           HD2      LYS  12  12.669   9.024  -5.928
  123    HD3  LYS  12           HD3      LYS  12  11.629  10.395  -5.535
  124    HE2  LYS  12           HE2      LYS  12  10.824  10.053  -8.022
  125    HE3  LYS  12           HE3      LYS  12  11.421   8.417  -7.752
  126    HZ1  LYS  12           HZ1      LYS  12   9.052   9.677  -6.755
  127    HZ2  LYS  12           HZ2      LYS  12   9.959   8.958  -5.521
  128    HZ3  LYS  12           HZ3      LYS  12   9.444   8.033  -6.840
  Start of MODEL    6
    1    H1   ARG   1           H        ARG   1   0.833  -0.260   1.022
    2    HA   ARG   1           HA       ARG   1   1.545  -0.839  -1.615
    3    HB2  ARG   1           HB2      ARG   1   2.094   1.405   0.269
    4    HB3  ARG   1           HB3      ARG   1   3.039   1.320  -1.211
    5    HG2  ARG   1           HG2      ARG   1   0.032   1.376  -1.078
    6    HG3  ARG   1           HG3      ARG   1   1.067   2.761  -1.428
    7    HD2  ARG   1           HD2      ARG   1   1.998   1.026  -3.253
    8    HD3  ARG   1           HD3      ARG   1   0.336   0.453  -3.122
    9    HE   ARG   1           HE       ARG   1   0.481   3.286  -3.444
   10   HH11  ARG   1          HH11      ARG   1   0.607   0.253  -5.148
   11   HH12  ARG   1          HH12      ARG   1   0.071   0.926  -6.651
   12   HH21  ARG   1          HH21      ARG   1  -0.225   4.184  -5.418
   13   HH22  ARG   1          HH22      ARG   1  -0.401   3.163  -6.804
   14    H    LEU   2           H        LEU   2   3.273  -1.753  -2.521
   15    HA   LEU   2           HA       LEU   2   5.504  -2.515  -0.788
   16    HB2  LEU   2           HB2      LEU   2   6.057  -4.151  -2.427
   17    HB3  LEU   2           HB3      LEU   2   4.322  -4.236  -2.131
   18    HG   LEU   2           HG       LEU   2   5.277  -2.612  -4.435
   19   HD11  LEU   2          HD11      LEU   2   6.580  -4.480  -4.909
   20   HD12  LEU   2          HD12      LEU   2   5.082  -4.788  -5.787
   21   HD13  LEU   2          HD13      LEU   2   5.387  -5.601  -4.252
   22   HD21  LEU   2          HD21      LEU   2   2.848  -4.123  -3.615
   23   HD22  LEU   2          HD22      LEU   2   3.175  -3.919  -5.336
   24   HD23  LEU   2          HD23      LEU   2   2.996  -2.504  -4.298
   25    H    PHE   3           H        PHE   3   4.702  -0.197  -3.095
   26    HA   PHE   3           HA       PHE   3   7.552   0.355  -3.604
   27    HB2  PHE   3           HB2      PHE   3   5.177   0.516  -5.422
   28    HB3  PHE   3           HB3      PHE   3   6.537   1.604  -5.678
   29    HD1  PHE   3           HD1      PHE   3   5.180  -1.513  -6.493
   30    HD2  PHE   3           HD2      PHE   3   8.892   0.418  -5.712
   31    HE1  PHE   3           HE1      PHE   3   6.358  -3.285  -7.727
   32    HE2  PHE   3           HE2      PHE   3  10.076  -1.351  -6.947
   33    HZ   PHE   3           HZ       PHE   3   8.809  -3.207  -7.955
   34    H    ASP   4           H        ASP   4   4.334   1.845  -3.351
   35    HA   ASP   4           HA       ASP   4   5.053   4.503  -3.243
   36    HB2  ASP   4           HB2      ASP   4   2.709   3.242  -3.067
   37    HB3  ASP   4           HB3      ASP   4   2.939   3.589  -1.355
   38    H    LYS   5           H        LYS   5   4.864   2.194  -0.550
   39    HA   LYS   5           HA       LYS   5   5.456   3.875   1.556
   40    HB2  LYS   5           HB2      LYS   5   6.338   1.012   1.144
   41    HB3  LYS   5           HB3      LYS   5   6.399   1.866   2.680
   42    HG2  LYS   5           HG2      LYS   5   3.931   1.185   1.096
   43    HG3  LYS   5           HG3      LYS   5   4.456   0.452   2.614
   44    HD2  LYS   5           HD2      LYS   5   3.044   1.957   3.526
   45    HD3  LYS   5           HD3      LYS   5   4.407   3.060   3.320
   46    HE2  LYS   5           HE2      LYS   5   3.218   3.195   0.874
   47    HE3  LYS   5           HE3      LYS   5   1.824   2.960   1.928
   48    HZ1  LYS   5           HZ1      LYS   5   3.667   4.894   2.955
   49    HZ2  LYS   5           HZ2      LYS   5   1.999   5.022   2.705
   50    HZ3  LYS   5           HZ3      LYS   5   3.071   5.327   1.432
   51    H    ILE   6           H        ILE   6   7.583   2.577  -0.891
   52    HA   ILE   6           HA       ILE   6   9.966   3.523   0.484
   53    HB   ILE   6           HB       ILE   6   9.653   2.201  -2.214
   54   HG12  ILE   6          HG12      ILE   6  10.958   0.381  -0.823
   55   HG13  ILE   6          HG13      ILE   6  10.230   1.207   0.550
   56   HG21  ILE   6          HG21      ILE   6  11.993   3.339  -0.785
   57   HG22  ILE   6          HG22      ILE   6  12.220   1.830  -1.669
   58   HG23  ILE   6          HG23      ILE   6  11.644   3.268  -2.513
   59   HD11  ILE   6          HD11      ILE   6   8.063   0.663  -0.132
   60   HD12  ILE   6          HD12      ILE   6   8.590   0.238  -1.761
   61   HD13  ILE   6          HD13      ILE   6   9.006  -0.804  -0.400
   62    H    ARG   7           H        ARG   7   7.964   4.352  -2.288
   63    HA   ARG   7           HA       ARG   7   9.537   6.184  -3.600
   64    HB2  ARG   7           HB2      ARG   7   6.725   5.577  -3.440
   65    HB3  ARG   7           HB3      ARG   7   6.959   7.316  -3.545
   66    HG2  ARG   7           HG2      ARG   7   6.757   6.615  -5.758
   67    HG3  ARG   7           HG3      ARG   7   8.493   6.818  -5.520
   68    HD2  ARG   7           HD2      ARG   7   8.892   4.543  -5.513
   69    HD3  ARG   7           HD3      ARG   7   7.240   4.152  -5.040
   70    HE   ARG   7           HE       ARG   7   6.637   4.152  -7.253
   71   HH11  ARG   7          HH11      ARG   7   9.774   5.620  -6.908
   72   HH12  ARG   7          HH12      ARG   7  10.077   5.680  -8.613
   73   HH21  ARG   7          HH21      ARG   7   7.024   4.225  -9.499
   74   HH22  ARG   7          HH22      ARG   7   8.512   4.887 -10.086
   75    H    GLN   8           H        GLN   8   7.356   6.830  -0.860
   76    HA   GLN   8           HA       GLN   8   7.779   9.547  -0.595
   77    HB2  GLN   8           HB2      GLN   8   6.925   9.365   1.601
   78    HB3  GLN   8           HB3      GLN   8   6.153   8.074   0.689
   79    HG2  GLN   8           HG2      GLN   8   7.724   6.463   1.619
   80    HG3  GLN   8           HG3      GLN   8   8.522   7.753   2.518
   81   HE21  GLN   8          HE21      GLN   8   7.905   6.046   4.200
   82   HE22  GLN   8          HE22      GLN   8   6.400   6.300   5.009
   83    H    VAL   9           H        VAL   9   9.887   6.911   0.200
   84    HA   VAL   9           HA       VAL   9  11.650   8.514   1.838
   85    HB   VAL   9           HB       VAL   9  11.339   5.704   1.249
   86   HG11  VAL   9          HG11      VAL   9  14.140   6.814   1.107
   87   HG12  VAL   9          HG12      VAL   9  13.741   5.109   1.325
   88   HG13  VAL   9          HG13      VAL   9  13.282   5.940  -0.162
   89   HG21  VAL   9          HG21      VAL   9  11.227   6.733   3.474
   90   HG22  VAL   9          HG22      VAL   9  12.447   5.461   3.402
   91   HG23  VAL   9          HG23      VAL   9  12.936   7.155   3.359
   92    H    ILE  10           H        ILE  10  11.449   7.434  -1.481
   93    HA   ILE  10           HA       ILE  10  14.091   7.939  -2.280
   94    HB   ILE  10           HB       ILE  10  11.626   8.258  -3.993
   95   HG12  ILE  10          HG12      ILE  10  13.226   5.785  -3.305
   96   HG13  ILE  10          HG13      ILE  10  11.539   6.094  -2.909
   97   HG21  ILE  10          HG21      ILE  10  14.285   8.751  -4.567
   98   HG22  ILE  10          HG22      ILE  10  14.004   7.137  -5.217
   99   HG23  ILE  10          HG23      ILE  10  12.993   8.485  -5.738
  100   HD11  ILE  10          HD11      ILE  10  11.251   4.765  -4.716
  101   HD12  ILE  10          HD12      ILE  10  11.366   6.318  -5.545
  102   HD13  ILE  10          HD13      ILE  10  12.771   5.256  -5.462
  103    H    ARG  11           H        ARG  11  11.210   9.998  -2.742
  104    HA   ARG  11           HA       ARG  11  10.969  12.249  -2.965
  105    HB2  ARG  11           HB2      ARG  11  13.577  12.324  -1.436
  106    HB3  ARG  11           HB3      ARG  11  12.497  13.689  -1.681
  107    HG2  ARG  11           HG2      ARG  11  11.938  11.189  -0.104
  108    HG3  ARG  11           HG3      ARG  11  12.153  12.826   0.519
  109    HD2  ARG  11           HD2      ARG  11   9.905  11.833  -1.227
  110    HD3  ARG  11           HD3      ARG  11   9.802  12.278   0.476
  111    HE   ARG  11           HE       ARG  11  10.732  14.391  -1.249
  112   HH11  ARG  11          HH11      ARG  11   7.960  12.832   0.167
  113   HH12  ARG  11          HH12      ARG  11   6.939  14.224   0.021
  114   HH21  ARG  11          HH21      ARG  11   9.397  16.230  -1.447
  115   HH22  ARG  11          HH22      ARG  11   7.757  16.156  -0.899
  116    H    LYS  12           H        LYS  12  12.379  10.732  -5.017
  117    HA   LYS  12           HA       LYS  12  13.764  12.982  -6.296
  118    HB2  LYS  12           HB2      LYS  12  14.824  10.269  -5.753
  119    HB3  LYS  12           HB3      LYS  12  15.145  10.921  -7.355
  120    HG2  LYS  12           HG2      LYS  12  16.990  11.651  -6.231
  121    HG3  LYS  12           HG3      LYS  12  15.913  13.030  -5.996
  122    HD2  LYS  12           HD2      LYS  12  15.447  12.434  -3.782
  123    HD3  LYS  12           HD3      LYS  12  16.022  10.781  -4.011
  124    HE2  LYS  12           HE2      LYS  12  18.279  11.467  -4.038
  125    HE3  LYS  12           HE3      LYS  12  17.842  13.164  -4.235
  126    HZ1  LYS  12           HZ1      LYS  12  18.557  12.276  -1.926
  127    HZ2  LYS  12           HZ2      LYS  12  16.966  11.711  -1.833
  128    HZ3  LYS  12           HZ3      LYS  12  17.266  13.364  -2.035
  Start of MODEL    7
    1    H1   ARG   1           H        ARG   1   1.692   0.963   0.749
    2    HA   ARG   1           HA       ARG   1   1.724  -0.683  -1.595
    3    HB2  ARG   1           HB2      ARG   1   2.067   2.129  -0.954
    4    HB3  ARG   1           HB3      ARG   1   3.248   1.587  -2.139
    5    HG2  ARG   1           HG2      ARG   1   0.335   0.979  -2.471
    6    HG3  ARG   1           HG3      ARG   1   1.016   2.527  -2.975
    7    HD2  ARG   1           HD2      ARG   1   2.283   1.580  -4.646
    8    HD3  ARG   1           HD3      ARG   1   2.343   0.007  -3.852
    9    HE   ARG   1           HE       ARG   1  -0.307   0.588  -4.612
   10   HH11  ARG   1          HH11      ARG   1   2.778  -0.272  -5.977
   11   HH12  ARG   1          HH12      ARG   1   2.093  -1.063  -7.358
   12   HH21  ARG   1          HH21      ARG   1  -1.221  -0.450  -6.426
   13   HH22  ARG   1          HH22      ARG   1  -0.182  -1.162  -7.613
   14    H    LEU   2           H        LEU   2   3.414  -1.667  -2.591
   15    HA   LEU   2           HA       LEU   2   5.799  -2.091  -1.015
   16    HB2  LEU   2           HB2      LEU   2   6.230  -3.899  -2.372
   17    HB3  LEU   2           HB3      LEU   2   4.470  -3.815  -2.416
   18    HG   LEU   2           HG       LEU   2   6.290  -2.734  -4.566
   19   HD11  LEU   2          HD11      LEU   2   4.583  -5.170  -4.846
   20   HD12  LEU   2          HD12      LEU   2   6.198  -5.292  -4.150
   21   HD13  LEU   2          HD13      LEU   2   5.989  -4.671  -5.787
   22   HD21  LEU   2          HD21      LEU   2   4.102  -2.830  -5.858
   23   HD22  LEU   2          HD22      LEU   2   4.257  -1.554  -4.650
   24   HD23  LEU   2          HD23      LEU   2   3.309  -2.998  -4.292
   25    H    PHE   3           H        PHE   3   4.910   0.315  -3.003
   26    HA   PHE   3           HA       PHE   3   7.689   0.850  -3.785
   27    HB2  PHE   3           HB2      PHE   3   5.244   0.954  -5.527
   28    HB3  PHE   3           HB3      PHE   3   6.632   1.981  -5.871
   29    HD1  PHE   3           HD1      PHE   3   5.131  -0.935  -6.803
   30    HD2  PHE   3           HD2      PHE   3   8.953   0.529  -5.637
   31    HE1  PHE   3           HE1      PHE   3   6.205  -2.798  -7.998
   32    HE2  PHE   3           HE2      PHE   3  10.034  -1.331  -6.832
   33    HZ   PHE   3           HZ       PHE   3   8.659  -2.998  -8.013
   34    H    ASP   4           H        ASP   4   4.451   2.345  -3.727
   35    HA   ASP   4           HA       ASP   4   5.221   4.991  -3.556
   36    HB2  ASP   4           HB2      ASP   4   2.813   3.506  -3.213
   37    HB3  ASP   4           HB3      ASP   4   2.945   4.641  -1.873
   38    H    LYS   5           H        LYS   5   4.640   2.718  -0.885
   39    HA   LYS   5           HA       LYS   5   5.096   4.430   1.246
   40    HB2  LYS   5           HB2      LYS   5   5.768   1.492   1.009
   41    HB3  LYS   5           HB3      LYS   5   5.727   2.389   2.521
   42    HG2  LYS   5           HG2      LYS   5   3.382   1.988   0.674
   43    HG3  LYS   5           HG3      LYS   5   3.691   1.076   2.154
   44    HD2  LYS   5           HD2      LYS   5   3.281   4.063   2.001
   45    HD3  LYS   5           HD3      LYS   5   2.053   2.891   2.483
   46    HE2  LYS   5           HE2      LYS   5   3.736   2.147   4.265
   47    HE3  LYS   5           HE3      LYS   5   4.590   3.646   3.902
   48    HZ1  LYS   5           HZ1      LYS   5   1.715   3.737   4.505
   49    HZ2  LYS   5           HZ2      LYS   5   2.899   4.921   4.744
   50    HZ3  LYS   5           HZ3      LYS   5   2.821   3.583   5.777
   51    H    ILE   6           H        ILE   6   7.351   2.993  -0.967
   52    HA   ILE   6           HA       ILE   6   9.651   3.681   0.676
   53    HB   ILE   6           HB       ILE   6   9.515   2.485  -2.094
   54   HG12  ILE   6          HG12      ILE   6  10.491   0.503  -0.651
   55   HG13  ILE   6          HG13      ILE   6   9.681   1.342   0.667
   56   HG21  ILE   6          HG21      ILE   6  11.630   3.250  -2.191
   57   HG22  ILE   6          HG22      ILE   6  11.747   3.456  -0.444
   58   HG23  ILE   6          HG23      ILE   6  11.972   1.861  -1.160
   59   HD11  ILE   6          HD11      ILE   6   8.244   0.614  -1.858
   60   HD12  ILE   6          HD12      ILE   6   8.407  -0.512  -0.510
   61   HD13  ILE   6          HD13      ILE   6   7.571   1.023  -0.281
   62    H    ARG   7           H        ARG   7   8.018   4.776  -2.239
   63    HA   ARG   7           HA       ARG   7   9.867   6.499  -3.318
   64    HB2  ARG   7           HB2      ARG   7   7.018   6.135  -3.465
   65    HB3  ARG   7           HB3      ARG   7   7.394   7.852  -3.451
   66    HG2  ARG   7           HG2      ARG   7   7.347   7.242  -5.711
   67    HG3  ARG   7           HG3      ARG   7   9.059   7.355  -5.297
   68    HD2  ARG   7           HD2      ARG   7   9.362   5.068  -5.361
   69    HD3  ARG   7           HD3      ARG   7   7.657   4.731  -5.061
   70    HE   ARG   7           HE       ARG   7   7.269   4.844  -7.318
   71   HH11  ARG   7          HH11      ARG   7  10.408   6.176  -6.618
   72   HH12  ARG   7          HH12      ARG   7  10.871   6.298  -8.283
   73   HH21  ARG   7          HH21      ARG   7   7.867   5.000  -9.513
   74   HH22  ARG   7          HH22      ARG   7   9.425   5.630  -9.929
   75    H    GLN   8           H        GLN   8   7.489   7.253  -0.776
   76    HA   GLN   8           HA       GLN   8   8.123   9.910  -0.360
   77    HB2  GLN   8           HB2      GLN   8   7.046   9.735   1.739
   78    HB3  GLN   8           HB3      GLN   8   6.248   8.564   0.697
   79    HG2  GLN   8           HG2      GLN   8   7.548   6.768   1.695
   80    HG3  GLN   8           HG3      GLN   8   8.384   7.933   2.721
   81   HE21  GLN   8          HE21      GLN   8   7.692   7.775   4.721
   82   HE22  GLN   8          HE22      GLN   8   6.053   7.562   5.222
   83    H    VAL   9           H        VAL   9   9.895   7.064   0.530
   84    HA   VAL   9           HA       VAL   9  11.617   8.437   2.402
   85    HB   VAL   9           HB       VAL   9  11.128   5.691   1.649
   86   HG11  VAL   9          HG11      VAL   9  13.220   5.802   0.457
   87   HG12  VAL   9          HG12      VAL   9  14.012   6.551   1.845
   88   HG13  VAL   9          HG13      VAL   9  13.449   4.882   1.943
   89   HG21  VAL   9          HG21      VAL   9  10.873   6.649   3.899
   90   HG22  VAL   9          HG22      VAL   9  11.965   5.264   3.889
   91   HG23  VAL   9          HG23      VAL   9  12.617   6.900   3.978
   92    H    ILE  10           H        ILE  10  11.661   7.512  -0.969
   93    HA   ILE  10           HA       ILE  10  14.405   7.806  -1.480
   94    HB   ILE  10           HB       ILE  10  12.168   8.412  -3.413
   95   HG12  ILE  10          HG12      ILE  10  13.456   5.775  -2.679
   96   HG13  ILE  10          HG13      ILE  10  11.772   6.229  -2.439
   97   HG21  ILE  10          HG21      ILE  10  14.418   9.102  -4.125
   98   HG22  ILE  10          HG22      ILE  10  14.986   7.450  -3.887
   99   HG23  ILE  10          HG23      ILE  10  13.776   7.797  -5.122
  100   HD11  ILE  10          HD11      ILE  10  13.184   5.398  -4.907
  101   HD12  ILE  10          HD12      ILE  10  11.574   4.978  -4.321
  102   HD13  ILE  10          HD13      ILE  10  11.861   6.556  -5.055
  103    H    ARG  11           H        ARG  11  11.766  10.131  -2.093
  104    HA   ARG  11           HA       ARG  11  11.740  12.401  -2.230
  105    HB2  ARG  11           HB2      ARG  11  14.201  12.176  -0.486
  106    HB3  ARG  11           HB3      ARG  11  13.276  13.646  -0.759
  107    HG2  ARG  11           HG2      ARG  11  12.342  11.151   0.639
  108    HG3  ARG  11           HG3      ARG  11  12.670  12.726   1.365
  109    HD2  ARG  11           HD2      ARG  11  10.519  12.124  -0.663
  110    HD3  ARG  11           HD3      ARG  11  10.270  12.351   1.068
  111    HE   ARG  11           HE       ARG  11  10.682  14.398  -0.910
  112   HH11  ARG  11          HH11      ARG  11  10.906  13.582   2.466
  113   HH12  ARG  11          HH12      ARG  11  10.803  15.225   3.005
  114   HH21  ARG  11          HH21      ARG  11  10.544  16.566  -0.214
  115   HH22  ARG  11          HH22      ARG  11  10.596  16.922   1.480
  116    H    LYS  12           H        LYS  12  13.170  10.859  -4.238
  117    HA   LYS  12           HA       LYS  12  15.604  11.889  -5.031
  118    HB2  LYS  12           HB2      LYS  12  15.010  11.204  -7.299
  119    HB3  LYS  12           HB3      LYS  12  14.509   9.988  -6.131
  120    HG2  LYS  12           HG2      LYS  12  12.506  12.032  -6.877
  121    HG3  LYS  12           HG3      LYS  12  12.936  10.837  -8.102
  122    HD2  LYS  12           HD2      LYS  12  12.550   9.561  -5.554
  123    HD3  LYS  12           HD3      LYS  12  11.138  10.534  -5.971
  124    HE2  LYS  12           HE2      LYS  12  10.738   8.400  -6.889
  125    HE3  LYS  12           HE3      LYS  12  11.215   9.421  -8.245
  126    HZ1  LYS  12           HZ1      LYS  12  13.551   8.514  -7.767
  127    HZ2  LYS  12           HZ2      LYS  12  12.446   7.505  -8.554
  128    HZ3  LYS  12           HZ3      LYS  12  12.757   7.295  -6.905
  Start of MODEL    8
    1    H1   ARG   1           H        ARG   1   2.474  -0.031   1.344
    2    HA   ARG   1           HA       ARG   1   1.733  -0.658  -1.300
    3    HB2  ARG   1           HB2      ARG   1   2.233   2.148  -0.755
    4    HB3  ARG   1           HB3      ARG   1   3.361   1.514  -1.946
    5    HG2  ARG   1           HG2      ARG   1   0.391   1.134  -2.168
    6    HG3  ARG   1           HG3      ARG   1   1.233   2.532  -2.839
    7    HD2  ARG   1           HD2      ARG   1   2.388   1.248  -4.393
    8    HD3  ARG   1           HD3      ARG   1   2.149  -0.243  -3.482
    9    HE   ARG   1           HE       ARG   1  -0.364   0.607  -4.242
   10   HH11  ARG   1          HH11      ARG   1   2.593  -0.340  -5.817
   11   HH12  ARG   1          HH12      ARG   1   1.797  -0.958  -7.227
   12   HH21  ARG   1          HH21      ARG   1  -1.423  -0.203  -6.094
   13   HH22  ARG   1          HH22      ARG   1  -0.487  -0.878  -7.384
   14    H    LEU   2           H        LEU   2   3.538  -1.297  -2.608
   15    HA   LEU   2           HA       LEU   2   5.864  -2.005  -0.984
   16    HB2  LEU   2           HB2      LEU   2   6.338  -3.673  -2.622
   17    HB3  LEU   2           HB3      LEU   2   4.626  -3.764  -2.216
   18    HG   LEU   2           HG       LEU   2   5.408  -2.178  -4.607
   19   HD11  LEU   2          HD11      LEU   2   5.933  -3.926  -5.953
   20   HD12  LEU   2          HD12      LEU   2   4.989  -5.081  -5.013
   21   HD13  LEU   2          HD13      LEU   2   6.575  -4.564  -4.439
   22   HD21  LEU   2          HD21      LEU   2   3.283  -3.573  -5.339
   23   HD22  LEU   2          HD22      LEU   2   3.141  -2.113  -4.360
   24   HD23  LEU   2          HD23      LEU   2   3.066  -3.700  -3.594
   25    H    PHE   3           H        PHE   3   4.993   0.432  -2.995
   26    HA   PHE   3           HA       PHE   3   7.789   0.932  -3.750
   27    HB2  PHE   3           HB2      PHE   3   5.343   1.149  -5.490
   28    HB3  PHE   3           HB3      PHE   3   6.799   2.077  -5.837
   29    HD1  PHE   3           HD1      PHE   3   5.134  -0.587  -6.967
   30    HD2  PHE   3           HD2      PHE   3   8.980   0.324  -5.388
   31    HE1  PHE   3           HE1      PHE   3   6.077  -2.523  -8.157
   32    HE2  PHE   3           HE2      PHE   3   9.930  -1.610  -6.575
   33    HZ   PHE   3           HZ       PHE   3   8.478  -3.036  -7.963
   34    H    ASP   4           H        ASP   4   4.562   2.405  -3.474
   35    HA   ASP   4           HA       ASP   4   5.367   5.069  -3.356
   36    HB2  ASP   4           HB2      ASP   4   2.952   3.566  -2.846
   37    HB3  ASP   4           HB3      ASP   4   3.141   4.851  -1.657
   38    H    LYS   5           H        LYS   5   4.811   2.774  -0.697
   39    HA   LYS   5           HA       LYS   5   5.339   4.454   1.442
   40    HB2  LYS   5           HB2      LYS   5   6.060   1.525   1.219
   41    HB3  LYS   5           HB3      LYS   5   5.874   2.434   2.714
   42    HG2  LYS   5           HG2      LYS   5   3.707   1.828   0.713
   43    HG3  LYS   5           HG3      LYS   5   3.917   1.079   2.297
   44    HD2  LYS   5           HD2      LYS   5   3.511   3.197   3.392
   45    HD3  LYS   5           HD3      LYS   5   3.425   4.020   1.833
   46    HE2  LYS   5           HE2      LYS   5   1.420   2.862   1.253
   47    HE3  LYS   5           HE3      LYS   5   1.568   1.791   2.646
   48    HZ1  LYS   5           HZ1      LYS   5  -0.052   3.749   2.780
   49    HZ2  LYS   5           HZ2      LYS   5   1.322   4.709   3.004
   50    HZ3  LYS   5           HZ3      LYS   5   0.967   3.472   4.102
   51    H    ILE   6           H        ILE   6   7.529   3.006  -0.832
   52    HA   ILE   6           HA       ILE   6   9.871   3.654   0.767
   53    HB   ILE   6           HB       ILE   6   9.663   2.478  -2.008
   54   HG12  ILE   6          HG12      ILE   6  10.639   0.473  -0.601
   55   HG13  ILE   6          HG13      ILE   6   9.873   1.315   0.742
   56   HG21  ILE   6          HG21      ILE   6  11.826   2.921  -2.227
   57   HG22  ILE   6          HG22      ILE   6  11.880   3.625  -0.612
   58   HG23  ILE   6          HG23      ILE   6  12.148   1.896  -0.828
   59   HD11  ILE   6          HD11      ILE   6   7.737   1.028  -0.154
   60   HD12  ILE   6          HD12      ILE   6   8.365   0.628  -1.753
   61   HD13  ILE   6          HD13      ILE   6   8.547  -0.515  -0.423
   62    H    ARG   7           H        ARG   7   8.190   4.789  -2.106
   63    HA   ARG   7           HA       ARG   7  10.037   6.496  -3.214
   64    HB2  ARG   7           HB2      ARG   7   7.184   6.164  -3.306
   65    HB3  ARG   7           HB3      ARG   7   7.576   7.878  -3.282
   66    HG2  ARG   7           HG2      ARG   7   7.472   7.281  -5.548
   67    HG3  ARG   7           HG3      ARG   7   9.192   7.395  -5.169
   68    HD2  ARG   7           HD2      ARG   7   9.498   5.108  -5.258
   69    HD3  ARG   7           HD3      ARG   7   7.801   4.765  -4.923
   70    HE   ARG   7           HE       ARG   7   7.362   4.896  -7.170
   71   HH11  ARG   7          HH11      ARG   7  10.515   6.227  -6.529
   72   HH12  ARG   7          HH12      ARG   7  10.941   6.363  -8.203
   73   HH21  ARG   7          HH21      ARG   7   7.912   5.069  -9.377
   74   HH22  ARG   7          HH22      ARG   7   9.460   5.705  -9.822
   75    H    GLN   8           H        GLN   8   7.724   7.262  -0.617
   76    HA   GLN   8           HA       GLN   8   8.400   9.908  -0.198
   77    HB2  GLN   8           HB2      GLN   8   7.365   9.733   1.921
   78    HB3  GLN   8           HB3      GLN   8   6.532   8.578   0.890
   79    HG2  GLN   8           HG2      GLN   8   7.832   6.761   1.851
   80    HG3  GLN   8           HG3      GLN   8   8.703   7.910   2.865
   81   HE21  GLN   8          HE21      GLN   8   7.932   6.561   4.617
   82   HE22  GLN   8          HE22      GLN   8   6.347   6.824   5.253
   83    H    VAL   9           H        VAL   9  10.156   7.036   0.634
   84    HA   VAL   9           HA       VAL   9  11.935   8.376   2.476
   85    HB   VAL   9           HB       VAL   9  11.395   5.640   1.719
   86   HG11  VAL   9          HG11      VAL   9  14.293   6.464   1.856
   87   HG12  VAL   9          HG12      VAL   9  13.712   4.800   1.957
   88   HG13  VAL   9          HG13      VAL   9  13.462   5.735   0.482
   89   HG21  VAL   9          HG21      VAL   9  12.314   5.196   3.937
   90   HG22  VAL   9          HG22      VAL   9  12.927   6.848   4.022
   91   HG23  VAL   9          HG23      VAL   9  11.189   6.553   3.979
   92    H    ILE  10           H        ILE  10  11.894   7.471  -0.900
   93    HA   ILE  10           HA       ILE  10  14.630   7.733  -1.468
   94    HB   ILE  10           HB       ILE  10  12.360   8.378  -3.350
   95   HG12  ILE  10          HG12      ILE  10  13.629   5.721  -2.658
   96   HG13  ILE  10          HG13      ILE  10  11.957   6.195  -2.379
   97   HG21  ILE  10          HG21      ILE  10  15.153   7.380  -3.892
   98   HG22  ILE  10          HG22      ILE  10  13.921   7.755  -5.096
   99   HG23  ILE  10          HG23      ILE  10  14.605   9.043  -4.104
  100   HD11  ILE  10          HD11      ILE  10  12.016   6.539  -5.003
  101   HD12  ILE  10          HD12      ILE  10  13.299   5.337  -4.870
  102   HD13  ILE  10          HD13      ILE  10  11.684   4.973  -4.263
  103    H    ARG  11           H        ARG  11  12.008  10.095  -2.012
  104    HA   ARG  11           HA       ARG  11  12.007  12.365  -2.136
  105    HB2  ARG  11           HB2      ARG  11  14.498  12.097  -0.443
  106    HB3  ARG  11           HB3      ARG  11  13.591  13.582  -0.692
  107    HG2  ARG  11           HG2      ARG  11  12.656  11.097   0.721
  108    HG3  ARG  11           HG3      ARG  11  13.004  12.672   1.437
  109    HD2  ARG  11           HD2      ARG  11  10.789  12.012  -0.499
  110    HD3  ARG  11           HD3      ARG  11  10.616  12.391   1.214
  111    HE   ARG  11           HE       ARG  11  11.888  14.459  -0.337
  112   HH11  ARG  11          HH11      ARG  11   8.871  13.161   0.816
  113   HH12  ARG  11          HH12      ARG  11   8.020  14.664   0.675
  114   HH21  ARG  11          HH21      ARG  11  10.780  16.444  -0.527
  115   HH22  ARG  11          HH22      ARG  11   9.107  16.530  -0.090
  116    H    LYS  12           H        LYS  12  13.385  10.811  -4.177
  117    HA   LYS  12           HA       LYS  12  15.811  11.817  -5.015
  118    HB2  LYS  12           HB2      LYS  12  15.175  11.141  -7.267
  119    HB3  LYS  12           HB3      LYS  12  14.650   9.936  -6.099
  120    HG2  LYS  12           HG2      LYS  12  12.717  12.050  -6.869
  121    HG3  LYS  12           HG3      LYS  12  13.079  10.785  -8.045
  122    HD2  LYS  12           HD2      LYS  12  12.653   9.167  -6.065
  123    HD3  LYS  12           HD3      LYS  12  11.835  10.548  -5.330
  124    HE2  LYS  12           HE2      LYS  12  10.188   9.257  -6.472
  125    HE3  LYS  12           HE3      LYS  12  10.454  10.727  -7.407
  126    HZ1  LYS  12           HZ1      LYS  12  12.040   8.374  -8.104
  127    HZ2  LYS  12           HZ2      LYS  12  11.415   9.589  -9.100
  128    HZ3  LYS  12           HZ3      LYS  12  10.402   8.361  -8.528
  Start of MODEL    9
    1    H1   ARG   1           H        ARG   1   1.443   0.424   0.831
    2    HA   ARG   1           HA       ARG   1   1.877  -1.164  -1.302
    3    HB2  ARG   1           HB2      ARG   1   2.104   1.688  -0.791
    4    HB3  ARG   1           HB3      ARG   1   3.213   1.162  -2.051
    5    HG2  ARG   1           HG2      ARG   1   0.306   0.429  -2.094
    6    HG3  ARG   1           HG3      ARG   1   0.903   1.947  -2.768
    7    HD2  ARG   1           HD2      ARG   1   2.616   0.249  -3.929
    8    HD3  ARG   1           HD3      ARG   1   1.235  -0.829  -3.735
    9    HE   ARG   1           HE       ARG   1   1.493   1.269  -5.624
   10   HH11  ARG   1          HH11      ARG   1  -0.825  -0.320  -3.569
   11   HH12  ARG   1          HH12      ARG   1  -2.179   0.064  -4.579
   12   HH21  ARG   1          HH21      ARG   1  -0.282   1.780  -6.962
   13   HH22  ARG   1          HH22      ARG   1  -1.869   1.258  -6.510
   14    H    LEU   2           H        LEU   2   3.550  -2.059  -2.416
   15    HA   LEU   2           HA       LEU   2   6.059  -2.315  -1.008
   16    HB2  LEU   2           HB2      LEU   2   6.502  -4.118  -2.367
   17    HB3  LEU   2           HB3      LEU   2   4.741  -4.137  -2.289
   18    HG   LEU   2           HG       LEU   2   6.339  -2.989  -4.576
   19   HD11  LEU   2          HD11      LEU   2   6.738  -5.320  -4.592
   20   HD12  LEU   2          HD12      LEU   2   5.469  -5.024  -5.780
   21   HD13  LEU   2          HD13      LEU   2   5.058  -5.684  -4.197
   22   HD21  LEU   2          HD21      LEU   2   3.402  -3.466  -4.128
   23   HD22  LEU   2          HD22      LEU   2   4.103  -3.188  -5.722
   24   HD23  LEU   2          HD23      LEU   2   4.216  -1.941  -4.479
   25    H    PHE   3           H        PHE   3   4.892  -0.004  -2.971
   26    HA   PHE   3           HA       PHE   3   7.576   0.680  -3.946
   27    HB2  PHE   3           HB2      PHE   3   5.015   0.625  -5.520
   28    HB3  PHE   3           HB3      PHE   3   6.333   1.698  -5.978
   29    HD1  PHE   3           HD1      PHE   3   4.901  -1.149  -6.963
   30    HD2  PHE   3           HD2      PHE   3   8.719   0.199  -5.651
   31    HE1  PHE   3           HE1      PHE   3   5.970  -2.995  -8.189
   32    HE2  PHE   3           HE2      PHE   3   9.794  -1.645  -6.875
   33    HZ   PHE   3           HZ       PHE   3   8.419  -3.246  -8.145
   34    H    ASP   4           H        ASP   4   4.265   1.984  -3.698
   35    HA   ASP   4           HA       ASP   4   4.886   4.673  -3.617
   36    HB2  ASP   4           HB2      ASP   4   2.602   3.033  -3.013
   37    HB3  ASP   4           HB3      ASP   4   2.750   4.306  -1.805
   38    H    LYS   5           H        LYS   5   4.610   2.422  -0.879
   39    HA   LYS   5           HA       LYS   5   5.105   4.202   1.189
   40    HB2  LYS   5           HB2      LYS   5   5.925   1.300   0.965
   41    HB3  LYS   5           HB3      LYS   5   5.917   2.226   2.459
   42    HG2  LYS   5           HG2      LYS   5   3.503   1.635   0.758
   43    HG3  LYS   5           HG3      LYS   5   3.944   0.801   2.250
   44    HD2  LYS   5           HD2      LYS   5   3.326   3.745   2.002
   45    HD3  LYS   5           HD3      LYS   5   2.224   2.515   2.626
   46    HE2  LYS   5           HE2      LYS   5   3.866   2.004   4.403
   47    HE3  LYS   5           HE3      LYS   5   4.885   3.311   3.803
   48    HZ1  LYS   5           HZ1      LYS   5   3.255   3.740   5.748
   49    HZ2  LYS   5           HZ2      LYS   5   2.090   3.866   4.529
   50    HZ3  LYS   5           HZ3      LYS   5   3.424   4.906   4.534
   51    H    ILE   6           H        ILE   6   7.287   2.848  -1.144
   52    HA   ILE   6           HA       ILE   6   9.648   3.682   0.337
   53    HB   ILE   6           HB       ILE   6   9.398   2.435  -2.403
   54   HG12  ILE   6          HG12      ILE   6  10.570   0.532  -1.003
   55   HG13  ILE   6          HG13      ILE   6   9.805   1.349   0.356
   56   HG21  ILE   6          HG21      ILE   6  11.645   3.635  -0.987
   57   HG22  ILE   6          HG22      ILE   6  11.952   1.980  -1.512
   58   HG23  ILE   6          HG23      ILE   6  11.477   3.204  -2.689
   59   HD11  ILE   6          HD11      ILE   6   7.657   0.904  -0.444
   60   HD12  ILE   6          HD12      ILE   6   8.247   0.501  -2.057
   61   HD13  ILE   6          HD13      ILE   6   8.557  -0.589  -0.707
   62    H    ARG   7           H        ARG   7   7.761   4.652  -2.464
   63    HA   ARG   7           HA       ARG   7   9.438   6.446  -3.698
   64    HB2  ARG   7           HB2      ARG   7   6.608   5.944  -3.626
   65    HB3  ARG   7           HB3      ARG   7   6.899   7.678  -3.656
   66    HG2  ARG   7           HG2      ARG   7   6.719   7.050  -5.900
   67    HG3  ARG   7           HG3      ARG   7   8.452   7.226  -5.617
   68    HD2  ARG   7           HD2      ARG   7   8.854   5.026  -5.910
   69    HD3  ARG   7           HD3      ARG   7   7.355   4.542  -5.119
   70    HE   ARG   7           HE       ARG   7   6.493   5.579  -7.455
   71   HH11  ARG   7          HH11      ARG   7   8.914   3.207  -6.663
   72   HH12  ARG   7          HH12      ARG   7   8.717   2.322  -8.140
   73   HH21  ARG   7          HH21      ARG   7   6.224   4.423  -9.403
   74   HH22  ARG   7          HH22      ARG   7   7.187   3.015  -9.698
   75    H    GLN   8           H        GLN   8   7.225   7.123  -0.991
   76    HA   GLN   8           HA       GLN   8   7.760   9.812  -0.653
   77    HB2  GLN   8           HB2      GLN   8   6.856   9.616   1.526
   78    HB3  GLN   8           HB3      GLN   8   6.036   8.398   0.557
   79    HG2  GLN   8           HG2      GLN   8   7.485   6.672   1.469
   80    HG3  GLN   8           HG3      GLN   8   8.348   7.884   2.414
   81   HE21  GLN   8          HE21      GLN   8   7.679   8.233   4.410
   82   HE22  GLN   8          HE22      GLN   8   6.151   7.761   5.063
   83    H    VAL   9           H        VAL   9   9.730   7.067   0.129
   84    HA   VAL   9           HA       VAL   9  11.521   8.551   1.846
   85    HB   VAL   9           HB       VAL   9  11.103   5.771   1.178
   86   HG11  VAL   9          HG11      VAL   9  13.091   5.952  -0.172
   87   HG12  VAL   9          HG12      VAL   9  13.951   6.763   1.139
   88   HG13  VAL   9          HG13      VAL   9  13.475   5.073   1.307
   89   HG21  VAL   9          HG21      VAL   9  12.716   7.083   3.364
   90   HG22  VAL   9          HG22      VAL   9  10.980   6.775   3.426
   91   HG23  VAL   9          HG23      VAL   9  12.113   5.426   3.355
   92    H    ILE  10           H        ILE  10  11.351   7.564  -1.503
   93    HA   ILE  10           HA       ILE  10  14.031   7.965  -2.229
   94    HB   ILE  10           HB       ILE  10  11.622   8.435  -3.986
   95   HG12  ILE  10          HG12      ILE  10  13.103   5.881  -3.330
   96   HG13  ILE  10          HG13      ILE  10  11.421   6.249  -2.965
   97   HG21  ILE  10          HG21      ILE  10  13.036   8.661  -5.691
   98   HG22  ILE  10          HG22      ILE  10  14.315   8.825  -4.489
   99   HG23  ILE  10          HG23      ILE  10  13.970   7.248  -5.199
  100   HD11  ILE  10          HD11      ILE  10  11.303   6.543  -5.589
  101   HD12  ILE  10          HD12      ILE  10  12.680   5.443  -5.519
  102   HD13  ILE  10          HD13      ILE  10  11.135   4.969  -4.812
  103    H    ARG  11           H        ARG  11  11.259  10.166  -2.698
  104    HA   ARG  11           HA       ARG  11  11.126  12.430  -2.867
  105    HB2  ARG  11           HB2      ARG  11  13.703  12.348  -1.287
  106    HB3  ARG  11           HB3      ARG  11  12.688  13.766  -1.516
  107    HG2  ARG  11           HG2      ARG  11  11.981  11.251  -0.024
  108    HG3  ARG  11           HG3      ARG  11  12.273  12.853   0.656
  109    HD2  ARG  11           HD2      ARG  11  10.022  12.091  -1.202
  110    HD3  ARG  11           HD3      ARG  11   9.885  12.366   0.534
  111    HE   ARG  11           HE       ARG  11  10.004  14.355  -1.525
  112   HH11  ARG  11          HH11      ARG  11  10.681  13.690   1.824
  113   HH12  ARG  11          HH12      ARG  11  10.573  15.349   2.311
  114   HH21  ARG  11          HH21      ARG  11   9.859  16.543  -0.898
  115   HH22  ARG  11          HH22      ARG  11  10.104  16.971   0.762
  116    H    LYS  12           H        LYS  12  12.541  10.881  -4.913
  117    HA   LYS  12           HA       LYS  12  14.030  13.105  -6.120
  118    HB2  LYS  12           HB2      LYS  12  14.982  10.347  -5.601
  119    HB3  LYS  12           HB3      LYS  12  15.371  11.020  -7.178
  120    HG2  LYS  12           HG2      LYS  12  17.208  11.646  -5.970
  121    HG3  LYS  12           HG3      LYS  12  16.183  13.070  -5.776
  122    HD2  LYS  12           HD2      LYS  12  15.548  12.432  -3.590
  123    HD3  LYS  12           HD3      LYS  12  16.192  10.802  -3.798
  124    HE2  LYS  12           HE2      LYS  12  18.466  11.855  -4.043
  125    HE3  LYS  12           HE3      LYS  12  17.731  13.379  -3.546
  126    HZ1  LYS  12           HZ1      LYS  12  16.907  11.631  -1.643
  127    HZ2  LYS  12           HZ2      LYS  12  18.197  12.713  -1.488
  128    HZ3  LYS  12           HZ3      LYS  12  18.487  11.114  -1.956
  Start of MODEL   10
    1    H1   ARG   1           H        ARG   1   2.189   0.040   1.308
    2    HA   ARG   1           HA       ARG   1   1.702  -0.755  -1.462
    3    HB2  ARG   1           HB2      ARG   1   2.087   1.990  -0.528
    4    HB3  ARG   1           HB3      ARG   1   3.233   1.520  -1.777
    5    HG2  ARG   1           HG2      ARG   1   0.288   1.069  -2.101
    6    HG3  ARG   1           HG3      ARG   1   1.046   2.610  -2.508
    7    HD2  ARG   1           HD2      ARG   1   2.113   1.761  -4.322
    8    HD3  ARG   1           HD3      ARG   1   2.327   0.173  -3.587
    9    HE   ARG   1           HE       ARG   1  -0.391   0.509  -4.092
   10   HH11  ARG   1          HH11      ARG   1   2.590   0.251  -5.873
   11   HH12  ARG   1          HH12      ARG   1   1.846  -0.455  -7.270
   12   HH21  ARG   1          HH21      ARG   1  -1.381  -0.420  -5.925
   13   HH22  ARG   1          HH22      ARG   1  -0.413  -0.835  -7.299
   14    H    LEU   2           H        LEU   2   3.516  -1.469  -2.552
   15    HA   LEU   2           HA       LEU   2   5.840  -1.992  -0.856
   16    HB2  LEU   2           HB2      LEU   2   6.280  -3.833  -2.150
   17    HB3  LEU   2           HB3      LEU   2   4.523  -3.749  -2.250
   18    HG   LEU   2           HG       LEU   2   6.412  -2.723  -4.366
   19   HD11  LEU   2          HD11      LEU   2   4.871  -5.303  -4.175
   20   HD12  LEU   2          HD12      LEU   2   6.620  -5.104  -4.271
   21   HD13  LEU   2          HD13      LEU   2   5.609  -4.694  -5.656
   22   HD21  LEU   2          HD21      LEU   2   3.434  -2.865  -4.103
   23   HD22  LEU   2          HD22      LEU   2   4.198  -2.916  -5.692
   24   HD23  LEU   2          HD23      LEU   2   4.447  -1.524  -4.637
   25    H    PHE   3           H        PHE   3   4.937   0.377  -2.866
   26    HA   PHE   3           HA       PHE   3   7.707   0.904  -3.688
   27    HB2  PHE   3           HB2      PHE   3   5.240   0.940  -5.385
   28    HB3  PHE   3           HB3      PHE   3   6.545   2.067  -5.739
   29    HD1  PHE   3           HD1      PHE   3   5.233  -0.864  -6.786
   30    HD2  PHE   3           HD2      PHE   3   8.967   0.709  -5.481
   31    HE1  PHE   3           HE1      PHE   3   6.409  -2.628  -8.035
   32    HE2  PHE   3           HE2      PHE   3  10.148  -1.051  -6.728
   33    HZ   PHE   3           HZ       PHE   3   8.870  -2.722  -8.008
   34    H    ASP   4           H        ASP   4   4.467   2.371  -3.465
   35    HA   ASP   4           HA       ASP   4   5.231   5.031  -3.358
   36    HB2  ASP   4           HB2      ASP   4   2.849   3.514  -2.844
   37    HB3  ASP   4           HB3      ASP   4   3.037   4.741  -1.594
   38    H    LYS   5           H        LYS   5   4.762   2.768  -0.655
   39    HA   LYS   5           HA       LYS   5   5.314   4.494   1.444
   40    HB2  LYS   5           HB2      LYS   5   6.066   1.570   1.281
   41    HB3  LYS   5           HB3      LYS   5   5.855   2.511   2.752
   42    HG2  LYS   5           HG2      LYS   5   3.695   1.880   0.750
   43    HG3  LYS   5           HG3      LYS   5   3.933   1.076   2.304
   44    HD2  LYS   5           HD2      LYS   5   3.437   3.083   3.499
   45    HD3  LYS   5           HD3      LYS   5   3.454   4.038   2.015
   46    HE2  LYS   5           HE2      LYS   5   1.243   3.740   1.968
   47    HE3  LYS   5           HE3      LYS   5   1.588   2.079   1.489
   48    HZ1  LYS   5           HZ1      LYS   5   0.062   2.496   3.492
   49    HZ2  LYS   5           HZ2      LYS   5   1.489   2.822   4.340
   50    HZ3  LYS   5           HZ3      LYS   5   1.257   1.306   3.627
   51    H    ILE   6           H        ILE   6   7.462   3.039  -0.857
   52    HA   ILE   6           HA       ILE   6   9.835   3.701   0.689
   53    HB   ILE   6           HB       ILE   6   9.572   2.515  -2.077
   54   HG12  ILE   6          HG12      ILE   6  10.589   0.520  -0.682
   55   HG13  ILE   6          HG13      ILE   6   9.843   1.362   0.671
   56   HG21  ILE   6          HG21      ILE   6  11.851   3.565  -0.605
   57   HG22  ILE   6          HG22      ILE   6  12.073   1.891  -1.111
   58   HG23  ILE   6          HG23      ILE   6  11.704   3.132  -2.309
   59   HD11  ILE   6          HD11      ILE   6   8.504  -0.478  -0.458
   60   HD12  ILE   6          HD12      ILE   6   7.692   1.065  -0.189
   61   HD13  ILE   6          HD13      ILE   6   8.296   0.654  -1.794
   62    H    ARG   7           H        ARG   7   8.107   4.805  -2.173
   63    HA   ARG   7           HA       ARG   7   9.928   6.525  -3.304
   64    HB2  ARG   7           HB2      ARG   7   7.072   6.170  -3.364
   65    HB3  ARG   7           HB3      ARG   7   7.460   7.885  -3.374
   66    HG2  ARG   7           HG2      ARG   7   7.350   7.275  -5.626
   67    HG3  ARG   7           HG3      ARG   7   9.075   7.346  -5.263
   68    HD2  ARG   7           HD2      ARG   7   9.315   5.049  -5.319
   69    HD3  ARG   7           HD3      ARG   7   7.608   4.760  -4.983
   70    HE   ARG   7           HE       ARG   7   7.166   4.908  -7.233
   71   HH11  ARG   7          HH11      ARG   7  10.393   6.050  -6.598
   72   HH12  ARG   7          HH12      ARG   7  10.834   6.131  -8.272
   73   HH21  ARG   7          HH21      ARG   7   7.734   5.012  -9.439
   74   HH22  ARG   7          HH22      ARG   7   9.320   5.541  -9.887
   75    H    GLN   8           H        GLN   8   7.623   7.283  -0.697
   76    HA   GLN   8           HA       GLN   8   8.274   9.939  -0.300
   77    HB2  GLN   8           HB2      GLN   8   7.251   9.769   1.824
   78    HB3  GLN   8           HB3      GLN   8   6.428   8.592   0.809
   79    HG2  GLN   8           HG2      GLN   8   7.763   6.803   1.779
   80    HG3  GLN   8           HG3      GLN   8   8.617   7.976   2.781
   81   HE21  GLN   8          HE21      GLN   8   5.323   6.902   2.025
   82   HE22  GLN   8          HE22      GLN   8   4.723   7.039   3.639
   83    H    VAL   9           H        VAL   9  10.064   7.090   0.542
   84    HA   VAL   9           HA       VAL   9  11.840   8.459   2.365
   85    HB   VAL   9           HB       VAL   9  11.325   5.714   1.625
   86   HG11  VAL   9          HG11      VAL   9  13.383   5.822   0.375
   87   HG12  VAL   9          HG12      VAL   9  14.215   6.568   1.741
   88   HG13  VAL   9          HG13      VAL   9  13.652   4.900   1.854
   89   HG21  VAL   9          HG21      VAL   9  11.145   6.697   3.883
   90   HG22  VAL   9          HG22      VAL   9  12.198   5.282   3.841
   91   HG23  VAL   9          HG23      VAL   9  12.897   6.899   3.911
   92    H    ILE  10           H        ILE  10  11.789   7.536  -1.007
   93    HA   ILE  10           HA       ILE  10  14.518   7.825  -1.592
   94    HB   ILE  10           HB       ILE  10  12.230   8.434  -3.463
   95   HG12  ILE  10          HG12      ILE  10  13.533   5.796  -2.764
   96   HG13  ILE  10          HG13      ILE  10  11.857   6.253  -2.480
   97   HG21  ILE  10          HG21      ILE  10  13.787   7.821  -5.216
   98   HG22  ILE  10          HG22      ILE  10  14.461   9.121  -4.235
   99   HG23  ILE  10          HG23      ILE  10  15.031   7.467  -4.018
  100   HD11  ILE  10          HD11      ILE  10  13.199   5.402  -4.976
  101   HD12  ILE  10          HD12      ILE  10  11.593   5.015  -4.357
  102   HD13  ILE  10          HD13      ILE  10  11.896   6.583  -5.105
  103    H    ARG  11           H        ARG  11  11.867  10.155  -2.132
  104    HA   ARG  11           HA       ARG  11  11.841  12.425  -2.268
  105    HB2  ARG  11           HB2      ARG  11  14.348  12.195  -0.592
  106    HB3  ARG  11           HB3      ARG  11  13.419  13.667  -0.840
  107    HG2  ARG  11           HG2      ARG  11  12.520  11.173   0.583
  108    HG3  ARG  11           HG3      ARG  11  12.870  12.747   1.300
  109    HD2  ARG  11           HD2      ARG  11  10.663  12.150  -0.668
  110    HD3  ARG  11           HD3      ARG  11  10.462  12.377   1.069
  111    HE   ARG  11           HE       ARG  11  10.830  14.425  -0.920
  112   HH11  ARG  11          HH11      ARG  11  11.120  13.605   2.451
  113   HH12  ARG  11          HH12      ARG  11  11.028  15.248   2.993
  114   HH21  ARG  11          HH21      ARG  11  10.708  16.592  -0.219
  115   HH22  ARG  11          HH22      ARG  11  10.793  16.946   1.473
  116    H    LYS  12           H        LYS  12  13.218  10.876  -4.312
  117    HA   LYS  12           HA       LYS  12  15.628  11.908  -5.171
  118    HB2  LYS  12           HB2      LYS  12  14.984  11.210  -7.417
  119    HB3  LYS  12           HB3      LYS  12  14.495  10.003  -6.235
  120    HG2  LYS  12           HG2      LYS  12  12.504  12.067  -6.974
  121    HG3  LYS  12           HG3      LYS  12  12.890  10.831  -8.175
  122    HD2  LYS  12           HD2      LYS  12  12.563   9.550  -5.659
  123    HD3  LYS  12           HD3      LYS  12  11.190  10.632  -5.906
  124    HE2  LYS  12           HE2      LYS  12  10.640   8.488  -6.825
  125    HE3  LYS  12           HE3      LYS  12  10.878   9.619  -8.156
  126    HZ1  LYS  12           HZ1      LYS  12  12.778   7.546  -7.210
  127    HZ2  LYS  12           HZ2      LYS  12  13.173   8.731  -8.350
  128    HZ3  LYS  12           HZ3      LYS  12  11.970   7.593  -8.696
  Start of MODEL   11
    1    H1   ARG   1           H        ARG   1   2.075   0.036   1.064
    2    HA   ARG   1           HA       ARG   1   1.472  -0.326  -1.647
    3    HB2  ARG   1           HB2      ARG   1   2.363   2.359  -0.907
    4    HB3  ARG   1           HB3      ARG   1   3.368   1.616  -2.145
    5    HG2  ARG   1           HG2      ARG   1   0.381   1.672  -2.379
    6    HG3  ARG   1           HG3      ARG   1   1.381   3.030  -2.899
    7    HD2  ARG   1           HD2      ARG   1   1.317   1.890  -4.861
    8    HD3  ARG   1           HD3      ARG   1   2.696   1.070  -4.129
    9    HE   ARG   1           HE       ARG   1   1.434  -0.838  -3.953
   10   HH11  ARG   1          HH11      ARG   1  -0.639   1.862  -4.685
   11   HH12  ARG   1          HH12      ARG   1  -2.035   0.879  -4.978
   12   HH21  ARG   1          HH21      ARG   1  -0.397  -2.143  -4.336
   13   HH22  ARG   1          HH22      ARG   1  -1.897  -1.399  -4.778
   14    H    LEU   2           H        LEU   2   3.328  -1.035  -2.903
   15    HA   LEU   2           HA       LEU   2   5.378  -2.194  -1.169
   16    HB2  LEU   2           HB2      LEU   2   5.823  -3.727  -2.953
   17    HB3  LEU   2           HB3      LEU   2   4.084  -3.661  -2.676
   18    HG   LEU   2           HG       LEU   2   5.123  -1.884  -4.794
   19   HD11  LEU   2          HD11      LEU   2   6.487  -3.853  -5.189
   20   HD12  LEU   2          HD12      LEU   2   5.240  -3.707  -6.427
   21   HD13  LEU   2          HD13      LEU   2   5.054  -4.881  -5.124
   22   HD21  LEU   2          HD21      LEU   2   2.892  -1.809  -4.956
   23   HD22  LEU   2          HD22      LEU   2   2.679  -3.312  -4.058
   24   HD23  LEU   2          HD23      LEU   2   3.047  -3.360  -5.783
   25    H    PHE   3           H        PHE   3   4.950   0.215  -3.584
   26    HA   PHE   3           HA       PHE   3   7.869   0.598  -3.711
   27    HB2  PHE   3           HB2      PHE   3   5.768   0.878  -5.836
   28    HB3  PHE   3           HB3      PHE   3   7.255   1.816  -5.934
   29    HD1  PHE   3           HD1      PHE   3   5.714  -1.128  -6.934
   30    HD2  PHE   3           HD2      PHE   3   9.450   0.349  -5.526
   31    HE1  PHE   3           HE1      PHE   3   6.856  -3.056  -7.951
   32    HE2  PHE   3           HE2      PHE   3  10.597  -1.576  -6.541
   33    HZ   PHE   3           HZ       PHE   3   9.301  -3.281  -7.756
   34    H    ASP   4           H        ASP   4   4.718   2.222  -3.800
   35    HA   ASP   4           HA       ASP   4   5.614   4.859  -3.672
   36    HB2  ASP   4           HB2      ASP   4   3.174   3.693  -3.820
   37    HB3  ASP   4           HB3      ASP   4   3.162   4.231  -2.143
   38    H    LYS   5           H        LYS   5   4.921   2.557  -1.072
   39    HA   LYS   5           HA       LYS   5   5.203   4.227   1.120
   40    HB2  LYS   5           HB2      LYS   5   5.862   1.309   0.749
   41    HB3  LYS   5           HB3      LYS   5   6.008   2.113   2.307
   42    HG2  LYS   5           HG2      LYS   5   3.484   1.883   0.680
   43    HG3  LYS   5           HG3      LYS   5   3.894   0.915   2.098
   44    HD2  LYS   5           HD2      LYS   5   4.204   3.644   2.799
   45    HD3  LYS   5           HD3      LYS   5   2.649   3.476   1.982
   46    HE2  LYS   5           HE2      LYS   5   2.128   1.579   3.507
   47    HE3  LYS   5           HE3      LYS   5   3.625   1.919   4.374
   48    HZ1  LYS   5           HZ1      LYS   5   1.391   2.921   5.191
   49    HZ2  LYS   5           HZ2      LYS   5   1.666   4.075   3.987
   50    HZ3  LYS   5           HZ3      LYS   5   2.796   3.863   5.228
   51    H    ILE   6           H        ILE   6   7.646   2.819  -0.944
   52    HA   ILE   6           HA       ILE   6   9.807   3.670   0.806
   53    HB   ILE   6           HB       ILE   6   9.889   2.343  -1.906
   54   HG12  ILE   6          HG12      ILE   6  10.858   0.476  -0.317
   55   HG13  ILE   6          HG13      ILE   6   9.947   1.344   0.915
   56   HG21  ILE   6          HG21      ILE   6  11.956   3.580  -0.269
   57   HG22  ILE   6          HG22      ILE   6  12.309   1.903  -0.683
   58   HG23  ILE   6          HG23      ILE   6  11.997   3.079  -1.959
   59   HD11  ILE   6          HD11      ILE   6   8.811  -0.617  -0.232
   60   HD12  ILE   6          HD12      ILE   6   7.904   0.892  -0.125
   61   HD13  ILE   6          HD13      ILE   6   8.679   0.434  -1.642
   62    H    ARG   7           H        ARG   7   8.328   4.569  -2.255
   63    HA   ARG   7           HA       ARG   7  10.177   6.317  -3.293
   64    HB2  ARG   7           HB2      ARG   7   7.349   5.844  -3.590
   65    HB3  ARG   7           HB3      ARG   7   7.683   7.569  -3.660
   66    HG2  ARG   7           HG2      ARG   7   7.811   6.863  -5.874
   67    HG3  ARG   7           HG3      ARG   7   9.495   6.969  -5.357
   68    HD2  ARG   7           HD2      ARG   7   9.759   4.679  -5.297
   69    HD3  ARG   7           HD3      ARG   7   8.036   4.382  -5.077
   70    HE   ARG   7           HE       ARG   7   7.790   4.345  -7.350
   71   HH11  ARG   7          HH11      ARG   7  10.846   5.815  -6.561
   72   HH12  ARG   7          HH12      ARG   7  11.387   5.881  -8.206
   73   HH21  ARG   7          HH21      ARG   7   8.491   4.426  -9.519
   74   HH22  ARG   7          HH22      ARG   7  10.047   5.091  -9.887
   75    H    GLN   8           H        GLN   8   7.612   7.084  -0.945
   76    HA   GLN   8           HA       GLN   8   8.114   9.780  -0.614
   77    HB2  GLN   8           HB2      GLN   8   6.908   9.655   1.415
   78    HB3  GLN   8           HB3      GLN   8   6.232   8.398   0.387
   79    HG2  GLN   8           HG2      GLN   8   7.547   6.717   1.558
   80    HG3  GLN   8           HG3      GLN   8   8.255   7.971   2.575
   81   HE21  GLN   8          HE21      GLN   8   5.118   6.648   1.598
   82   HE22  GLN   8          HE22      GLN   8   4.357   6.852   3.135
   83    H    VAL   9           H        VAL   9   9.933   7.053   0.521
   84    HA   VAL   9           HA       VAL   9  11.478   8.579   2.427
   85    HB   VAL   9           HB       VAL   9  11.143   5.784   1.779
   86   HG11  VAL   9          HG11      VAL   9  13.299   5.928   0.710
   87   HG12  VAL   9          HG12      VAL   9  13.975   6.767   2.107
   88   HG13  VAL   9          HG13      VAL   9  13.470   5.083   2.248
   89   HG21  VAL   9          HG21      VAL   9  10.697   6.778   3.960
   90   HG22  VAL   9          HG22      VAL   9  11.912   5.506   4.088
   91   HG23  VAL   9          HG23      VAL   9  12.401   7.200   4.128
   92    H    ILE  10           H        ILE  10  11.777   7.498  -0.885
   93    HA   ILE  10           HA       ILE  10  14.533   7.883  -1.239
   94    HB   ILE  10           HB       ILE  10  12.402   8.314  -3.332
   95   HG12  ILE  10          HG12      ILE  10  13.742   5.766  -2.404
   96   HG13  ILE  10          HG13      ILE  10  12.031   6.160  -2.283
   97   HG21  ILE  10          HG21      ILE  10  15.279   7.448  -3.590
   98   HG22  ILE  10          HG22      ILE  10  14.135   7.692  -4.909
   99   HG23  ILE  10          HG23      ILE  10  14.664   9.064  -3.936
  100   HD11  ILE  10          HD11      ILE  10  12.296   6.386  -4.911
  101   HD12  ILE  10          HD12      ILE  10  13.612   5.251  -4.608
  102   HD13  ILE  10          HD13      ILE  10  11.967   4.845  -4.120
  103    H    ARG  11           H        ARG  11  11.855  10.073  -2.123
  104    HA   ARG  11           HA       ARG  11  11.755  12.332  -2.367
  105    HB2  ARG  11           HB2      ARG  11  14.101  12.280  -0.459
  106    HB3  ARG  11           HB3      ARG  11  13.145  13.700  -0.861
  107    HG2  ARG  11           HG2      ARG  11  12.209  11.235   0.589
  108    HG3  ARG  11           HG3      ARG  11  12.432  12.852   1.261
  109    HD2  ARG  11           HD2      ARG  11  10.444  12.080  -0.873
  110    HD3  ARG  11           HD3      ARG  11  10.072  12.371   0.826
  111    HE   ARG  11           HE       ARG  11  10.514  14.343  -1.212
  112   HH11  ARG  11          HH11      ARG  11  10.643  13.693   2.205
  113   HH12  ARG  11          HH12      ARG  11  10.470  15.356   2.661
  114   HH21  ARG  11          HH21      ARG  11  10.285  16.536  -0.626
  115   HH22  ARG  11          HH22      ARG  11  10.265  16.972   1.050
  116    H    LYS  12           H        LYS  12  13.419  10.730  -4.172
  117    HA   LYS  12           HA       LYS  12  15.839  11.879  -4.852
  118    HB2  LYS  12           HB2      LYS  12  15.667  10.775  -6.899
  119    HB3  LYS  12           HB3      LYS  12  14.630   9.821  -5.847
  120    HG2  LYS  12           HG2      LYS  12  13.697  11.931  -7.784
  121    HG3  LYS  12           HG3      LYS  12  13.617  10.185  -8.035
  122    HD2  LYS  12           HD2      LYS  12  12.269  10.136  -5.849
  123    HD3  LYS  12           HD3      LYS  12  12.095  11.877  -6.076
  124    HE2  LYS  12           HE2      LYS  12  10.174  10.802  -7.017
  125    HE3  LYS  12           HE3      LYS  12  11.161  11.423  -8.339
  126    HZ1  LYS  12           HZ1      LYS  12  10.208   9.005  -8.393
  127    HZ2  LYS  12           HZ2      LYS  12  11.577   8.656  -7.464
  128    HZ3  LYS  12           HZ3      LYS  12  11.751   9.337  -9.003
  Start of MODEL   12
    1    H1   ARG   1           H        ARG   1   2.230  -0.199   1.463
    2    HA   ARG   1           HA       ARG   1   1.332  -0.764  -1.160
    3    HB2  ARG   1           HB2      ARG   1   2.053   1.993  -0.585
    4    HB3  ARG   1           HB3      ARG   1   3.064   1.304  -1.848
    5    HG2  ARG   1           HG2      ARG   1   0.055   1.255  -1.871
    6    HG3  ARG   1           HG3      ARG   1   1.043   2.468  -2.687
    7    HD2  ARG   1           HD2      ARG   1   0.885   1.066  -4.439
    8    HD3  ARG   1           HD3      ARG   1   2.174   0.193  -3.612
    9    HE   ARG   1           HE       ARG   1  -0.135  -0.831  -2.569
   10   HH11  ARG   1          HH11      ARG   1   1.190  -0.480  -5.769
   11   HH12  ARG   1          HH12      ARG   1   0.403  -1.892  -6.392
   12   HH21  ARG   1          HH21      ARG   1  -1.177  -2.692  -3.377
   13   HH22  ARG   1          HH22      ARG   1  -0.944  -3.149  -5.030
   14    H    LEU   2           H        LEU   2   3.076  -1.412  -2.585
   15    HA   LEU   2           HA       LEU   2   5.380  -2.370  -1.059
   16    HB2  LEU   2           HB2      LEU   2   5.714  -3.957  -2.810
   17    HB3  LEU   2           HB3      LEU   2   4.008  -3.966  -2.368
   18    HG   LEU   2           HG       LEU   2   4.823  -2.274  -4.669
   19   HD11  LEU   2          HD11      LEU   2   5.740  -3.926  -5.829
   20   HD12  LEU   2          HD12      LEU   2   4.206  -4.790  -5.739
   21   HD13  LEU   2          HD13      LEU   2   5.447  -5.070  -4.519
   22   HD21  LEU   2          HD21      LEU   2   2.569  -2.126  -4.373
   23   HD22  LEU   2          HD22      LEU   2   2.435  -3.752  -3.702
   24   HD23  LEU   2          HD23      LEU   2   2.623  -3.528  -5.441
   25    H    PHE   3           H        PHE   3   4.532  -0.017  -3.379
   26    HA   PHE   3           HA       PHE   3   7.382   0.487  -3.928
   27    HB2  PHE   3           HB2      PHE   3   4.997   0.640  -5.741
   28    HB3  PHE   3           HB3      PHE   3   6.399   1.661  -6.045
   29    HD1  PHE   3           HD1      PHE   3   4.941  -1.108  -7.218
   30    HD2  PHE   3           HD2      PHE   3   8.679   0.061  -5.550
   31    HE1  PHE   3           HE1      PHE   3   6.041  -2.973  -8.385
   32    HE2  PHE   3           HE2      PHE   3   9.785  -1.803  -6.715
   33    HZ   PHE   3           HZ       PHE   3   8.466  -3.324  -8.134
   34    H    ASP   4           H        ASP   4   4.182   2.039  -3.781
   35    HA   ASP   4           HA       ASP   4   5.000   4.684  -3.702
   36    HB2  ASP   4           HB2      ASP   4   2.592   3.396  -3.546
   37    HB3  ASP   4           HB3      ASP   4   2.742   4.062  -1.922
   38    H    LYS   5           H        LYS   5   4.586   2.405  -1.016
   39    HA   LYS   5           HA       LYS   5   5.045   4.087   1.122
   40    HB2  LYS   5           HB2      LYS   5   5.759   1.192   0.692
   41    HB3  LYS   5           HB3      LYS   5   6.055   2.006   2.223
   42    HG2  LYS   5           HG2      LYS   5   3.371   1.700   0.890
   43    HG3  LYS   5           HG3      LYS   5   3.967   0.744   2.249
   44    HD2  LYS   5           HD2      LYS   5   4.278   3.476   2.926
   45    HD3  LYS   5           HD3      LYS   5   2.648   3.272   2.282
   46    HE2  LYS   5           HE2      LYS   5   2.272   1.425   3.851
   47    HE3  LYS   5           HE3      LYS   5   3.896   1.650   4.499
   48    HZ1  LYS   5           HZ1      LYS   5   3.260   3.888   5.183
   49    HZ2  LYS   5           HZ2      LYS   5   2.261   2.724   5.895
   50    HZ3  LYS   5           HZ3      LYS   5   1.694   3.641   4.592
   51    H    ILE   6           H        ILE   6   7.320   2.787  -1.181
   52    HA   ILE   6           HA       ILE   6   9.614   3.702   0.353
   53    HB   ILE   6           HB       ILE   6   9.468   2.413  -2.375
   54   HG12  ILE   6          HG12      ILE   6  10.662   0.564  -0.927
   55   HG13  ILE   6          HG13      ILE   6   9.858   1.381   0.409
   56   HG21  ILE   6          HG21      ILE   6  11.963   2.024  -1.843
   57   HG22  ILE   6          HG22      ILE   6  11.458   3.608  -2.429
   58   HG23  ILE   6          HG23      ILE   6  11.769   3.361  -0.711
   59   HD11  ILE   6          HD11      ILE   6   8.677  -0.606  -0.649
   60   HD12  ILE   6          HD12      ILE   6   7.734   0.865  -0.411
   61   HD13  ILE   6          HD13      ILE   6   8.353   0.464  -2.012
   62    H    ARG   7           H        ARG   7   7.728   4.636  -2.445
   63    HA   ARG   7           HA       ARG   7   9.381   6.428  -3.711
   64    HB2  ARG   7           HB2      ARG   7   6.530   5.959  -3.549
   65    HB3  ARG   7           HB3      ARG   7   6.874   7.678  -3.688
   66    HG2  ARG   7           HG2      ARG   7   6.615   6.913  -5.886
   67    HG3  ARG   7           HG3      ARG   7   8.357   7.075  -5.654
   68    HD2  ARG   7           HD2      ARG   7   7.480   4.451  -4.871
   69    HD3  ARG   7           HD3      ARG   7   6.943   4.811  -6.511
   70    HE   ARG   7           HE       ARG   7   9.633   4.346  -5.636
   71   HH11  ARG   7          HH11      ARG   7   7.653   5.930  -8.022
   72   HH12  ARG   7          HH12      ARG   7   8.900   5.961  -9.225
   73   HH21  ARG   7          HH21      ARG   7  11.282   4.380  -7.211
   74   HH22  ARG   7          HH22      ARG   7  10.963   5.078  -8.763
   75    H    GLN   8           H        GLN   8   7.202   7.115  -0.979
   76    HA   GLN   8           HA       GLN   8   7.737   9.807  -0.662
   77    HB2  GLN   8           HB2      GLN   8   6.867   9.619   1.534
   78    HB3  GLN   8           HB3      GLN   8   6.027   8.407   0.576
   79    HG2  GLN   8           HG2      GLN   8   7.465   6.670   1.470
   80    HG3  GLN   8           HG3      GLN   8   8.366   7.872   2.393
   81   HE21  GLN   8          HE21      GLN   8   7.432   8.798   4.208
   82   HE22  GLN   8          HE22      GLN   8   6.033   8.130   4.970
   83    H    VAL   9           H        VAL   9   9.721   7.069   0.105
   84    HA   VAL   9           HA       VAL   9  11.539   8.587   1.775
   85    HB   VAL   9           HB       VAL   9  11.085   5.790   1.209
   86   HG11  VAL   9          HG11      VAL   9  13.057   5.905  -0.173
   87   HG12  VAL   9          HG12      VAL   9  13.942   6.749   1.098
   88   HG13  VAL   9          HG13      VAL   9  13.450   5.071   1.330
   89   HG21  VAL   9          HG21      VAL   9  12.693   7.213   3.329
   90   HG22  VAL   9          HG22      VAL   9  10.980   6.805   3.424
   91   HG23  VAL   9          HG23      VAL   9  12.190   5.523   3.379
   92    H    ILE  10           H        ILE  10  11.303   7.513  -1.539
   93    HA   ILE  10           HA       ILE  10  13.971   7.822  -2.330
   94    HB   ILE  10           HB       ILE  10  11.506   8.317  -4.003
   95   HG12  ILE  10          HG12      ILE  10  13.059   5.791  -3.416
   96   HG13  ILE  10          HG13      ILE  10  11.371   6.116  -3.035
   97   HG21  ILE  10          HG21      ILE  10  12.918   7.842  -5.906
   98   HG22  ILE  10          HG22      ILE  10  13.605   9.171  -4.973
   99   HG23  ILE  10          HG23      ILE  10  14.298   7.554  -4.846
  100   HD11  ILE  10          HD11      ILE  10  10.893   6.218  -5.456
  101   HD12  ILE  10          HD12      ILE  10  12.567   5.760  -5.770
  102   HD13  ILE  10          HD13      ILE  10  11.493   4.648  -4.921
  103    H    ARG  11           H        ARG  11  11.276  10.120  -2.790
  104    HA   ARG  11           HA       ARG  11  11.226  12.385  -2.992
  105    HB2  ARG  11           HB2      ARG  11  13.780  12.183  -1.386
  106    HB3  ARG  11           HB3      ARG  11  12.896  13.674  -1.684
  107    HG2  ARG  11           HG2      ARG  11  11.902  11.277  -0.156
  108    HG3  ARG  11           HG3      ARG  11  12.391  12.833   0.518
  109    HD2  ARG  11           HD2      ARG  11  10.070  12.338  -1.343
  110    HD3  ARG  11           HD3      ARG  11   9.968  12.676   0.384
  111    HE   ARG  11           HE       ARG  11  10.320  14.575  -1.722
  112   HH11  ARG  11          HH11      ARG  11  11.005  13.918   1.627
  113   HH12  ARG  11          HH12      ARG  11  11.140  15.589   2.063
  114   HH21  ARG  11          HH21      ARG  11  10.495  16.779  -1.161
  115   HH22  ARG  11          HH22      ARG  11  10.848  17.216   0.476
  116    H    LYS  12           H        LYS  12  12.529  10.790  -5.046
  117    HA   LYS  12           HA       LYS  12  14.018  12.950  -6.332
  118    HB2  LYS  12           HB2      LYS  12  15.082  10.246  -5.679
  119    HB3  LYS  12           HB3      LYS  12  15.522  10.944  -7.232
  120    HG2  LYS  12           HG2      LYS  12  17.237  11.763  -6.019
  121    HG3  LYS  12           HG3      LYS  12  16.066  13.036  -5.667
  122    HD2  LYS  12           HD2      LYS  12  15.508  12.036  -3.568
  123    HD3  LYS  12           HD3      LYS  12  16.452  10.592  -3.944
  124    HE2  LYS  12           HE2      LYS  12  17.715  11.951  -2.426
  125    HE3  LYS  12           HE3      LYS  12  18.490  12.017  -4.008
  126    HZ1  LYS  12           HZ1      LYS  12  16.523  14.084  -3.383
  127    HZ2  LYS  12           HZ2      LYS  12  17.948  14.187  -4.287
  128    HZ3  LYS  12           HZ3      LYS  12  18.018  14.176  -2.597
  Start of MODEL   13
    1    H1   ARG   1           H        ARG   1   2.080   0.079   1.019
    2    HA   ARG   1           HA       ARG   1   1.396  -0.347  -1.683
    3    HB2  ARG   1           HB2      ARG   1   2.299   2.350  -0.955
    4    HB3  ARG   1           HB3      ARG   1   3.217   1.618  -2.264
    5    HG2  ARG   1           HG2      ARG   1   0.217   1.748  -2.262
    6    HG3  ARG   1           HG3      ARG   1   1.235   3.024  -2.933
    7    HD2  ARG   1           HD2      ARG   1   0.986   1.817  -4.829
    8    HD3  ARG   1           HD3      ARG   1   2.329   0.901  -4.147
    9    HE   ARG   1           HE       ARG   1  -0.028  -0.224  -3.184
   10   HH11  ARG   1          HH11      ARG   1   1.606   0.217  -6.227
   11   HH12  ARG   1          HH12      ARG   1   0.940  -1.215  -6.940
   12   HH21  ARG   1          HH21      ARG   1  -0.911  -2.111  -4.112
   13   HH22  ARG   1          HH22      ARG   1  -0.492  -2.538  -5.737
   14    H    LEU   2           H        LEU   2   3.263  -0.969  -2.997
   15    HA   LEU   2           HA       LEU   2   5.354  -2.126  -1.313
   16    HB2  LEU   2           HB2      LEU   2   5.632  -3.756  -2.903
   17    HB3  LEU   2           HB3      LEU   2   3.915  -3.393  -3.069
   18    HG   LEU   2           HG       LEU   2   6.075  -2.295  -4.866
   19   HD11  LEU   2          HD11      LEU   2   4.375  -4.745  -5.033
   20   HD12  LEU   2          HD12      LEU   2   6.082  -4.533  -5.421
   21   HD13  LEU   2          HD13      LEU   2   4.846  -3.895  -6.505
   22   HD21  LEU   2          HD21      LEU   2   3.847  -2.056  -6.280
   23   HD22  LEU   2          HD22      LEU   2   4.377  -0.806  -5.155
   24   HD23  LEU   2          HD23      LEU   2   3.132  -1.958  -4.671
   25    H    PHE   3           H        PHE   3   4.849   0.406  -3.540
   26    HA   PHE   3           HA       PHE   3   7.759   0.817  -3.746
   27    HB2  PHE   3           HB2      PHE   3   5.607   1.199  -5.809
   28    HB3  PHE   3           HB3      PHE   3   7.110   2.112  -5.899
   29    HD1  PHE   3           HD1      PHE   3   5.583  -0.485  -7.356
   30    HD2  PHE   3           HD2      PHE   3   9.189   0.316  -5.241
   31    HE1  PHE   3           HE1      PHE   3   6.663  -2.387  -8.483
   32    HE2  PHE   3           HE2      PHE   3  10.274  -1.584  -6.366
   33    HZ   PHE   3           HZ       PHE   3   9.012  -2.938  -7.990
   34    H    ASP   4           H        ASP   4   4.590   2.413  -3.729
   35    HA   ASP   4           HA       ASP   4   5.444   5.048  -3.491
   36    HB2  ASP   4           HB2      ASP   4   3.004   3.756  -3.510
   37    HB3  ASP   4           HB3      ASP   4   3.067   4.452  -1.893
   38    H    LYS   5           H        LYS   5   4.742   2.683  -0.935
   39    HA   LYS   5           HA       LYS   5   5.122   4.267   1.291
   40    HB2  LYS   5           HB2      LYS   5   5.857   1.363   0.888
   41    HB3  LYS   5           HB3      LYS   5   5.807   2.162   2.454
   42    HG2  LYS   5           HG2      LYS   5   3.466   1.842   0.587
   43    HG3  LYS   5           HG3      LYS   5   3.787   0.852   2.012
   44    HD2  LYS   5           HD2      LYS   5   3.309   3.833   2.010
   45    HD3  LYS   5           HD3      LYS   5   2.131   2.602   2.473
   46    HE2  LYS   5           HE2      LYS   5   3.776   1.848   4.223
   47    HE3  LYS   5           HE3      LYS   5   4.726   3.283   3.843
   48    HZ1  LYS   5           HZ1      LYS   5   2.567   4.540   4.300
   49    HZ2  LYS   5           HZ2      LYS   5   3.417   3.929   5.628
   50    HZ3  LYS   5           HZ3      LYS   5   2.042   3.123   5.061
   51    H    ILE   6           H        ILE   6   7.494   2.926  -0.886
   52    HA   ILE   6           HA       ILE   6   9.710   3.666   0.846
   53    HB   ILE   6           HB       ILE   6   9.705   2.470  -1.927
   54   HG12  ILE   6          HG12      ILE   6  10.694   0.519  -0.459
   55   HG13  ILE   6          HG13      ILE   6   9.834   1.337   0.841
   56   HG21  ILE   6          HG21      ILE   6  11.839   3.081  -2.031
   57   HG22  ILE   6          HG22      ILE   6  11.808   3.681  -0.373
   58   HG23  ILE   6          HG23      ILE   6  12.153   1.981  -0.689
   59   HD11  ILE   6          HD11      ILE   6   7.753   0.958  -0.149
   60   HD12  ILE   6          HD12      ILE   6   8.471   0.568  -1.713
   61   HD13  ILE   6          HD13      ILE   6   8.637  -0.553  -0.362
   62    H    ARG   7           H        ARG   7   8.131   4.754  -2.094
   63    HA   ARG   7           HA       ARG   7   9.968   6.512  -3.132
   64    HB2  ARG   7           HB2      ARG   7   7.125   6.115  -3.314
   65    HB3  ARG   7           HB3      ARG   7   7.482   7.837  -3.281
   66    HG2  ARG   7           HG2      ARG   7   7.483   7.278  -5.543
   67    HG3  ARG   7           HG3      ARG   7   9.192   7.343  -5.107
   68    HD2  ARG   7           HD2      ARG   7   9.495   5.158  -5.508
   69    HD3  ARG   7           HD3      ARG   7   7.976   4.712  -4.732
   70    HE   ARG   7           HE       ARG   7   7.163   5.810  -7.059
   71   HH11  ARG   7          HH11      ARG   7   9.495   3.344  -6.283
   72   HH12  ARG   7          HH12      ARG   7   9.275   2.485  -7.771
   73   HH21  ARG   7          HH21      ARG   7   6.865   4.688  -9.022
   74   HH22  ARG   7          HH22      ARG   7   7.780   3.251  -9.329
   75    H    GLN   8           H        GLN   8   7.556   7.209  -0.607
   76    HA   GLN   8           HA       GLN   8   8.148   9.870  -0.159
   77    HB2  GLN   8           HB2      GLN   8   7.061   9.657   1.933
   78    HB3  GLN   8           HB3      GLN   8   6.285   8.491   0.869
   79    HG2  GLN   8           HG2      GLN   8   7.605   6.697   1.852
   80    HG3  GLN   8           HG3      GLN   8   8.410   7.860   2.905
   81   HE21  GLN   8          HE21      GLN   8   7.478   6.137   4.413
   82   HE22  GLN   8          HE22      GLN   8   5.922   6.482   5.078
   83    H    VAL   9           H        VAL   9   9.963   7.046   0.703
   84    HA   VAL   9           HA       VAL   9  11.663   8.458   2.580
   85    HB   VAL   9           HB       VAL   9  11.163   5.694   1.910
   86   HG11  VAL   9          HG11      VAL   9  14.052   6.542   2.080
   87   HG12  VAL   9          HG12      VAL   9  13.479   4.879   2.223
   88   HG13  VAL   9          HG13      VAL   9  13.257   5.763   0.713
   89   HG21  VAL   9          HG21      VAL   9  10.928   6.749   4.131
   90   HG22  VAL   9          HG22      VAL   9  11.969   5.326   4.160
   91   HG23  VAL   9          HG23      VAL   9  12.680   6.939   4.201
   92    H    ILE  10           H        ILE  10  11.705   7.461  -0.767
   93    HA   ILE  10           HA       ILE  10  14.450   7.701  -1.286
   94    HB   ILE  10           HB       ILE  10  12.181   8.283  -3.193
   95   HG12  ILE  10          HG12      ILE  10  13.588   5.697  -2.502
   96   HG13  ILE  10          HG13      ILE  10  11.890   6.080  -2.238
   97   HG21  ILE  10          HG21      ILE  10  14.553   7.087  -4.321
   98   HG22  ILE  10          HG22      ILE  10  13.702   8.558  -4.791
   99   HG23  ILE  10          HG23      ILE  10  14.923   8.614  -3.520
  100   HD11  ILE  10          HD11      ILE  10  13.268   5.170  -4.655
  101   HD12  ILE  10          HD12      ILE  10  11.595   4.950  -4.143
  102   HD13  ILE  10          HD13      ILE  10  12.092   6.460  -4.907
  103    H    ARG  11           H        ARG  11  11.881  10.064  -2.044
  104    HA   ARG  11           HA       ARG  11  11.905  12.331  -2.223
  105    HB2  ARG  11           HB2      ARG  11  14.258  12.087  -0.339
  106    HB3  ARG  11           HB3      ARG  11  13.399  13.578  -0.703
  107    HG2  ARG  11           HG2      ARG  11  12.320  11.154   0.714
  108    HG3  ARG  11           HG3      ARG  11  12.629  12.751   1.398
  109    HD2  ARG  11           HD2      ARG  11  10.556  12.022  -0.665
  110    HD3  ARG  11           HD3      ARG  11  10.268  12.508   1.005
  111    HE   ARG  11           HE       ARG  11  11.682  14.457  -0.582
  112   HH11  ARG  11          HH11      ARG  11   8.575  13.282   0.458
  113   HH12  ARG  11          HH12      ARG  11   7.764  14.786   0.172
  114   HH21  ARG  11          HH21      ARG  11  10.627  16.443  -0.963
  115   HH22  ARG  11          HH22      ARG  11   8.932  16.583  -0.637
  116    H    LYS  12           H        LYS  12  13.736  10.528  -3.884
  117    HA   LYS  12           HA       LYS  12  15.337  10.720  -5.500
  118    HB2  LYS  12           HB2      LYS  12  13.530  12.936  -5.695
  119    HB3  LYS  12           HB3      LYS  12  15.137  13.465  -6.177
  120    HG2  LYS  12           HG2      LYS  12  14.304  12.741  -8.177
  121    HG3  LYS  12           HG3      LYS  12  15.101  11.273  -7.606
  122    HD2  LYS  12           HD2      LYS  12  12.738  10.817  -6.529
  123    HD3  LYS  12           HD3      LYS  12  12.197  11.911  -7.804
  124    HE2  LYS  12           HE2      LYS  12  13.404  10.464  -9.445
  125    HE3  LYS  12           HE3      LYS  12  13.717   9.329  -8.133
  126    HZ1  LYS  12           HZ1      LYS  12  11.581   8.640  -8.094
  127    HZ2  LYS  12           HZ2      LYS  12  11.613   9.138  -9.710
  128    HZ3  LYS  12           HZ3      LYS  12  10.949  10.148  -8.527
  Start of MODEL   14
    1    H1   ARG   1           H        ARG   1   1.989  -0.037   1.068
    2    HA   ARG   1           HA       ARG   1   1.634  -0.670  -1.729
    3    HB2  ARG   1           HB2      ARG   1   2.044   2.081  -0.791
    4    HB3  ARG   1           HB3      ARG   1   3.197   1.566  -2.015
    5    HG2  ARG   1           HG2      ARG   1   0.222   1.292  -2.342
    6    HG3  ARG   1           HG3      ARG   1   1.133   2.708  -2.870
    7    HD2  ARG   1           HD2      ARG   1   1.381   1.607  -4.802
    8    HD3  ARG   1           HD3      ARG   1   2.583   0.648  -3.939
    9    HE   ARG   1           HE       ARG   1   0.087  -0.505  -3.482
   10   HH11  ARG   1          HH11      ARG   1   2.267   0.064  -6.136
   11   HH12  ARG   1          HH12      ARG   1   1.751  -1.329  -7.028
   12   HH21  ARG   1          HH21      ARG   1  -0.601  -2.341  -4.647
   13   HH22  ARG   1          HH22      ARG   1   0.119  -2.695  -6.181
   14    H    LEU   2           H        LEU   2   3.487  -1.451  -2.684
   15    HA   LEU   2           HA       LEU   2   5.707  -1.961  -0.850
   16    HB2  LEU   2           HB2      LEU   2   6.191  -3.838  -2.075
   17    HB3  LEU   2           HB3      LEU   2   4.443  -3.733  -2.274
   18    HG   LEU   2           HG       LEU   2   6.463  -2.784  -4.305
   19   HD11  LEU   2          HD11      LEU   2   6.747  -5.001  -4.597
   20   HD12  LEU   2          HD12      LEU   2   5.225  -4.859  -5.475
   21   HD13  LEU   2          HD13      LEU   2   5.229  -5.414  -3.801
   22   HD21  LEU   2          HD21      LEU   2   4.525  -1.563  -4.694
   23   HD22  LEU   2          HD22      LEU   2   3.470  -2.894  -4.217
   24   HD23  LEU   2          HD23      LEU   2   4.336  -2.960  -5.753
   25    H    PHE   3           H        PHE   3   4.951   0.369  -2.966
   26    HA   PHE   3           HA       PHE   3   7.771   0.836  -3.648
   27    HB2  PHE   3           HB2      PHE   3   5.388   0.937  -5.471
   28    HB3  PHE   3           HB3      PHE   3   6.789   1.954  -5.787
   29    HD1  PHE   3           HD1      PHE   3   5.314  -0.936  -6.773
   30    HD2  PHE   3           HD2      PHE   3   9.092   0.465  -5.400
   31    HE1  PHE   3           HE1      PHE   3   6.420  -2.822  -7.902
   32    HE2  PHE   3           HE2      PHE   3  10.204  -1.418  -6.528
   33    HZ   PHE   3           HZ       PHE   3   8.868  -3.065  -7.780
   34    H    ASP   4           H        ASP   4   4.555   2.374  -3.650
   35    HA   ASP   4           HA       ASP   4   5.353   5.017  -3.551
   36    HB2  ASP   4           HB2      ASP   4   2.928   3.553  -3.128
   37    HB3  ASP   4           HB3      ASP   4   3.078   4.779  -1.872
   38    H    LYS   5           H        LYS   5   4.729   2.828  -0.818
   39    HA   LYS   5           HA       LYS   5   5.216   4.593   1.263
   40    HB2  LYS   5           HB2      LYS   5   5.934   1.656   1.193
   41    HB3  LYS   5           HB3      LYS   5   5.682   2.632   2.634
   42    HG2  LYS   5           HG2      LYS   5   3.594   1.967   0.568
   43    HG3  LYS   5           HG3      LYS   5   3.754   1.228   2.163
   44    HD2  LYS   5           HD2      LYS   5   3.261   3.310   3.245
   45    HD3  LYS   5           HD3      LYS   5   3.313   4.176   1.708
   46    HE2  LYS   5           HE2      LYS   5   1.120   3.849   1.544
   47    HE3  LYS   5           HE3      LYS   5   1.455   2.132   1.328
   48    HZ1  LYS   5           HZ1      LYS   5   1.203   1.763   3.650
   49    HZ2  LYS   5           HZ2      LYS   5  -0.144   2.647   3.137
   50    HZ3  LYS   5           HZ3      LYS   5   1.104   3.419   3.978
   51    H    ILE   6           H        ILE   6   7.444   3.050  -0.904
   52    HA   ILE   6           HA       ILE   6   9.755   3.732   0.725
   53    HB   ILE   6           HB       ILE   6   9.599   2.466  -2.013
   54   HG12  ILE   6          HG12      ILE   6  10.532   0.503  -0.517
   55   HG13  ILE   6          HG13      ILE   6   9.739   1.395   0.778
   56   HG21  ILE   6          HG21      ILE   6  11.944   2.945  -0.183
   57   HG22  ILE   6          HG22      ILE   6  11.982   1.882  -1.589
   58   HG23  ILE   6          HG23      ILE   6  11.693   3.609  -1.797
   59   HD11  ILE   6          HD11      ILE   6   8.288   0.629  -1.728
   60   HD12  ILE   6          HD12      ILE   6   8.426  -0.463  -0.349
   61   HD13  ILE   6          HD13      ILE   6   7.623   1.096  -0.162
   62    H    ARG   7           H        ARG   7   8.141   4.792  -2.211
   63    HA   ARG   7           HA       ARG   7  10.025   6.443  -3.341
   64    HB2  ARG   7           HB2      ARG   7   7.165   6.150  -3.459
   65    HB3  ARG   7           HB3      ARG   7   7.590   7.855  -3.499
   66    HG2  ARG   7           HG2      ARG   7   7.536   7.225  -5.737
   67    HG3  ARG   7           HG3      ARG   7   9.253   7.210  -5.331
   68    HD2  ARG   7           HD2      ARG   7   9.428   5.005  -5.678
   69    HD3  ARG   7           HD3      ARG   7   7.917   4.664  -4.835
   70    HE   ARG   7           HE       ARG   7   6.905   4.513  -6.867
   71   HH11  ARG   7          HH11      ARG   7   9.781   6.443  -7.214
   72   HH12  ARG   7          HH12      ARG   7   9.620   6.609  -8.931
   73   HH21  ARG   7          HH21      ARG   7   6.682   4.724  -9.127
   74   HH22  ARG   7          HH22      ARG   7   7.856   5.631 -10.018
   75    H    GLN   8           H        GLN   8   7.682   7.317  -0.806
   76    HA   GLN   8           HA       GLN   8   8.383   9.966  -0.458
   77    HB2  GLN   8           HB2      GLN   8   7.315   9.869   1.650
   78    HB3  GLN   8           HB3      GLN   8   6.482   8.694   0.641
   79    HG2  GLN   8           HG2      GLN   8   7.743   6.890   1.675
   80    HG3  GLN   8           HG3      GLN   8   8.614   8.058   2.668
   81   HE21  GLN   8          HE21      GLN   8   5.406   6.786   1.958
   82   HE22  GLN   8          HE22      GLN   8   4.742   7.082   3.525
   83    H    VAL   9           H        VAL   9  10.089   7.100   0.495
   84    HA   VAL   9           HA       VAL   9  11.856   8.476   2.322
   85    HB   VAL   9           HB       VAL   9  11.294   5.725   1.641
   86   HG11  VAL   9          HG11      VAL   9  13.379   5.754   0.434
   87   HG12  VAL   9          HG12      VAL   9  14.200   6.516   1.798
   88   HG13  VAL   9          HG13      VAL   9  13.595   4.864   1.940
   89   HG21  VAL   9          HG21      VAL   9  12.141   5.334   3.885
   90   HG22  VAL   9          HG22      VAL   9  12.826   6.958   3.930
   91   HG23  VAL   9          HG23      VAL   9  11.077   6.741   3.869
   92    H    ILE  10           H        ILE  10  11.857   7.465  -1.025
   93    HA   ILE  10           HA       ILE  10  14.604   7.676  -1.558
   94    HB   ILE  10           HB       ILE  10  12.370   8.294  -3.492
   95   HG12  ILE  10          HG12      ILE  10  13.600   5.644  -2.708
   96   HG13  ILE  10          HG13      ILE  10  11.930   6.144  -2.464
   97   HG21  ILE  10          HG21      ILE  10  13.950   7.602  -5.196
   98   HG22  ILE  10          HG22      ILE  10  14.629   8.914  -4.235
   99   HG23  ILE  10          HG23      ILE  10  15.161   7.254  -3.963
  100   HD11  ILE  10          HD11      ILE  10  13.297   5.211  -4.917
  101   HD12  ILE  10          HD12      ILE  10  11.674   4.867  -4.317
  102   HD13  ILE  10          HD13      ILE  10  12.018   6.413  -5.092
  103    H    ARG  11           H        ARG  11  12.023  10.056  -2.213
  104    HA   ARG  11           HA       ARG  11  12.056  12.322  -2.403
  105    HB2  ARG  11           HB2      ARG  11  14.519  12.073  -0.667
  106    HB3  ARG  11           HB3      ARG  11  13.631  13.560  -0.970
  107    HG2  ARG  11           HG2      ARG  11  12.639  11.123   0.490
  108    HG3  ARG  11           HG3      ARG  11  13.015  12.704   1.179
  109    HD2  ARG  11           HD2      ARG  11  10.836  12.119  -0.824
  110    HD3  ARG  11           HD3      ARG  11  10.603  12.389   0.903
  111    HE   ARG  11           HE       ARG  11  11.068  14.383  -1.120
  112   HH11  ARG  11          HH11      ARG  11  11.259  13.629   2.273
  113   HH12  ARG  11          HH12      ARG  11  11.197  15.285   2.778
  114   HH21  ARG  11          HH21      ARG  11  10.986  16.567  -0.468
  115   HH22  ARG  11          HH22      ARG  11  11.040  16.955   1.218
  116    H    LYS  12           H        LYS  12  13.491  10.655  -4.347
  117    HA   LYS  12           HA       LYS  12  15.926  11.653  -5.175
  118    HB2  LYS  12           HB2      LYS  12  15.564  10.558  -7.173
  119    HB3  LYS  12           HB3      LYS  12  14.406   9.740  -6.131
  120    HG2  LYS  12           HG2      LYS  12  13.805  11.956  -8.079
  121    HG3  LYS  12           HG3      LYS  12  13.399  10.248  -8.264
  122    HD2  LYS  12           HD2      LYS  12  12.390  12.013  -6.035
  123    HD3  LYS  12           HD3      LYS  12  11.492  11.659  -7.513
  124    HE2  LYS  12           HE2      LYS  12  11.415   9.323  -6.975
  125    HE3  LYS  12           HE3      LYS  12  12.497   9.555  -5.603
  126    HZ1  LYS  12           HZ1      LYS  12  10.671   9.783  -4.387
  127    HZ2  LYS  12           HZ2      LYS  12   9.669   9.878  -5.746
  128    HZ3  LYS  12           HZ3      LYS  12  10.417  11.273  -5.147
  Start of MODEL   15
    1    H1   ARG   1           H        ARG   1   2.175   0.140   1.234
    2    HA   ARG   1           HA       ARG   1   1.558  -0.523  -1.520
    3    HB2  ARG   1           HB2      ARG   1   2.399   2.159  -0.668
    4    HB3  ARG   1           HB3      ARG   1   3.384   1.475  -1.954
    5    HG2  ARG   1           HG2      ARG   1   0.410   1.411  -2.179
    6    HG3  ARG   1           HG3      ARG   1   1.291   2.899  -2.530
    7    HD2  ARG   1           HD2      ARG   1   2.770   1.291  -3.991
    8    HD3  ARG   1           HD3      ARG   1   1.325   0.283  -3.957
    9    HE   ARG   1           HE       ARG   1   1.708   2.659  -5.469
   10   HH11  ARG   1          HH11      ARG   1  -0.692   0.824  -3.740
   11   HH12  ARG   1          HH12      ARG   1  -2.018   1.427  -4.677
   12   HH21  ARG   1          HH21      ARG   1  -0.030   3.461  -6.711
   13   HH22  ARG   1          HH22      ARG   1  -1.640   2.926  -6.368
   14    H    LEU   2           H        LEU   2   3.389  -1.273  -2.706
   15    HA   LEU   2           HA       LEU   2   5.479  -2.330  -0.962
   16    HB2  LEU   2           HB2      LEU   2   5.952  -3.894  -2.701
   17    HB3  LEU   2           HB3      LEU   2   4.207  -3.843  -2.456
   18    HG   LEU   2           HG       LEU   2   5.287  -2.109  -4.595
   19   HD11  LEU   2          HD11      LEU   2   5.513  -3.900  -6.181
   20   HD12  LEU   2          HD12      LEU   2   5.098  -5.095  -4.952
   21   HD13  LEU   2          HD13      LEU   2   6.607  -4.191  -4.829
   22   HD21  LEU   2          HD21      LEU   2   3.217  -3.512  -5.618
   23   HD22  LEU   2          HD22      LEU   2   3.041  -2.008  -4.715
   24   HD23  LEU   2          HD23      LEU   2   2.822  -3.557  -3.900
   25    H    PHE   3           H        PHE   3   4.987   0.030  -3.410
   26    HA   PHE   3           HA       PHE   3   7.896   0.477  -3.560
   27    HB2  PHE   3           HB2      PHE   3   5.786   0.579  -5.668
   28    HB3  PHE   3           HB3      PHE   3   7.135   1.704  -5.784
   29    HD1  PHE   3           HD1      PHE   3   5.999  -1.606  -6.423
   30    HD2  PHE   3           HD2      PHE   3   9.494   0.724  -5.734
   31    HE1  PHE   3           HE1      PHE   3   7.374  -3.371  -7.447
   32    HE2  PHE   3           HE2      PHE   3  10.874  -1.036  -6.757
   33    HZ   PHE   3           HZ       PHE   3   9.814  -3.087  -7.616
   34    H    ASP   4           H        ASP   4   4.710   2.025  -3.619
   35    HA   ASP   4           HA       ASP   4   5.540   4.685  -3.537
   36    HB2  ASP   4           HB2      ASP   4   3.142   3.540  -3.708
   37    HB3  ASP   4           HB3      ASP   4   3.122   3.898  -1.983
   38    H    LYS   5           H        LYS   5   4.952   2.401  -0.896
   39    HA   LYS   5           HA       LYS   5   5.240   4.104   1.269
   40    HB2  LYS   5           HB2      LYS   5   5.958   1.198   0.921
   41    HB3  LYS   5           HB3      LYS   5   6.118   2.024   2.465
   42    HG2  LYS   5           HG2      LYS   5   3.566   1.717   0.895
   43    HG3  LYS   5           HG3      LYS   5   4.028   0.777   2.316
   44    HD2  LYS   5           HD2      LYS   5   4.303   3.490   3.021
   45    HD3  LYS   5           HD3      LYS   5   2.760   3.344   2.176
   46    HE2  LYS   5           HE2      LYS   5   3.330   1.228   4.141
   47    HE3  LYS   5           HE3      LYS   5   3.116   2.843   4.815
   48    HZ1  LYS   5           HZ1      LYS   5   1.166   1.060   3.724
   49    HZ2  LYS   5           HZ2      LYS   5   1.082   2.593   3.016
   50    HZ3  LYS   5           HZ3      LYS   5   0.949   2.429   4.694
   51    H    ILE   6           H        ILE   6   7.674   2.721  -0.822
   52    HA   ILE   6           HA       ILE   6   9.848   3.648   0.872
   53    HB   ILE   6           HB       ILE   6   9.909   2.282  -1.820
   54   HG12  ILE   6          HG12      ILE   6  10.950   0.461  -0.222
   55   HG13  ILE   6          HG13      ILE   6  10.043   1.327   1.013
   56   HG21  ILE   6          HG21      ILE   6  12.362   1.902  -0.678
   57   HG22  ILE   6          HG22      ILE   6  11.990   3.101  -1.916
   58   HG23  ILE   6          HG23      ILE   6  11.987   3.561  -0.213
   59   HD11  ILE   6          HD11      ILE   6   8.930  -0.676  -0.083
   60   HD12  ILE   6          HD12      ILE   6   7.992   0.814   0.019
   61   HD13  ILE   6          HD13      ILE   6   8.747   0.350  -1.505
   62    H    ARG   7           H        ARG   7   8.295   4.461  -2.178
   63    HA   ARG   7           HA       ARG   7  10.084   6.237  -3.273
   64    HB2  ARG   7           HB2      ARG   7   7.264   5.691  -3.516
   65    HB3  ARG   7           HB3      ARG   7   7.556   7.422  -3.624
   66    HG2  ARG   7           HG2      ARG   7   7.670   6.683  -5.826
   67    HG3  ARG   7           HG3      ARG   7   9.359   6.825  -5.336
   68    HD2  ARG   7           HD2      ARG   7   9.655   4.535  -5.223
   69    HD3  ARG   7           HD3      ARG   7   7.934   4.221  -5.006
   70    HE   ARG   7           HE       ARG   7   7.673   4.216  -7.289
   71   HH11  ARG   7          HH11      ARG   7  10.809   5.488  -6.474
   72   HH12  ARG   7          HH12      ARG   7  11.382   5.479  -8.109
   73   HH21  ARG   7          HH21      ARG   7   8.415   4.199  -9.445
   74   HH22  ARG   7          HH22      ARG   7  10.019   4.747  -9.799
   75    H    GLN   8           H        GLN   8   7.537   6.978  -0.897
   76    HA   GLN   8           HA       GLN   8   7.976   9.691  -0.618
   77    HB2  GLN   8           HB2      GLN   8   6.801   9.570   1.428
   78    HB3  GLN   8           HB3      GLN   8   6.145   8.275   0.435
   79    HG2  GLN   8           HG2      GLN   8   7.526   6.654   1.616
   80    HG3  GLN   8           HG3      GLN   8   8.208   7.947   2.601
   81   HE21  GLN   8          HE21      GLN   8   7.280   6.216   4.157
   82   HE22  GLN   8          HE22      GLN   8   5.688   6.541   4.744
   83    H    VAL   9           H        VAL   9   9.885   7.030   0.524
   84    HA   VAL   9           HA       VAL   9  11.418   8.625   2.385
   85    HB   VAL   9           HB       VAL   9  11.143   5.813   1.786
   86   HG11  VAL   9          HG11      VAL   9  13.954   6.872   2.052
   87   HG12  VAL   9          HG12      VAL   9  13.495   5.178   2.228
   88   HG13  VAL   9          HG13      VAL   9  13.279   5.995   0.680
   89   HG21  VAL   9          HG21      VAL   9  10.720   6.877   3.958
   90   HG22  VAL   9          HG22      VAL   9  11.909   5.580   4.084
   91   HG23  VAL   9          HG23      VAL   9  12.435   7.263   4.095
   92    H    ILE  10           H        ILE  10  11.688   7.507  -0.917
   93    HA   ILE  10           HA       ILE  10  14.431   7.960  -1.315
   94    HB   ILE  10           HB       ILE  10  12.264   8.284  -3.391
   95   HG12  ILE  10          HG12      ILE  10  13.673   5.792  -2.415
   96   HG13  ILE  10          HG13      ILE  10  11.954   6.149  -2.290
   97   HG21  ILE  10          HG21      ILE  10  14.505   9.074  -4.032
   98   HG22  ILE  10          HG22      ILE  10  15.157   7.479  -3.661
   99   HG23  ILE  10          HG23      ILE  10  13.995   7.672  -4.973
  100   HD11  ILE  10          HD11      ILE  10  13.544   5.239  -4.614
  101   HD12  ILE  10          HD12      ILE  10  11.923   4.777  -4.092
  102   HD13  ILE  10          HD13      ILE  10  12.179   6.313  -4.920
  103    H    ARG  11           H        ARG  11  11.677  10.045  -2.219
  104    HA   ARG  11           HA       ARG  11  11.501  12.294  -2.504
  105    HB2  ARG  11           HB2      ARG  11  13.878  12.361  -0.636
  106    HB3  ARG  11           HB3      ARG  11  12.864  13.738  -1.049
  107    HG2  ARG  11           HG2      ARG  11  12.045  11.272   0.469
  108    HG3  ARG  11           HG3      ARG  11  12.219  12.911   1.101
  109    HD2  ARG  11           HD2      ARG  11  10.215  11.994  -0.959
  110    HD3  ARG  11           HD3      ARG  11   9.874  12.364   0.731
  111    HE   ARG  11           HE       ARG  11  10.257  14.243  -1.419
  112   HH11  ARG  11          HH11      ARG  11  10.307  13.755   2.027
  113   HH12  ARG  11          HH12      ARG  11  10.051  15.428   2.399
  114   HH21  ARG  11          HH21      ARG  11   9.920  16.448  -0.942
  115   HH22  ARG  11          HH22      ARG  11   9.830  16.959   0.709
  116    H    LYS  12           H        LYS  12  13.344  10.631  -4.192
  117    HA   LYS  12           HA       LYS  12  15.658  11.878  -4.960
  118    HB2  LYS  12           HB2      LYS  12  15.040  11.042  -7.319
  119    HB3  LYS  12           HB3      LYS  12  15.196   9.853  -6.032
  120    HG2  LYS  12           HG2      LYS  12  13.262   9.352  -7.370
  121    HG3  LYS  12           HG3      LYS  12  12.748   9.863  -5.760
  122    HD2  LYS  12           HD2      LYS  12  11.785  11.767  -6.527
  123    HD3  LYS  12           HD3      LYS  12  12.985  11.988  -7.802
  124    HE2  LYS  12           HE2      LYS  12  10.796   9.914  -7.848
  125    HE3  LYS  12           HE3      LYS  12  10.700  11.484  -8.644
  126    HZ1  LYS  12           HZ1      LYS  12  12.215   9.115  -9.389
  127    HZ2  LYS  12           HZ2      LYS  12  12.992  10.598  -9.630
  128    HZ3  LYS  12           HZ3      LYS  12  11.500  10.296 -10.367