*HEADER    TOXIN                                   05-AUG-14   2MSO              
*TITLE     SOLUTION STUDY OF CGM9A                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CONOTOXIN GM9.1;                                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 61-88;                                        
*COMPND   5 SYNONYM: GM9A, SPASMODIC PROTEIN TX9A-LIKE PROTEIN;                  
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: CONUS GLORIAMARIS;                              
*SOURCE   4 ORGANISM_COMMON: GLORY-OF-THE-SEAS CONE;                             
*SOURCE   5 ORGANISM_TAXID: 37336                                                
*KEYWDS    CONOTOXINS, CYCLIC PEPTIDES, CYCLIZATION, CYSTINE KNOT, DRUG DESIGN,  
*KEYWDS   2 TOXIN                                                                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    M.AKCAN, R.J.CLARK, N.L.DALY, A.C.CONIBEAR, A.C.DE FAOITE,            
*AUTHOR   2 M.C.HEGHINIAN, D.J.ADAMS, F.MARI, D.J.CRAIK                          
*REVDAT   1   22-JUL-15 2MSO    0                                                


!H proton - H proton
 27 ASN  HA     28 GLY  H       3.47            #peak 2 #SUP 1.00
 20 PHE  H      20 PHE  HA      2.94            #peak 20 #SUP 1.00
  1 SER  H       1 SER  HB3     3.72            #peak 31 #SUP 0.92 #QF 0.92
  1 SER  H       1 SER  HB2     3.72            #peak 32 #SUP 0.96 #QF 0.96
 13 ALA  H      13 ALA  QB      2.71            #peak 37 #SUP 0.89 #QF 0.89
 14 SER  H      14 SER  QB      3.09            #peak 38 #SUP 0.85 #QF 0.85
 16 CYSS H      16 CYSS HB2     3.51            #peak 41 #SUP 0.75 #QF 0.75
 16 CYSS H      16 CYSS HB3     4.11            #peak 42 #SUP 0.98 #QF 0.98
 17 ILE  H      17 ILE  HB      3.86            #peak 43 #SUP 1.00
 17 ILE  H      17 ILE  QG1     4.18            #peak 44 #SUP 0.94 #QF 0.94
 17 ILE  H      17 ILE  QG2     3.77            #peak 45 #SUP 0.90 #QF 0.90
 17 ILE  H      17 ILE  QD1     4.14            #peak 46 #SUP 0.83 #QF 0.83
 18 CYSS H      18 CYSS HB3     3.76            #peak 47 #SUP 0.98 #QF 0.98
 18 CYSS H      18 CYSS HB2     3.76            #peak 48 #SUP 0.89 #QF 0.89
 19 THR  H      19 THR  QG2     3.79            #peak 49 #SUP 0.90 #QF 0.90
 20 PHE  H      20 PHE  HB3     2.85            #peak 51 #SUP 0.93 #QF 0.93
 20 PHE  H      20 PHE  HB2     3.62            #peak 52 #SUP 1.00
 23 CYSS H      23 CYSS HB3     3.86            #peak 53 #SUP 0.97 #QF 0.97
 23 CYSS H      23 CYSS HB2     3.11            #peak 54 #SUP 0.67 #QF 0.67
 25 ALA  H      25 ALA  QB      2.81            #peak 55 #SUP 0.93 #QF 0.93
 26 VAL  H      26 VAL  HB      3.77            #peak 56 #SUP 0.96 #QF 0.96
 26 VAL  H      26 VAL  QQG     3.08            #peak 57 #SUP 0.99 #QF 0.99
 27 ASN  H      27 ASN  QB      3.58            #peak 58 #SUP 0.97 #QF 0.95
 27 ASN  QB     28 GLY  H       4.00            #peak 58 #SUP 0.97 #QF 0.95
 29 LEU  H      29 LEU  QD2     4.76            #peak 59 #SUP 1.00
 29 LEU  H      29 LEU  QD1     4.76            #peak 60 #SUP 0.99 #QF 0.99
 29 LEU  H      29 LEU  HB3     3.31            #peak 61 #SUP 0.79 #QF 0.79
 29 LEU  H      29 LEU  HB2     3.31            #peak 62 #SUP 0.78 #QF 0.78
 11 ASP  H      11 ASP  HB2     3.30            #peak 67 #SUP 0.74 #QF 0.74
  5 SER  H       5 SER  QB      3.02            #peak 68 #SUP 0.66 #QF 0.66
  7 GLN  H       7 GLN  QG      4.92            #peak 71 #SUP 1.00
  8 SER  H       8 SER  HB3     4.03            #peak 74 #SUP 0.97 #QF 0.97
  8 SER  H       8 SER  HB2     4.03            #peak 75 #SUP 0.98 #QF 0.98
 10 SER  H      10 SER  QB      3.06            #peak 77 #SUP 0.83 #QF 0.83
  4 ASN  H       4 ASN  HB3     3.91            #peak 79 #SUP 0.81 #QF 0.81
  4 ASN  H       4 ASN  HB2     3.91            #peak 80 #SUP 0.59 #QF 0.33
  4 ASN  H      23 CYSS HB2     4.08            #peak 80 #SUP 0.59 #QF 0.33
  3 ASN  H       3 ASN  QB      3.13            #peak 82 #SUP 0.86 #QF 0.86
 21 ARG  H      21 ARG  QD      5.22            #peak 83 #SUP 0.99 #QF 0.99
 21 ARG  H      21 ARG  HG3     4.17            #peak 86 #SUP 0.99 #QF 0.99
 21 ARG  H      21 ARG  HG2     4.17            #peak 87 #SUP 0.95 #QF 0.95
  1 SER  H       2 CYSS H       3.91            #peak 88 #SUP 0.84 #QF 0.84
  1 SER  H      30 PRO  HA      3.51            #peak 89 #SUP 0.65 #QF 0.65
  1 SER  H      29 LEU  HG      4.67            #peak 90 #SUP 0.65 #QF 0.65
  1 SER  H      29 LEU  HB2     5.50            #peak 91 #SUP 0.98 #QF 0.98
  2 CYSS H       3 ASN  H       4.30            #peak 98 #SUP 0.96 #QF 0.96
  4 ASN  H      23 CYSS H       4.60            #peak 104 #SUP 0.46 #QF 0.46
  5 SER  HA      6 CYSS H       3.13            #peak 118 #SUP 0.68 #QF 0.68
  5 SER  QB      6 CYSS H       4.20            #peak 119 #SUP 0.97 #QF 0.97
  6 CYSS H       7 GLN  H       4.81            #peak 121 #SUP 0.96 #QF 0.96
  6 CYSS HA      7 GLN  H       3.50            #peak 123 #SUP 0.95 #QF 0.95
  6 CYSS HB2     8 SER  H       3.54            #peak 125 #SUP 0.52 #QF 0.52
  6 CYSS HB3     8 SER  H       5.36            #peak 126 #SUP 1.00
  7 GLN  H       8 SER  H       2.93            #peak 130 #SUP 0.81 #QF 0.81
  7 GLN  HB2     8 SER  H       3.93            #peak 132 #SUP 0.97 #QF 0.97
  7 GLN  HB3     8 SER  H       3.93            #peak 133 #SUP 0.91 #QF 0.91
  7 GLN  HA      7 GLN  QG      4.25            #peak 134 #SUP 0.99 #QF 0.99
  8 SER  HA      9 HIS  H       3.51            #peak 141 #SUP 0.98 #QF 0.98
  9 HIS  H       9 HIS  QB      3.43            #peak 147 #SUP 1.00
  9 HIS  H      10 SER  H       3.93            #peak 148 #SUP 0.90 #QF 0.90
 10 SER  H      11 ASP  H       3.66            #peak 149 #SUP 0.76 #QF 0.76
  9 HIS  QB     10 SER  H       3.91            #peak 150 #SUP 0.75 #QF 0.75
 10 SER  QB     11 ASP  H       4.40            #peak 152 #SUP 1.00
 10 SER  HA     10 SER  QB      2.90            #peak 153 #SUP 1.00
  6 CYSS HB3    11 ASP  HB3     5.11            #peak 156 #SUP 0.99 #QF 0.99
  6 CYSS HB3    11 ASP  HB2     3.70            #peak 157 #SUP 0.88 #QF 0.88
 12 CYSS HA     13 ALA  H       2.84            #peak 160 #SUP 0.84 #QF 0.84
 12 CYSS HB3    13 ALA  H       4.24            #peak 161 #SUP 0.90 #QF 0.90
 12 CYSS HB2    13 ALA  H       4.24            #peak 162 #SUP 0.99 #QF 0.99
 13 ALA  H      16 CYSS HB2     4.18            #peak 168 #SUP 0.91 #QF 0.91
 13 ALA  HA     14 SER  H       2.59            #peak 169 #SUP 0.73 #QF 0.73
 13 ALA  QB     14 SER  H       2.73            #peak 170 #SUP 0.88 #QF 0.88
 12 CYSS HA     13 ALA  QB      4.57            #peak 172 #SUP 0.97 #QF 0.97
 14 SER  HA     15 HIS  H       3.31            #peak 173 #SUP 0.80 #QF 0.80
 15 HIS  HA     15 HIS  HE1     4.79            #peak 175 #SUP 0.44 #QF 0.44
 16 CYSS HA     17 ILE  H       3.16            #peak 183 #SUP 0.83 #QF 0.83
 16 CYSS HB3    24 GLY  H       4.29            #peak 185 #SUP 0.80 #QF 0.80
 16 CYSS HB3    17 ILE  H       3.91            #peak 186 #SUP 0.95 #QF 0.95
 16 CYSS HB2    17 ILE  H       5.01            #peak 187 #SUP 1.00
 17 ILE  H      24 GLY  H       4.31            #peak 190 #SUP 0.88 #QF 0.88
 17 ILE  HA     18 CYSS H       2.90            #peak 191 #SUP 0.83 #QF 0.83
 17 ILE  HB     18 CYSS H       4.24            #peak 192 #SUP 0.98 #QF 0.98
 17 ILE  QG1    18 CYSS H       4.60            #peak 193 #SUP 0.98 #QF 0.98
 17 ILE  QG2    18 CYSS H       4.66            #peak 194 #SUP 1.00
 17 ILE  QD1    18 CYSS H       3.98            #peak 195 #SUP 0.85 #QF 0.85
 17 ILE  HA     17 ILE  QD1     3.52            #peak 199 #SUP 0.91 #QF 0.91
 17 ILE  HB     17 ILE  QD1     3.55            #peak 202 #SUP 0.98 #QF 0.98
 17 ILE  QG2    17 ILE  QG1     3.22            #peak 203 #SUP 0.98 #QF 0.98
 17 ILE  QG2    17 ILE  QD1     4.25            #peak 205 #SUP 0.74 #QF 0.74
  6 CYSS HB2    18 CYSS HB2     4.40            #peak 210 #SUP 0.89 #QF 0.89
  6 CYSS HB2    18 CYSS HB3     4.40            #peak 211 #SUP 0.77 #QF 0.77
 19 THR  H      22 GLY  H       4.41            #peak 212 #SUP 0.45 #QF 0.45
 19 THR  H      23 CYSS HA      4.46            #peak 213 #SUP 0.66 #QF 0.66
 19 THR  HA     19 THR  QG2     4.04            #peak 216 #SUP 0.99 #QF 0.99
 19 THR  HB     20 PHE  H       2.58            #peak 217 #SUP 0.60 #QF 0.60
 19 THR  QG2    20 PHE  H       3.56            #peak 219 #SUP 0.97 #QF 0.97
 20 PHE  H      21 ARG  H       3.86            #peak 220 #SUP 0.95 #QF 0.95
 20 PHE  H      20 PHE  QD      3.41            #peak 221 #SUP 0.98 #QF 0.98
 20 PHE  QD     21 ARG  HG2     4.40            #peak 224 #SUP 0.93 #QF 0.93
 20 PHE  QD     21 ARG  HG3     4.40            #peak 225 #SUP 0.88 #QF 0.88
 21 ARG  HA     21 ARG  HE      5.24            #peak 230 #SUP 0.95 #QF 0.95
 22 GLY  HA3    23 CYSS H       3.28            #peak 249 #SUP 0.87 #QF 0.87
 22 GLY  HA2    23 CYSS H       3.28            #peak 250 #SUP 0.94 #QF 0.94
 23 CYSS HA     24 GLY  H       3.08            #peak 252 #SUP 0.80 #QF 0.80
  4 ASN  HD21   12 CYSS HA      4.49            #peak 253 #SUP 0.85 #QF 0.85
 12 CYSS HA     23 CYSS HB2     4.59            #peak 256 #SUP 0.97 #QF 0.29
 16 CYSS HB3    23 CYSS HB3     4.32            #peak 258 #SUP 0.96 #QF 0.96
 16 CYSS HB2    23 CYSS HB3     4.05            #peak 259 #SUP 0.84 #QF 0.84
 23 CYSS H      24 GLY  H       4.79            #peak 260 #SUP 0.98 #QF 0.98
 23 CYSS HB3    24 GLY  H       4.52            #peak 261 #SUP 0.94 #QF 0.94
 24 GLY  HA3    25 ALA  H       3.22            #peak 262 #SUP 0.87 #QF 0.87
 24 GLY  HA2    25 ALA  H       3.22            #peak 263 #SUP 0.95 #QF 0.95
 25 ALA  H      26 VAL  HA      5.34            #peak 267 #SUP 0.90 #QF 0.90
 25 ALA  HA     26 VAL  H       3.49            #peak 268 #SUP 0.94 #QF 0.94
 25 ALA  QB     26 VAL  H       3.53            #peak 269 #SUP 0.98 #QF 0.98
 25 ALA  QB     27 ASN  H       4.25            #peak 270 #SUP 0.76 #QF 0.61
 25 ALA  QB     28 GLY  H       4.54            #peak 270 #SUP 0.76 #QF 0.61
 25 ALA  QB     29 LEU  H       4.02            #peak 271 #SUP 0.43 #QF 0.43
 26 VAL  HA     27 ASN  H       3.55            #peak 275 #SUP 0.99 #QF 0.99
 26 VAL  HB     27 ASN  H       4.21            #peak 276 #SUP 0.97 #QF 0.97
 26 VAL  QQG    27 ASN  H       3.97            #peak 277 #SUP 0.99 #QF 0.99
 26 VAL  HA     26 VAL  QQG     3.07            #peak 279 #SUP 1.00
 28 GLY  H      29 LEU  H       3.93            #peak 281 #SUP 0.96 #QF 0.96
 26 VAL  H      27 ASN  H       3.95            #peak 282 #SUP 0.90 #QF 0.90
 28 GLY  HA3    29 LEU  H       3.53            #peak 287 #SUP 0.96 #QF 0.96
 28 GLY  HA2    29 LEU  H       3.53            #peak 288 #SUP 0.99 #QF 0.99
 29 LEU  HA     29 LEU  HG      3.47            #peak 301 #SUP 0.92 #QF 0.92
 29 LEU  HA     29 LEU  QD1     4.33            #peak 302 #SUP 0.94 #QF 0.94
 29 LEU  HA     29 LEU  QD2     4.33            #peak 303 #SUP 0.94 #QF 0.94
 29 LEU  HA     30 PRO  HD2     3.30            #peak 304 #SUP 0.97 #QF 0.33
 29 LEU  HA     30 PRO  HD3     3.30            #peak 305 #SUP 1.00
 29 LEU  HA     30 PRO  QG      4.63            #peak 306 #SUP 0.81 #QF 0.81
 25 ALA  QB     30 PRO  HA      4.43            #peak 307 #SUP 0.64 #QF 0.64
  1 SER  H      30 PRO  QB      4.20            #peak 331 #SUP 0.94 #QF 0.94
  1 SER  H      29 LEU  HB3     5.50            #peak 333 #SUP 0.87 #QF 0.87
  4 ASN  HD21    6 CYSS HB3     5.50            #peak 336 #SUP 0.84 #QF 0.84
  4 ASN  HD21   11 ASP  HB2     5.07            #peak 337 #SUP 0.50 #QF 0.50
  4 ASN  HD21    5 SER  H       4.99            #peak 341 #SUP 0.95 #QF 0.95
  6 CYSS HA     11 ASP  H       5.50            #peak 344 #SUP 0.99 #QF 0.99
  6 CYSS HB3    23 CYSS H       5.50            #peak 345 #SUP 0.30 #QF 0.30
  6 CYSS HB3     7 GLN  H       4.99            #peak 346 #SUP 0.99 #QF 0.99
  6 CYSS HB2     7 GLN  H       4.79            #peak 347 #SUP 0.99 #QF 0.99
  6 CYSS HA     11 ASP  HB3     5.50            #peak 349 #SUP 1.00
  6 CYSS HA     11 ASP  HB2     4.11            #peak 350 #SUP 0.95 #QF 0.95
  6 CYSS HB3    18 CYSS HB3     5.50            #peak 351 #SUP 0.97 #QF 0.97
  7 GLN  H       8 SER  HA      5.10            #peak 353 #SUP 0.92 #QF 0.92
  7 GLN  H      11 ASP  HB2     5.50            #peak 354 #SUP 0.95 #QF 0.95
  7 GLN  QG      8 SER  H       5.22            #peak 356 #SUP 0.98 #QF 0.98
  8 SER  H      11 ASP  H       5.09            #peak 357 #SUP 0.78 #QF 0.78
  8 SER  H       9 HIS  H       4.05            #peak 360 #SUP 0.83 #QF 0.83
  8 SER  HA     10 SER  H       5.38            #peak 364 #SUP 0.95 #QF 0.95
  7 GLN  H      11 ASP  H       5.50            #peak 367 #SUP 0.91 #QF 0.91
  6 CYSS HB3    11 ASP  H       5.50            #peak 368 #SUP 0.89 #QF 0.89
 11 ASP  HB2    12 CYSS H       5.50            #peak 369 #SUP 0.98 #QF 0.96
  4 ASN  HD22   12 CYSS HA      4.62            #peak 370 #SUP 0.79 #QF 0.79
 17 ILE  H      23 CYSS HA      5.50            #peak 371 #SUP 0.91 #QF 0.91
 12 CYSS HB3    16 CYSS H       5.50            #peak 372 #SUP 0.94 #QF 0.94
 12 CYSS HB2    16 CYSS H       5.50            #peak 373 #SUP 0.97 #QF 0.97
 12 CYSS HB2    17 ILE  HA      5.50            #peak 375 #SUP 0.83 #QF 0.83
 12 CYSS HB3    17 ILE  HA      5.50            #peak 376 #SUP 0.94 #QF 0.45
 13 ALA  H      16 CYSS HB3     4.84            #peak 377 #SUP 0.97 #QF 0.97
 13 ALA  QB     16 CYSS HB3     5.50            #peak 378 #SUP 0.95 #QF 0.95
 14 SER  H      15 HIS  H       4.76            #peak 379 #SUP 0.98 #QF 0.98
 15 HIS  HB2    16 CYSS H       5.50            #peak 381 #SUP 0.96 #QF 0.96
 15 HIS  HB3    16 CYSS H       5.50            #peak 382 #SUP 0.77 #QF 0.77
 16 CYSS H      17 ILE  H       5.50            #peak 384 #SUP 0.99 #QF 0.99
 12 CYSS HA     16 CYSS HB2     5.14            #peak 386 #SUP 0.96 #QF 0.96
 12 CYSS HA     16 CYSS HB3     5.34            #peak 387 #SUP 1.00 #QF 0.94
 16 CYSS HB3    23 CYSS HA      5.50            #peak 387 #SUP 1.00 #QF 0.94
 16 CYSS HA     17 ILE  HA      5.50            #peak 388 #SUP 0.97 #QF 0.97
 16 CYSS HA     25 ALA  QB      4.51            #peak 389 #SUP 0.48 #QF 0.48
 16 CYSS HB3    25 ALA  QB      5.50            #peak 391 #SUP 0.81 #QF 0.81
 20 PHE  HA     20 PHE  QD      3.79            #peak 392 #SUP 0.93 #QF 0.93
 17 ILE  HA     18 CYSS HB3     5.50            #peak 394 #SUP 0.63 #QF 0.63
 17 ILE  HA     18 CYSS HB2     5.50            #peak 395 #SUP 0.93 #QF 0.93
 16 CYSS HA     17 ILE  QG2     5.50            #peak 396 #SUP 0.89 #QF 0.89
  9 HIS  HA     18 CYSS H       5.50            #peak 397 #SUP 0.96 #QF 0.96
 18 CYSS HA     24 GLY  H       5.11            #peak 399 #SUP 0.36 #QF 0.36
 18 CYSS HB3    23 CYSS HA      5.15            #peak 401 #SUP 0.96 #QF 0.96
 18 CYSS HB2    23 CYSS HA      5.15            #peak 402 #SUP 0.95 #QF 0.95
  6 CYSS HB3    18 CYSS HB2     5.50            #peak 403 #SUP 1.00
 18 CYSS H      19 THR  H       5.50            #peak 404 #SUP 0.99 #QF 0.99
 19 THR  HB     22 GLY  H       5.04            #peak 405 #SUP 0.64 #QF 0.64
 20 PHE  H      20 PHE  QE      4.43            #peak 406 #SUP 0.89 #QF 0.89
  6 CYSS HB2    11 ASP  H       5.50            #peak 410 #SUP 0.98 #QF 0.32
 20 PHE  HB2    21 ARG  H       5.50            #peak 411 #SUP 1.00
 20 PHE  QE     21 ARG  HG3     5.50            #peak 414 #SUP 0.95 #QF 0.95
 20 PHE  QE     21 ARG  HG2     5.50            #peak 415 #SUP 0.96 #QF 0.96
  7 GLN  H      10 SER  HA      5.50            #peak 416 #SUP 0.60 #QF 0.60
  6 CYSS HB2    10 SER  HA      5.50            #peak 419 #SUP 0.51 #QF 0.51
 21 ARG  HA     21 ARG  QD      5.50            #peak 420 #SUP 0.96 #QF 0.96
 22 GLY  H      23 CYSS H       5.50            #peak 421 #SUP 0.99 #QF 0.99
 19 THR  HB     20 PHE  QD      4.13            #peak 423 #SUP 0.87 #QF 0.87
 19 THR  HB     20 PHE  QE      5.50            #peak 424 #SUP 0.99 #QF 0.99
 18 CYSS HA     23 CYSS H       5.50            #peak 425 #SUP 0.62 #QF 0.62
  6 CYSS HB3    23 CYSS HB2     5.50            #peak 428 #SUP 0.92 #QF 0.69
 16 CYSS HA     23 CYSS HB3     5.50            #peak 429 #SUP 0.90 #QF 0.90
  6 CYSS HB3    12 CYSS HA      5.50            #peak 430 #SUP 0.68 #QF 0.68
 24 GLY  H      25 ALA  H       4.89            #peak 431 #SUP 1.00
 17 ILE  QG1    24 GLY  H       5.50            #peak 432 #SUP 0.92 #QF 0.92
 17 ILE  QG2    24 GLY  H       5.50            #peak 434 #SUP 0.93 #QF 0.93
  2 CYSS H      25 ALA  H       5.50            #peak 438 #SUP 0.93 #QF 0.93
 26 VAL  HA     27 ASN  HA      5.50            #peak 443 #SUP 0.99 #QF 0.99
 27 ASN  HA     27 ASN  HD21    5.50            #peak 444 #SUP 0.98 #QF 0.98
 27 ASN  HA     27 ASN  HD22    5.50            #peak 445 #SUP 0.98 #QF 0.98
 25 ALA  QB     30 PRO  QG      5.50            #peak 451 #SUP 0.96 #QF 0.96
  1 SER  H       1 SER  QB      3.25            #peak 31
  1 SER  H      29 LEU  QB      4.84            #peak 91
  1 SER  H      30 PRO  QD      4.41            #peak 330
  1 SER  QB      2 CYSS H       4.15            #peak 95
  2 CYSS H       2 CYSS QB      3.42            #peak 33
  2 CYSS H      24 GLY  QA      4.85            #peak 435
  2 CYSS QB      3 ASN  H       4.01            #peak 100
  2 CYSS QB     24 GLY  QA      4.01            #peak 266
  2 CYSS QB     25 ALA  H       5.04            #peak 334
  3 ASN  QB      3 ASN  QD2     3.21            #peak 106
  4 ASN  H       4 ASN  QB      3.34            #peak 79
  4 ASN  QB      4 ASN  HD21    2.84            #peak 115
  4 ASN  QB      4 ASN  HD22    3.37            #peak 116
  4 ASN  QB      5 SER  H       2.98            #peak 112
  4 ASN  QB      5 SER  HA      5.34            #peak 376
  4 ASN  QB      6 CYSS HB3     5.34            #peak 428
  5 SER  H      22 GLY  QA      5.34            #peak 342
  6 CYSS H      22 GLY  QA      3.69            #peak 122
  6 CYSS HB2    18 CYSS QB      3.54            #peak 211
  7 GLN  H       7 GLN  QB      3.55            #peak 73
  7 GLN  QB      8 SER  H       3.35            #peak 133
  8 SER  QB     10 SER  H       4.96            #peak 143
  9 HIS  HA     12 CYSS QB      5.21            #peak 363
  9 HIS  HA     18 CYSS QB      3.69            #peak 328
  9 HIS  QB     18 CYSS QB      5.26            #peak 362
 12 CYSS H      12 CYSS QB      3.40            #peak 36
 12 CYSS QB     13 ALA  H       3.51            #peak 161
 12 CYSS QB     16 CYSS HA      5.34            #peak 374
 12 CYSS QB     16 CYSS HB2     4.45            #peak 166
 12 CYSS QB     16 CYSS HB3     5.03            #peak 390
 12 CYSS QB     18 CYSS H       5.34            #peak 398
 18 CYSS H      18 CYSS QB      3.13            #peak 48
 21 ARG  H      21 ARG  QB      3.52            #peak 85
 21 ARG  H      21 ARG  QG      3.62            #peak 87
 21 ARG  HA     21 ARG  QG      3.72            #peak 246
 21 ARG  QB     21 ARG  HE      4.41            #peak 233
 22 GLY  QA     23 CYSS H       2.82            #peak 249
 22 GLY  QA     23 CYSS HB2     5.34            #peak 339
 23 CYSS HA     24 GLY  QA      5.34            #peak 380
 23 CYSS HB2    24 GLY  QA      5.34            #peak 339
 23 CYSS HB3    24 GLY  QA      5.34            #peak 437
 24 GLY  QA     25 ALA  H       2.71            #peak 262
 24 GLY  QA     25 ALA  QB      4.86            #peak 436
 25 ALA  QB     30 PRO  QD      5.20            #peak 274
 27 ASN  QB     27 ASN  QD2     3.22            #peak 284
 28 GLY  QA     29 LEU  H       3.05            #peak 287
 28 GLY  QA     29 LEU  QQD     5.28            #peak 313
 29 LEU  H      29 LEU  QB      2.84            #peak 61
 29 LEU  H      29 LEU  QQD     4.14            #peak 60
 29 LEU  H      30 PRO  QD      4.91            #peak 447
 29 LEU  HA     29 LEU  QQD     3.56            #peak 303
 29 LEU  QB     29 LEU  HG      2.52            #peak 297
 29 LEU  QB     29 LEU  QQD     2.42            #peak 292
 29 LEU  QB     30 PRO  QD      4.13            #peak 320
 29 LEU  HG     30 PRO  QD      3.61            #peak 317
 29 LEU  QQD    30 PRO  QD      3.78            #peak 314
 !
 !Dihedral angles
   1 SER   PHI     -80.0   -50.0   1.00  #
   1 SER   CHI1    150.0   210.0   1.00  #
   2 CYSS  PHI    -150.0   -90.0   1.00  #
   2 CYSS  CHI1    -90.0   -30.0   1.00  #
   3 ASN   PHI    -180.0   -20.0   1.00  #
   4 ASN   PHI    -180.0   -20.0   1.00  #
   5 SER   PHI    -180.0   -20.0   1.00  #
   6 CYSS  PHI    -180.0   -20.0   1.00  # 
   6 CYSS  CHI1     30.0     90.0   1.00  #
   7 GLN   PHI    -180.0   -20.0   1.00  #
   9 HIS   PHI      10.0    90.0   1.00  #
  10 SER   PHI     -80.0   -50.0   1.00  #
  11 ASP   PHI    -180.0   -20.0   1.00  #
  11 ASP   CHI1    -90.0   -30.0   1.00  #  
  12 CYSS  PHI    -180.0   -20.0   1.00  #
  12 CYSS  CHI1    -90.0   -30.0   1.00  #
  13 ALA   PHI    -180.0   -20.0   1.00  #
  14 SER   PHI     10.0    90.0   1.00  #
  15 HIS   PHI     10.0     90.0   1.00  #
  16 CYSS  PHI    -180.0   -20.0   1.00  #
  17 ILE   PHI    -180.0   -20.0   1.00  #
  18 CYSS  PHI    -180.0   -20.0   1.00  #
  18 CYSS  CHI1    -90.0   -30.0   1.00  #
  19 THR   PHI    -180.0   -20.0   1.00  #
  20 PHE   PHI    -180.0   -20.0   1.00  #
  22 GLY   PHI      10.0    90.0   1.00  #
  23 CYSS  PHI    -180.0   -20.0   1.00  #
  23 CYSS   CHI1   -90.0   -30.0   1.00  # 
  24 GLY   PHI    -180.0   -20.0   1.00  #
  25 ALA   PHI    -180.0   -20.0   1.00  #
  26 VAL   PHI    -180.0   -20.0   1.00  # 
  27 ASN   PHI      10.0    90.0  1.00  #
  28 GLY   PHI      10.0    90.0  1.00  #
  29 LEU   PHI    -180.0   -20.0   1.00  # 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   1           H        SER   1  -6.020   4.614   2.100
    2    HA   SER   1           HA       SER   1  -7.433   2.647   3.660
    3    HB3  SER   1           2HB      SER   1  -5.876   1.929   1.206
    4    HG   SER   1           HG       SER   1  -8.052   0.909   0.875
    5    H    CYS   2           H        CYS   2  -4.148   2.768   2.268
    6    HA   CYS   2           HA       CYS   2  -3.181   1.299   4.621
    7    HB3  CYS   2           2HB      CYS   2  -1.775  -0.116   3.212
    8    H    ASN   3           H        ASN   3  -1.875   2.710   5.590
    9    HA   ASN   3           HA       ASN   3   0.071   4.168   3.924
   10    HB3  ASN   3           2HB      ASN   3   0.022   5.781   6.008
   11   HD21  ASN   3          1HD2      ASN   3   0.147   7.457   4.696
   12   HD22  ASN   3          2HD2      ASN   3  -1.056   7.940   3.553
   13    H    ASN   4           H        ASN   4   1.098   1.922   4.437
   14    HA   ASN   4           HA       ASN   4   2.909   2.354   6.695
   15    HB3  ASN   4           2HB      ASN   4   1.546   0.811   7.761
   16   HD21  ASN   4          1HD2      ASN   4   2.042  -1.829   5.763
   17   HD22  ASN   4          2HD2      ASN   4   0.438  -1.988   5.141
   18    H    SER   5           H        SER   5   4.935   1.259   6.504
   19    HA   SER   5           HA       SER   5   5.877   1.135   3.811
   20    HB3  SER   5           2HB      SER   5   7.294   1.964   5.645
   21    HG   SER   5           HG       SER   5   7.912   0.684   7.276
   22    H    CYS   6           H        CYS   6   6.823  -0.659   2.744
   23    HA   CYS   6           HA       CYS   6   6.779  -3.296   3.733
   24    HB3  CYS   6           2HB      CYS   6   4.393  -3.208   3.624
   25    H    GLN   7           H        GLN   7   7.171  -4.915   1.969
   26    HA   GLN   7           HA       GLN   7   8.468  -3.642  -0.349
   27    HB3  GLN   7           2HB      GLN   7  10.035  -5.715  -0.188
   28    HG3  GLN   7           2HG      GLN   7  11.506  -4.603   1.484
   29   HE21  GLN   7          1HE2      GLN   7  10.664  -1.596   0.818
   30   HE22  GLN   7          2HE2      GLN   7  11.349  -1.397  -0.754
   31    H    SER   8           H        SER   8   7.018  -6.624   0.908
   32    HA   SER   8           HA       SER   8   5.965  -7.157  -1.776
   33    HB3  SER   8           2HB      SER   8   7.919  -8.580  -1.606
   34    HG   SER   8           HG       SER   8   8.373  -8.933   0.459
   35    H    HIS   9           H        HIS   9   4.236  -6.054  -0.315
   36    HA   HIS   9           HA       HIS   9   2.267  -6.187   0.823
   37    HB3  HIS   9           2HB      HIS   9   1.035  -8.417   0.487
   38    HD1  HIS   9           1HD      HIS   9   2.765  -7.727  -2.758
   39    HD2  HIS   9           2HD      HIS   9  -0.662  -6.557  -0.721
   40    HE1  HIS   9           1HE      HIS   9   1.375  -6.478  -4.441
   41    H    SER  10           H        SER  10   4.733  -6.867   2.259
   42    HA   SER  10           HA       SER  10   4.157  -9.019   4.052
   43    HB3  SER  10           2HB      SER  10   6.450  -8.580   3.802
   44    HG   SER  10           HG       SER  10   6.194  -5.889   4.577
   45    H    ASP  11           H        ASP  11   3.800  -5.514   4.147
   46    HA   ASP  11           HA       ASP  11   2.450  -5.763   6.752
   47    HB3  ASP  11           2HB      ASP  11   2.911  -3.386   7.077
   48    H    CYS  12           H        CYS  12   2.075  -4.871   3.437
   49    HA   CYS  12           HA       CYS  12  -0.224  -3.256   3.638
   50    HB3  CYS  12           2HB      CYS  12  -0.505  -3.628   1.277
   51    H    ALA  13           H        ALA  13  -2.411  -3.862   2.885
   52    HA   ALA  13           HA       ALA  13  -3.219  -6.613   3.040
   53    HB1  ALA  13           1HB      ALA  13  -3.101  -6.389   5.366
   54    HB2  ALA  13           2HB      ALA  13  -3.767  -4.755   5.332
   55    HB3  ALA  13           3HB      ALA  13  -4.806  -6.137   4.986
   56    H    SER  14           H        SER  14  -5.638  -6.812   2.879
   57    HA   SER  14           HA       SER  14  -7.559  -6.376   1.741
   58    HB3  SER  14           2HB      SER  14  -8.190  -3.830   1.715
   59    HG   SER  14           HG       SER  14  -7.905  -5.434   4.028
   60    H    HIS  15           H        HIS  15  -5.524  -6.873   0.084
   61    HA   HIS  15           HA       HIS  15  -4.701  -6.587  -2.023
   62    HB3  HIS  15           2HB      HIS  15  -6.319  -5.761  -3.693
   63    HD1  HIS  15           1HD      HIS  15  -5.791  -8.447  -1.750
   64    HD2  HIS  15           2HD      HIS  15  -9.302  -7.020  -3.453
   65    HE1  HIS  15           1HE      HIS  15  -7.332 -10.431  -1.877
   66    H    CYS  16           H        CYS  16  -3.441  -4.884  -0.475
   67    HA   CYS  16           HA       CYS  16  -3.586  -2.257  -1.792
   68    HB3  CYS  16           2HB      CYS  16  -1.982  -1.756   0.290
   69    H    ILE  17           H        ILE  17  -2.126  -1.935  -3.322
   70    HA   ILE  17           HA       ILE  17   0.035  -3.598  -3.888
   71    HB   ILE  17           HB       ILE  17  -0.192  -0.678  -4.622
   72   HG13  ILE  17          2HG1      ILE  17  -1.261  -1.504  -6.699
   73   HG21  ILE  17          1HG2      ILE  17   1.009  -1.854  -6.716
   74   HG22  ILE  17          2HG2      ILE  17   1.889  -1.138  -5.367
   75   HG23  ILE  17          3HG2      ILE  17   1.608  -2.878  -5.410
   76   HD11  ILE  17          3HD1      ILE  17  -1.995  -4.082  -5.497
   77   HD12  ILE  17          1HD1      ILE  17  -1.719  -3.646  -7.183
   78   HD13  ILE  17          2HD1      ILE  17  -0.349  -3.962  -6.118
   79    H    CYS  18           H        CYS  18   2.256  -3.423  -3.568
   80    HA   CYS  18           HA       CYS  18   3.110  -1.504  -1.503
   81    HB3  CYS  18           2HB      CYS  18   4.768  -3.537  -0.973
   82    H    THR  19           H        THR  19   4.961  -0.436  -1.894
   83    HA   THR  19           HA       THR  19   6.833  -1.437  -3.893
   84    HB   THR  19           HB       THR  19   6.895   0.673  -5.127
   85    HG1  THR  19           1HG      THR  19   5.277   2.247  -4.701
   86   HG21  THR  19          3HG2      THR  19   4.678   0.514  -6.235
   87   HG22  THR  19          1HG2      THR  19   4.142  -0.553  -4.939
   88   HG23  THR  19          2HG2      THR  19   5.452  -1.055  -6.008
   89    H    PHE  20           H        PHE  20   8.573   0.540  -4.143
   90    HA   PHE  20           HA       PHE  20  10.017   0.542  -1.762
   91    HB3  PHE  20           2HB      PHE  20  11.166   0.919  -3.827
   92    HD1  PHE  20           1HD      PHE  20  10.082   4.409  -3.369
   93    HD2  PHE  20           2HD      PHE  20  10.038   0.994  -5.908
   94    HE1  PHE  20           1HE      PHE  20   9.196   5.789  -5.203
   95    HE2  PHE  20           2HE      PHE  20   9.152   2.369  -7.747
   96    HZ   PHE  20           HZ       PHE  20   8.731   4.770  -7.396
   97    H    ARG  21           H        ARG  21   7.477   2.616  -2.841
   98    HA   ARG  21           HA       ARG  21   8.054   4.610  -0.782
   99    HB3  ARG  21           2HB      ARG  21   5.849   5.590  -1.872
  100    HG3  ARG  21           2HG      ARG  21   7.392   6.356  -3.888
  101    HD3  ARG  21           2HD      ARG  21   6.616   7.516  -1.650
  102    HE   ARG  21           HE       ARG  21   9.116   6.521  -0.831
  103   HH11  ARG  21          1HH1      ARG  21   7.246   9.457  -0.812
  104   HH12  ARG  21          2HH1      ARG  21   7.988  10.074   0.626
  105   HH21  ARG  21          1HH2      ARG  21  10.100   7.323   1.064
  106   HH22  ARG  21          2HH2      ARG  21   9.613   8.861   1.692
  107    H    GLY  22           H        GLY  22   7.110   1.823  -0.229
  108    HA2  GLY  22           2HA      GLY  22   5.864   1.005   1.560
  109    HA3  GLY  22           3HA      GLY  22   5.070   2.568   1.688
  110    H    CYS  23           H        CYS  23   3.105   1.334   1.990
  111    HA   CYS  23           HA       CYS  23   2.100  -0.186  -0.260
  112    HB3  CYS  23           2HB      CYS  23   0.116  -0.539   1.140
  113    H    GLY  24           H        GLY  24  -0.109   0.297  -1.120
  114    HA2  GLY  24           2HA      GLY  24  -0.590   3.205  -1.273
  115    HA3  GLY  24           3HA      GLY  24  -0.548   2.215  -2.724
  116    H    ALA  25           H        ALA  25  -2.738   3.815  -1.967
  117    HA   ALA  25           HA       ALA  25  -4.745   1.774  -1.262
  118    HB1  ALA  25           1HB      ALA  25  -6.180   3.722  -0.591
  119    HB2  ALA  25           2HB      ALA  25  -4.756   3.456   0.416
  120    HB3  ALA  25           3HB      ALA  25  -4.757   4.746  -0.786
  121    H    VAL  26           H        VAL  26  -7.004   2.493  -2.152
  122    HA   VAL  26           HA       VAL  26  -6.636   3.106  -5.010
  123    HB   VAL  26           HB       VAL  26  -8.750   1.877  -5.389
  124   HG11  VAL  26          1HG1      VAL  26  -7.774  -0.230  -5.398
  125   HG12  VAL  26          2HG1      VAL  26  -6.378   0.848  -5.369
  126   HG13  VAL  26          3HG1      VAL  26  -6.910   0.053  -3.887
  127   HG21  VAL  26          3HG2      VAL  26  -8.887   2.017  -2.531
  128   HG22  VAL  26          1HG2      VAL  26 -10.112   1.480  -3.680
  129   HG23  VAL  26          2HG2      VAL  26  -8.935   0.331  -3.046
  130    H    ASN  27           H        ASN  27  -8.042   4.521  -6.040
  131    HA   ASN  27           HA       ASN  27  -9.328   6.386  -6.247
  132    HB3  ASN  27           2HB      ASN  27 -11.417   6.450  -4.880
  133   HD21  ASN  27          1HD2      ASN  27 -12.755   4.006  -4.667
  134   HD22  ASN  27          2HD2      ASN  27 -12.817   3.279  -6.233
  135    H    GLY  28           H        GLY  28  -7.008   6.365  -4.382
  136    HA2  GLY  28           2HA      GLY  28  -5.979   7.820  -2.935
  137    HA3  GLY  28           3HA      GLY  28  -7.179   8.996  -3.450
  138    H    LEU  29           H        LEU  29  -7.583   5.945  -1.678
  139    HA   LEU  29           HA       LEU  29  -9.104   7.395   0.350
  140    HB3  LEU  29           2HB      LEU  29  -9.176   4.734   1.041
  141    HG   LEU  29           HG       LEU  29 -11.204   6.054   0.921
  142   HD11  LEU  29          1HD1      LEU  29 -11.295   7.413  -0.871
  143   HD12  LEU  29          2HD1      LEU  29 -12.140   6.051  -1.605
  144   HD13  LEU  29          3HD1      LEU  29 -10.419   6.286  -1.907
  145   HD21  LEU  29          3HD2      LEU  29 -11.669   3.766   0.965
  146   HD22  LEU  29          1HD2      LEU  29 -11.110   3.526  -0.690
  147   HD23  LEU  29          2HD2      LEU  29 -12.629   4.371  -0.387
  148    HA   PRO  30           HA       PRO  30  -6.074   7.177   3.515
  149    HB3  PRO  30           2HB      PRO  30  -7.607   8.151   4.921
  150    HG3  PRO  30           2HG      PRO  30  -9.859   7.579   4.823
  151    HD3  PRO  30           2HD      PRO  30  -9.458   7.995   2.592
  Start of MODEL    2
    1    H1   SER   1           H        SER   1  -7.017   4.137   2.867
    2    HA   SER   1           HA       SER   1  -7.185   2.593   5.169
    3    HB3  SER   1           2HB      SER   1  -6.951   1.838   2.259
    4    HG   SER   1           HG       SER   1  -7.252  -0.254   2.802
    5    H    CYS   2           H        CYS   2  -4.872   1.846   2.573
    6    HA   CYS   2           HA       CYS   2  -3.037   0.771   4.572
    7    HB3  CYS   2           2HB      CYS   2  -1.811  -0.129   2.604
    8    H    ASN   3           H        ASN   3  -1.789   2.288   5.479
    9    HA   ASN   3           HA       ASN   3  -0.454   4.220   3.697
   10    HB3  ASN   3           2HB      ASN   3  -0.401   5.802   5.496
   11   HD21  ASN   3          1HD2      ASN   3  -1.860   7.004   4.465
   12   HD22  ASN   3          2HD2      ASN   3  -3.570   6.775   4.544
   13    H    ASN   4           H        ASN   4  -0.083   1.798   6.146
   14    HA   ASN   4           HA       ASN   4   2.459   2.303   7.112
   15    HB3  ASN   4           2HB      ASN   4   1.015   0.520   7.985
   16   HD21  ASN   4          1HD2      ASN   4   1.355  -2.141   7.648
   17   HD22  ASN   4          2HD2      ASN   4   0.580  -2.665   6.196
   18    H    SER   5           H        SER   5   4.489   1.136   6.593
   19    HA   SER   5           HA       SER   5   4.993   1.313   3.729
   20    HB3  SER   5           2HB      SER   5   7.425   0.925   4.575
   21    HG   SER   5           HG       SER   5   6.464   3.284   5.668
   22    H    CYS   6           H        CYS   6   6.435  -0.327   2.721
   23    HA   CYS   6           HA       CYS   6   6.781  -2.903   3.787
   24    HB3  CYS   6           2HB      CYS   6   4.440  -3.254   3.690
   25    H    GLN   7           H        GLN   7   7.075  -4.548   1.838
   26    HA   GLN   7           HA       GLN   7   8.309  -3.138  -0.423
   27    HB3  GLN   7           2HB      GLN   7  10.144  -3.651   1.032
   28    HG3  GLN   7           2HG      GLN   7   9.401  -6.556   0.989
   29   HE21  GLN   7          1HE2      GLN   7  11.065  -7.748   1.545
   30   HE22  GLN   7          2HE2      GLN   7  12.439  -7.227   2.454
   31    H    SER   8           H        SER   8   7.323  -6.303   0.858
   32    HA   SER   8           HA       SER   8   6.284  -6.965  -1.807
   33    HB3  SER   8           2HB      SER   8   7.080  -9.316  -1.479
   34    HG   SER   8           HG       SER   8   8.383  -8.089  -2.765
   35    H    HIS   9           H        HIS   9   4.479  -6.041  -0.262
   36    HA   HIS   9           HA       HIS   9   2.550  -6.407   0.891
   37    HB3  HIS   9           2HB      HIS   9   1.575  -8.768   0.552
   38    HD1  HIS   9           1HD      HIS   9  -0.362  -7.626  -0.533
   39    HD2  HIS   9           2HD      HIS   9   3.127  -7.281  -2.763
   40    HE1  HIS   9           1HE      HIS   9  -1.054  -6.563  -2.705
   41    H    SER  10           H        SER  10   5.024  -6.726   2.339
   42    HA   SER  10           HA       SER  10   4.725  -8.980   4.104
   43    HB3  SER  10           2HB      SER  10   6.964  -8.310   3.783
   44    HG   SER  10           HG       SER  10   7.608  -6.267   3.670
   45    H    ASP  11           H        ASP  11   3.930  -5.565   4.146
   46    HA   ASP  11           HA       ASP  11   2.674  -5.936   6.787
   47    HB3  ASP  11           2HB      ASP  11   2.946  -3.531   7.145
   48    H    CYS  12           H        CYS  12   2.225  -5.046   3.485
   49    HA   CYS  12           HA       CYS  12  -0.190  -3.607   3.712
   50    HB3  CYS  12           2HB      CYS  12  -0.440  -3.954   1.346
   51    H    ALA  13           H        ALA  13  -2.308  -4.406   2.842
   52    HA   ALA  13           HA       ALA  13  -2.903  -7.197   2.977
   53    HB1  ALA  13           1HB      ALA  13  -2.831  -7.070   5.296
   54    HB2  ALA  13           2HB      ALA  13  -3.537  -5.454   5.328
   55    HB3  ALA  13           3HB      ALA  13  -4.543  -6.847   4.934
   56    H    SER  14           H        SER  14  -5.308  -7.576   2.828
   57    HA   SER  14           HA       SER  14  -7.259  -7.266   1.698
   58    HB3  SER  14           2HB      SER  14  -8.246  -4.940   1.815
   59    HG   SER  14           HG       SER  14  -8.900  -5.645   3.669
   60    H    HIS  15           H        HIS  15  -5.205  -7.570   0.022
   61    HA   HIS  15           HA       HIS  15  -4.417  -7.173  -2.079
   62    HB3  HIS  15           2HB      HIS  15  -6.168  -6.203  -3.669
   63    HD1  HIS  15           1HD      HIS  15  -5.821  -9.000  -1.299
   64    HD2  HIS  15           2HD      HIS  15  -8.010  -8.135  -4.722
   65    HE1  HIS  15           1HE      HIS  15  -6.725 -11.207  -2.094
   66    H    CYS  16           H        CYS  16  -3.232  -5.446  -0.534
   67    HA   CYS  16           HA       CYS  16  -3.575  -2.797  -1.775
   68    HB3  CYS  16           2HB      CYS  16  -2.003  -2.245   0.327
   69    H    ILE  17           H        ILE  17  -2.165  -2.436  -3.348
   70    HA   ILE  17           HA       ILE  17   0.124  -3.911  -3.892
   71    HB   ILE  17           HB       ILE  17  -0.962  -2.455  -5.546
   72   HG13  ILE  17          2HG1      ILE  17   1.959  -1.899  -4.996
   73   HG21  ILE  17          1HG2      ILE  17   0.360  -0.116  -4.200
   74   HG22  ILE  17          2HG2      ILE  17  -0.824  -0.105  -5.506
   75   HG23  ILE  17          3HG2      ILE  17  -1.312  -0.576  -3.879
   76   HD11  ILE  17          3HD1      ILE  17   0.662  -3.778  -6.956
   77   HD12  ILE  17          1HD1      ILE  17   2.393  -3.515  -6.740
   78   HD13  ILE  17          2HD1      ILE  17   1.443  -4.247  -5.447
   79    H    CYS  18           H        CYS  18   2.262  -3.724  -3.399
   80    HA   CYS  18           HA       CYS  18   2.979  -1.686  -1.394
   81    HB3  CYS  18           2HB      CYS  18   4.801  -3.579  -0.887
   82    H    THR  19           H        THR  19   4.089  -0.176  -2.477
   83    HA   THR  19           HA       THR  19   6.156  -1.056  -4.380
   84    HB   THR  19           HB       THR  19   5.547   1.810  -4.345
   85    HG1  THR  19           1HG      THR  19   3.451   1.633  -4.484
   86   HG21  THR  19          3HG2      THR  19   5.041   0.483  -6.831
   87   HG22  THR  19          1HG2      THR  19   6.526  -0.151  -6.123
   88   HG23  THR  19          2HG2      THR  19   6.355   1.581  -6.408
   89    H    PHE  20           H        PHE  20   7.874   0.912  -4.535
   90    HA   PHE  20           HA       PHE  20   9.484   0.688  -2.272
   91    HB3  PHE  20           2HB      PHE  20  10.537   1.255  -4.320
   92    HD1  PHE  20           1HD      PHE  20   9.246   4.644  -3.618
   93    HD2  PHE  20           2HD      PHE  20   9.399   1.404  -6.373
   94    HE1  PHE  20           1HE      PHE  20   8.219   6.067  -5.343
   95    HE2  PHE  20           2HE      PHE  20   8.374   2.821  -8.103
   96    HZ   PHE  20           HZ       PHE  20   7.782   5.156  -7.588
   97    H    ARG  21           H        ARG  21   6.879   2.840  -2.957
   98    HA   ARG  21           HA       ARG  21   7.619   4.650  -0.788
   99    HB3  ARG  21           2HB      ARG  21   5.256   5.617  -1.632
  100    HG3  ARG  21           2HG      ARG  21   7.712   6.054  -3.303
  101    HD3  ARG  21           2HD      ARG  21   5.389   7.121  -3.771
  102    HE   ARG  21           HE       ARG  21   5.745   8.137  -1.205
  103   HH11  ARG  21          1HH1      ARG  21   5.062   9.310  -4.410
  104   HH12  ARG  21          2HH1      ARG  21   4.159  10.681  -3.858
  105   HH21  ARG  21          1HH2      ARG  21   4.557   9.938  -0.463
  106   HH22  ARG  21          2HH2      ARG  21   3.873  11.037  -1.612
  107    H    GLY  22           H        GLY  22   6.678   1.791  -0.473
  108    HA2  GLY  22           2HA      GLY  22   5.616   0.811   1.363
  109    HA3  GLY  22           3HA      GLY  22   4.837   2.349   1.704
  110    H    CYS  23           H        CYS  23   2.932   0.998   2.070
  111    HA   CYS  23           HA       CYS  23   1.728  -0.311  -0.199
  112    HB3  CYS  23           2HB      CYS  23  -0.082  -0.857   1.299
  113    H    GLY  24           H        GLY  24  -0.701   0.227  -0.588
  114    HA2  GLY  24           2HA      GLY  24  -1.381   3.028  -0.367
  115    HA3  GLY  24           3HA      GLY  24  -0.980   2.516  -2.000
  116    H    ALA  25           H        ALA  25  -3.523   3.483  -0.845
  117    HA   ALA  25           HA       ALA  25  -5.212   1.107  -1.231
  118    HB1  ALA  25           1HB      ALA  25  -5.302   2.924   0.778
  119    HB2  ALA  25           2HB      ALA  25  -6.499   3.590  -0.335
  120    HB3  ALA  25           3HB      ALA  25  -6.671   1.939   0.261
  121    H    VAL  26           H        VAL  26  -7.303   1.507  -2.377
  122    HA   VAL  26           HA       VAL  26  -6.909   2.308  -4.990
  123    HB   VAL  26           HB       VAL  26  -9.376   2.365  -5.212
  124   HG11  VAL  26          1HG1      VAL  26  -9.012  -0.021  -3.542
  125   HG12  VAL  26          2HG1      VAL  26  -9.464   0.119  -5.243
  126   HG13  VAL  26          3HG1      VAL  26  -7.768   0.220  -4.769
  127   HG21  VAL  26          3HG2      VAL  26 -10.108   3.343  -3.195
  128   HG22  VAL  26          1HG2      VAL  26 -10.673   1.673  -3.139
  129   HG23  VAL  26          2HG2      VAL  26  -9.250   2.154  -2.214
  130    H    ASN  27           H        ASN  27  -6.884   4.195  -6.040
  131    HA   ASN  27           HA       ASN  27  -6.928   6.433  -6.444
  132    HB3  ASN  27           2HB      ASN  27  -9.194   6.575  -4.455
  133   HD21  ASN  27          1HD2      ASN  27  -8.171   7.554  -7.713
  134   HD22  ASN  27          2HD2      ASN  27  -8.678   9.199  -7.560
  135    H    GLY  28           H        GLY  28  -5.364   5.335  -4.166
  136    HA2  GLY  28           2HA      GLY  28  -4.069   6.098  -2.429
  137    HA3  GLY  28           3HA      GLY  28  -4.198   7.661  -3.221
  138    H    LEU  29           H        LEU  29  -6.170   5.497  -1.186
  139    HA   LEU  29           HA       LEU  29  -7.102   7.890   0.259
  140    HB3  LEU  29           2HB      LEU  29  -8.837   5.807   0.875
  141    HG   LEU  29           HG       LEU  29  -9.245   8.330   0.076
  142   HD11  LEU  29          1HD1      LEU  29 -10.671   7.979  -2.079
  143   HD12  LEU  29          2HD1      LEU  29  -9.585   6.615  -2.340
  144   HD13  LEU  29          3HD1      LEU  29  -8.933   8.247  -2.200
  145   HD21  LEU  29          3HD2      LEU  29 -10.771   6.768   1.308
  146   HD22  LEU  29          1HD2      LEU  29 -11.333   6.187  -0.259
  147   HD23  LEU  29          2HD2      LEU  29 -11.578   7.873   0.195
  148    HA   PRO  30           HA       PRO  30  -5.443   6.366   4.024
  149    HB3  PRO  30           2HB      PRO  30  -6.324   8.222   5.055
  150    HG3  PRO  30           2HG      PRO  30  -8.409   9.054   4.449
  151    HD3  PRO  30           2HD      PRO  30  -7.436   8.867   2.368
  Start of MODEL    3
    1    H1   SER   1           H        SER   1  -7.430   3.745   2.712
    2    HA   SER   1           HA       SER   1  -7.641   2.032   4.880
    3    HB3  SER   1           2HB      SER   1  -6.997   1.219   2.035
    4    HG   SER   1           HG       SER   1  -8.560  -0.143   3.961
    5    H    CYS   2           H        CYS   2  -5.132   1.672   2.376
    6    HA   CYS   2           HA       CYS   2  -3.340   0.601   4.443
    7    HB3  CYS   2           2HB      CYS   2  -2.163  -0.537   2.694
    8    H    ASN   3           H        ASN   3  -1.986   2.058   5.251
    9    HA   ASN   3           HA       ASN   3  -0.511   3.781   3.400
   10    HB3  ASN   3           2HB      ASN   3  -2.138   5.319   4.138
   11   HD21  ASN   3          1HD2      ASN   3  -3.609   6.124   5.588
   12   HD22  ASN   3          2HD2      ASN   3  -3.987   5.337   7.079
   13    H    ASN   4           H        ASN   4   0.699   1.633   4.227
   14    HA   ASN   4           HA       ASN   4   2.498   2.563   6.358
   15    HB3  ASN   4           2HB      ASN   4   1.383   0.907   7.536
   16   HD21  ASN   4          1HD2      ASN   4   2.348  -1.577   5.380
   17   HD22  ASN   4          2HD2      ASN   4   0.766  -2.094   4.914
   18    H    SER   5           H        SER   5   4.621   1.387   6.318
   19    HA   SER   5           HA       SER   5   5.635   1.409   3.621
   20    HB3  SER   5           2HB      SER   5   7.833   0.882   4.816
   21    HG   SER   5           HG       SER   5   7.562   2.994   4.423
   22    H    CYS   6           H        CYS   6   6.605  -0.297   2.521
   23    HA   CYS   6           HA       CYS   6   6.887  -2.909   3.569
   24    HB3  CYS   6           2HB      CYS   6   4.495  -3.042   3.523
   25    H    GLN   7           H        GLN   7   6.844  -4.514   1.467
   26    HA   GLN   7           HA       GLN   7   8.114  -3.158  -0.789
   27    HB3  GLN   7           2HB      GLN   7  10.012  -3.690   0.564
   28    HG3  GLN   7           2HG      GLN   7   9.195  -6.575   0.645
   29   HE21  GLN   7          1HE2      GLN   7  10.682  -7.860   1.538
   30   HE22  GLN   7          2HE2      GLN   7  12.183  -7.324   2.206
   31    H    SER   8           H        SER   8   7.144  -6.301   0.563
   32    HA   SER   8           HA       SER   8   5.971  -6.964  -2.048
   33    HB3  SER   8           2HB      SER   8   6.704  -9.371  -1.590
   34    HG   SER   8           HG       SER   8   8.628  -9.010  -2.598
   35    H    HIS   9           H        HIS   9   4.222  -5.998  -0.500
   36    HA   HIS   9           HA       HIS   9   2.336  -6.299   0.744
   37    HB3  HIS   9           2HB      HIS   9   2.405  -9.209   0.007
   38    HD1  HIS   9           1HD      HIS   9   0.530  -9.588   1.744
   39    HD2  HIS   9           2HD      HIS   9  -0.368  -6.721  -1.125
   40    HE1  HIS   9           1HE      HIS   9  -1.938  -9.164   1.967
   41    H    SER  10           H        SER  10   4.905  -6.708   2.070
   42    HA   SER  10           HA       SER  10   4.634  -8.902   3.888
   43    HB3  SER  10           2HB      SER  10   6.520  -7.698   5.108
   44    HG   SER  10           HG       SER  10   7.065  -9.253   3.602
   45    H    ASP  11           H        ASP  11   3.922  -5.454   3.979
   46    HA   ASP  11           HA       ASP  11   2.661  -5.843   6.614
   47    HB3  ASP  11           2HB      ASP  11   2.901  -3.234   6.658
   48    H    CYS  12           H        CYS  12   2.236  -4.860   3.338
   49    HA   CYS  12           HA       CYS  12  -0.048  -3.273   3.511
   50    HB3  CYS  12           2HB      CYS  12  -0.450  -3.848   1.191
   51    H    ALA  13           H        ALA  13  -2.277  -3.864   2.914
   52    HA   ALA  13           HA       ALA  13  -3.049  -6.603   3.587
   53    HB1  ALA  13           1HB      ALA  13  -4.038  -4.154   5.034
   54    HB2  ALA  13           2HB      ALA  13  -4.837  -5.726   5.107
   55    HB3  ALA  13           3HB      ALA  13  -3.192  -5.543   5.715
   56    H    SER  14           H        SER  14  -5.511  -6.846   3.295
   57    HA   SER  14           HA       SER  14  -7.214  -6.931   1.784
   58    HB3  SER  14           2HB      SER  14  -8.077  -4.680   1.042
   59    HG   SER  14           HG       SER  14  -8.819  -5.409   2.999
   60    H    HIS  15           H        HIS  15  -4.529  -7.318   0.760
   61    HA   HIS  15           HA       HIS  15  -3.478  -7.641  -1.231
   62    HB3  HIS  15           2HB      HIS  15  -4.818  -7.826  -3.232
   63    HD1  HIS  15           1HD      HIS  15  -4.423  -9.613  -0.566
   64    HD2  HIS  15           2HD      HIS  15  -7.931  -9.012  -2.709
   65    HE1  HIS  15           1HE      HIS  15  -5.882 -11.590  -0.033
   66    H    CYS  16           H        CYS  16  -3.373  -5.062   0.015
   67    HA   CYS  16           HA       CYS  16  -3.581  -3.058  -2.039
   68    HB3  CYS  16           2HB      CYS  16  -2.199  -1.755  -0.207
   69    H    ILE  17           H        ILE  17  -2.091  -2.514  -3.489
   70    HA   ILE  17           HA       ILE  17   0.210  -3.964  -3.979
   71    HB   ILE  17           HB       ILE  17   0.876  -2.247  -5.521
   72   HG13  ILE  17          2HG1      ILE  17  -0.738  -0.528  -3.721
   73   HG21  ILE  17          1HG2      ILE  17  -1.472  -3.577  -5.647
   74   HG22  ILE  17          2HG2      ILE  17  -2.033  -1.913  -5.809
   75   HG23  ILE  17          3HG2      ILE  17  -0.846  -2.556  -6.942
   76   HD11  ILE  17          3HD1      ILE  17   1.013   0.877  -3.788
   77   HD12  ILE  17          1HD1      ILE  17   1.876  -0.572  -4.301
   78   HD13  ILE  17          2HD1      ILE  17   1.318   0.594  -5.501
   79    H    CYS  18           H        CYS  18   2.433  -3.527  -3.707
   80    HA   CYS  18           HA       CYS  18   3.095  -1.577  -1.607
   81    HB3  CYS  18           2HB      CYS  18   4.898  -3.470  -1.042
   82    H    THR  19           H        THR  19   4.263  -0.098  -2.659
   83    HA   THR  19           HA       THR  19   6.311  -1.015  -4.563
   84    HB   THR  19           HB       THR  19   5.811   1.862  -4.518
   85    HG1  THR  19           1HG      THR  19   3.700   0.170  -5.409
   86   HG21  THR  19          3HG2      THR  19   6.711  -0.097  -6.298
   87   HG22  THR  19          1HG2      THR  19   6.494   1.622  -6.628
   88   HG23  THR  19          2HG2      THR  19   5.191   0.486  -6.977
   89    H    PHE  20           H        PHE  20   8.068   0.936  -4.693
   90    HA   PHE  20           HA       PHE  20   9.674   0.637  -2.430
   91    HB3  PHE  20           2HB      PHE  20  10.579   1.219  -4.629
   92    HD1  PHE  20           2HD      PHE  20   8.973   1.837  -6.348
   93    HD2  PHE  20           1HD      PHE  20  10.341   4.664  -3.474
   94    HE1  PHE  20           2HE      PHE  20   8.098   3.669  -7.738
   95    HE2  PHE  20           1HE      PHE  20   9.468   6.500  -4.860
   96    HZ   PHE  20           HZ       PHE  20   8.344   6.004  -6.994
   97    H    ARG  21           H        ARG  21   7.126   2.861  -3.100
   98    HA   ARG  21           HA       ARG  21   7.907   4.614  -0.894
   99    HB3  ARG  21           2HB      ARG  21   5.681   5.774  -1.733
  100    HG3  ARG  21           2HG      ARG  21   7.172   6.647  -3.781
  101    HD3  ARG  21           2HD      ARG  21   8.370   8.074  -1.967
  102    HE   ARG  21           HE       ARG  21   5.678   8.183  -2.858
  103   HH11  ARG  21          1HH1      ARG  21   7.874   9.541  -0.522
  104   HH12  ARG  21          2HH1      ARG  21   7.018  11.041  -0.395
  105   HH21  ARG  21          1HH2      ARG  21   4.541  10.154  -2.699
  106   HH22  ARG  21          2HH2      ARG  21   5.122  11.389  -1.633
  107    H    GLY  22           H        GLY  22   6.897   1.816  -0.577
  108    HA2  GLY  22           2HA      GLY  22   5.743   0.875   1.224
  109    HA3  GLY  22           3HA      GLY  22   4.966   2.425   1.505
  110    H    CYS  23           H        CYS  23   3.000   1.201   1.792
  111    HA   CYS  23           HA       CYS  23   1.889  -0.082  -0.571
  112    HB3  CYS  23           2HB      CYS  23   0.108  -0.820   0.850
  113    H    GLY  24           H        GLY  24  -0.670   0.436  -0.693
  114    HA2  GLY  24           2HA      GLY  24  -1.418   3.157  -0.320
  115    HA3  GLY  24           3HA      GLY  24  -0.918   2.873  -1.981
  116    H    ALA  25           H        ALA  25  -3.560   3.560  -0.810
  117    HA   ALA  25           HA       ALA  25  -5.115   1.178  -1.527
  118    HB1  ALA  25           1HB      ALA  25  -6.625   3.485  -0.581
  119    HB2  ALA  25           2HB      ALA  25  -6.632   1.813  -0.015
  120    HB3  ALA  25           3HB      ALA  25  -5.401   2.936   0.564
  121    H    VAL  26           H        VAL  26  -7.079   1.506  -2.836
  122    HA   VAL  26           HA       VAL  26  -6.552   2.585  -5.324
  123    HB   VAL  26           HB       VAL  26  -8.991   2.446  -5.757
  124   HG11  VAL  26          1HG1      VAL  26  -7.381   0.468  -5.773
  125   HG12  VAL  26          2HG1      VAL  26  -8.108   0.013  -4.230
  126   HG13  VAL  26          3HG1      VAL  26  -9.104   0.103  -5.684
  127   HG21  VAL  26          3HG2      VAL  26  -9.974   3.139  -3.731
  128   HG22  VAL  26          1HG2      VAL  26 -10.367   1.426  -3.877
  129   HG23  VAL  26          2HG2      VAL  26  -9.077   1.946  -2.792
  130    H    ASN  27           H        ASN  27  -6.686   4.550  -6.226
  131    HA   ASN  27           HA       ASN  27  -6.922   6.802  -6.438
  132    HB3  ASN  27           2HB      ASN  27  -9.299   6.527  -4.594
  133   HD21  ASN  27          1HD2      ASN  27  -8.360   7.915  -7.724
  134   HD22  ASN  27          2HD2      ASN  27  -8.970   9.498  -7.396
  135    H    GLY  28           H        GLY  28  -5.416   5.625  -4.137
  136    HA2  GLY  28           2HA      GLY  28  -4.308   6.337  -2.255
  137    HA3  GLY  28           3HA      GLY  28  -4.492   7.942  -2.945
  138    H    LEU  29           H        LEU  29  -6.302   5.502  -1.095
  139    HA   LEU  29           HA       LEU  29  -7.531   7.715   0.413
  140    HB3  LEU  29           2HB      LEU  29  -9.189   5.505   0.723
  141    HG   LEU  29           HG       LEU  29  -9.697   8.056   0.145
  142   HD11  LEU  29          1HD1      LEU  29  -9.932   6.589  -2.470
  143   HD12  LEU  29          2HD1      LEU  29  -9.044   8.074  -2.128
  144   HD13  LEU  29          3HD1      LEU  29 -10.807   8.079  -2.117
  145   HD21  LEU  29          3HD2      LEU  29 -11.671   5.962  -0.700
  146   HD22  LEU  29          1HD2      LEU  29 -11.961   7.492   0.128
  147   HD23  LEU  29          2HD2      LEU  29 -11.197   6.155   0.988
  148    HA   PRO  30           HA       PRO  30  -6.048   5.945   4.144
  149    HB3  PRO  30           2HB      PRO  30  -7.094   7.658   5.262
  150    HG3  PRO  30           2HG      PRO  30  -9.174   8.442   4.582
  151    HD3  PRO  30           2HD      PRO  30  -8.056   8.486   2.568
  Start of MODEL    4
    1    H1   SER   1           H        SER   1  -7.510   3.185   2.656
    2    HA   SER   1           HA       SER   1  -7.282   0.843   4.119
    3    HB3  SER   1           2HB      SER   1  -6.858   1.123   1.134
    4    HG   SER   1           HG       SER   1  -8.238  -1.027   2.114
    5    H    CYS   2           H        CYS   2  -4.867   2.483   2.127
    6    HA   CYS   2           HA       CYS   2  -2.834   0.644   3.209
    7    HB3  CYS   2           2HB      CYS   2  -1.588   0.825   1.190
    8    H    ASN   3           H        ASN   3  -2.014   1.753   4.897
    9    HA   ASN   3           HA       ASN   3  -0.629   4.247   4.299
   10    HB3  ASN   3           2HB      ASN   3  -2.414   4.044   6.726
   11   HD21  ASN   3          1HD2      ASN   3  -3.196   6.789   6.198
   12   HD22  ASN   3          2HD2      ASN   3  -1.852   7.772   6.660
   13    H    ASN   4           H        ASN   4   0.896   2.243   4.472
   14    HA   ASN   4           HA       ASN   4   2.234   2.482   7.020
   15    HB3  ASN   4           2HB      ASN   4   0.487   0.567   7.158
   16   HD21  ASN   4          1HD2      ASN   4  -0.340  -0.699   5.629
   17   HD22  ASN   4          2HD2      ASN   4   0.539  -1.896   4.746
   18    H    SER   5           H        SER   5   4.222   0.856   6.957
   19    HA   SER   5           HA       SER   5   5.520   1.346   4.376
   20    HB3  SER   5           2HB      SER   5   7.638   0.936   5.631
   21    HG   SER   5           HG       SER   5   7.488   2.853   6.872
   22    H    CYS   6           H        CYS   6   6.388  -0.257   3.145
   23    HA   CYS   6           HA       CYS   6   6.705  -2.940   4.101
   24    HB3  CYS   6           2HB      CYS   6   4.309  -3.011   3.778
   25    H    GLN   7           H        GLN   7   7.182  -4.435   2.128
   26    HA   GLN   7           HA       GLN   7   8.565  -2.922   0.027
   27    HB3  GLN   7           2HB      GLN   7  10.529  -4.318   0.210
   28    HG3  GLN   7           2HG      GLN   7   9.746  -3.350   2.950
   29   HE21  GLN   7          1HE2      GLN   7  11.103  -3.924   4.473
   30   HE22  GLN   7          2HE2      GLN   7  12.757  -4.371   4.257
   31    H    SER   8           H        SER   8   7.430  -6.102   1.110
   32    HA   SER   8           HA       SER   8   6.608  -6.671  -1.645
   33    HB3  SER   8           2HB      SER   8   8.010  -8.723   0.079
   34    HG   SER   8           HG       SER   8   8.216  -9.621  -2.167
   35    H    HIS   9           H        HIS   9   4.679  -5.866  -0.231
   36    HA   HIS   9           HA       HIS   9   2.679  -6.316   0.759
   37    HB3  HIS   9           2HB      HIS   9   1.876  -8.763   0.364
   38    HD1  HIS   9           1HD      HIS   9   2.072  -9.126  -2.822
   39    HD2  HIS   9           2HD      HIS   9   1.190  -5.636  -0.749
   40    HE1  HIS   9           1HE      HIS   9   0.796  -7.686  -4.443
   41    H    SER  10           H        SER  10   5.050  -6.544   2.388
   42    HA   SER  10           HA       SER  10   4.722  -8.815   4.120
   43    HB3  SER  10           2HB      SER  10   6.546  -7.918   5.381
   44    HG   SER  10           HG       SER  10   7.800  -8.325   3.760
   45    H    ASP  11           H        ASP  11   4.192  -5.311   4.455
   46    HA   ASP  11           HA       ASP  11   2.627  -5.806   6.881
   47    HB3  ASP  11           2HB      ASP  11   2.689  -3.292   7.088
   48    H    CYS  12           H        CYS  12   2.331  -4.743   3.578
   49    HA   CYS  12           HA       CYS  12  -0.102  -3.429   3.607
   50    HB3  CYS  12           2HB      CYS  12  -0.321  -4.052   1.265
   51    H    ALA  13           H        ALA  13  -2.229  -4.029   3.560
   52    HA   ALA  13           HA       ALA  13  -2.928  -6.857   3.548
   53    HB1  ALA  13           1HB      ALA  13  -3.150  -5.085   5.923
   54    HB2  ALA  13           2HB      ALA  13  -4.444  -6.246   5.626
   55    HB3  ALA  13           3HB      ALA  13  -2.784  -6.807   5.824
   56    H    SER  14           H        SER  14  -5.336  -7.156   3.554
   57    HA   SER  14           HA       SER  14  -7.349  -6.788   2.563
   58    HB3  SER  14           2HB      SER  14  -8.257  -4.432   2.742
   59    HG   SER  14           HG       SER  14  -7.109  -5.559   5.083
   60    H    HIS  15           H        HIS  15  -5.553  -7.215   0.709
   61    HA   HIS  15           HA       HIS  15  -4.917  -6.859  -1.451
   62    HB3  HIS  15           2HB      HIS  15  -7.420  -5.211  -1.747
   63    HD1  HIS  15           1HD      HIS  15  -5.869  -8.264  -3.420
   64    HD2  HIS  15           2HD      HIS  15  -7.309  -4.476  -4.341
   65    HE1  HIS  15           1HE      HIS  15  -5.700  -8.070  -5.921
   66    H    CYS  16           H        CYS  16  -3.455  -5.266   0.011
   67    HA   CYS  16           HA       CYS  16  -3.660  -2.576  -1.164
   68    HB3  CYS  16           2HB      CYS  16  -1.801  -2.284   0.785
   69    H    ILE  17           H        ILE  17  -2.343  -2.204  -2.808
   70    HA   ILE  17           HA       ILE  17  -0.209  -3.918  -3.528
   71    HB   ILE  17           HB       ILE  17  -1.403  -2.621  -5.209
   72   HG13  ILE  17          2HG1      ILE  17   1.521  -1.878  -4.961
   73   HG21  ILE  17          1HG2      ILE  17  -1.758  -0.415  -5.110
   74   HG22  ILE  17          2HG2      ILE  17  -1.238  -0.546  -3.431
   75   HG23  ILE  17          3HG2      ILE  17  -0.083  -0.073  -4.677
   76   HD11  ILE  17          3HD1      ILE  17   0.262  -4.363  -5.527
   77   HD12  ILE  17          1HD1      ILE  17   1.057  -3.779  -6.988
   78   HD13  ILE  17          2HD1      ILE  17   1.981  -3.968  -5.496
   79    H    CYS  18           H        CYS  18   1.835  -3.961  -2.874
   80    HA   CYS  18           HA       CYS  18   2.844  -1.694  -1.296
   81    HB3  CYS  18           2HB      CYS  18   4.626  -3.597  -0.730
   82    H    THR  19           H        THR  19   4.588  -0.576  -1.939
   83    HA   THR  19           HA       THR  19   6.289  -1.665  -4.060
   84    HB   THR  19           HB       THR  19   6.231   0.421  -5.331
   85    HG1  THR  19           1HG      THR  19   4.726   2.039  -4.757
   86   HG21  THR  19          3HG2      THR  19   3.576  -0.900  -4.812
   87   HG22  THR  19          1HG2      THR  19   4.707  -1.202  -6.131
   88   HG23  THR  19          2HG2      THR  19   3.802   0.311  -6.074
   89    H    PHE  20           H        PHE  20   7.998   0.309  -4.523
   90    HA   PHE  20           HA       PHE  20   9.710   0.322  -2.336
   91    HB3  PHE  20           2HB      PHE  20  10.651   0.741  -4.469
   92    HD1  PHE  20           1HD      PHE  20   9.165   4.097  -3.938
   93    HD2  PHE  20           2HD      PHE  20   9.556   0.739  -6.524
   94    HE1  PHE  20           1HE      PHE  20   8.022   5.344  -5.724
   95    HE2  PHE  20           2HE      PHE  20   8.414   1.982  -8.314
   96    HZ   PHE  20           HZ       PHE  20   7.646   4.287  -7.916
   97    H    ARG  21           H        ARG  21   7.060   2.413  -3.102
   98    HA   ARG  21           HA       ARG  21   7.845   4.323  -1.024
   99    HB3  ARG  21           2HB      ARG  21   7.170   5.385  -3.052
  100    HG3  ARG  21           2HG      ARG  21   4.911   3.456  -3.002
  101    HD3  ARG  21           2HD      ARG  21   3.754   5.583  -2.956
  102    HE   ARG  21           HE       ARG  21   5.814   6.494  -4.744
  103   HH11  ARG  21          1HH1      ARG  21   2.550   6.993  -3.639
  104   HH12  ARG  21          2HH1      ARG  21   2.511   8.663  -4.098
  105   HH21  ARG  21          1HH2      ARG  21   5.774   8.692  -5.354
  106   HH22  ARG  21          2HH2      ARG  21   4.345   9.629  -5.075
  107    H    GLY  22           H        GLY  22   6.894   1.576  -0.467
  108    HA2  GLY  22           2HA      GLY  22   5.694   0.688   1.304
  109    HA3  GLY  22           3HA      GLY  22   5.002   2.278   1.590
  110    H    CYS  23           H        CYS  23   2.988   1.159   1.956
  111    HA   CYS  23           HA       CYS  23   1.739  -0.087  -0.361
  112    HB3  CYS  23           2HB      CYS  23  -0.001  -0.775   1.121
  113    H    GLY  24           H        GLY  24   0.106   0.778  -1.545
  114    HA2  GLY  24           2HA      GLY  24  -0.851   3.459  -0.754
  115    HA3  GLY  24           3HA      GLY  24  -0.343   3.118  -2.402
  116    H    ALA  25           H        ALA  25  -2.964   3.949  -1.168
  117    HA   ALA  25           HA       ALA  25  -4.624   1.714  -2.127
  118    HB1  ALA  25           1HB      ALA  25  -6.361   3.419  -0.877
  119    HB2  ALA  25           2HB      ALA  25  -5.614   2.001  -0.141
  120    HB3  ALA  25           3HB      ALA  25  -4.897   3.595   0.091
  121    H    VAL  26           H        VAL  26  -6.513   2.223  -3.392
  122    HA   VAL  26           HA       VAL  26  -6.034   3.852  -5.581
  123    HB   VAL  26           HB       VAL  26  -8.439   3.635  -6.105
  124   HG11  VAL  26          1HG1      VAL  26  -6.656   1.392  -5.461
  125   HG12  VAL  26          2HG1      VAL  26  -8.360   0.966  -5.636
  126   HG13  VAL  26          3HG1      VAL  26  -7.510   1.772  -6.955
  127   HG21  VAL  26          3HG2      VAL  26  -9.616   3.795  -4.124
  128   HG22  VAL  26          1HG2      VAL  26  -9.687   2.062  -4.445
  129   HG23  VAL  26          2HG2      VAL  26  -8.534   2.695  -3.270
  130    H    ASN  27           H        ASN  27  -6.167   5.969  -5.945
  131    HA   ASN  27           HA       ASN  27  -6.565   8.190  -5.660
  132    HB3  ASN  27           2HB      ASN  27  -8.762   8.859  -4.806
  133   HD21  ASN  27          1HD2      ASN  27  -7.907   8.614  -7.254
  134   HD22  ASN  27          2HD2      ASN  27  -8.995   7.712  -8.247
  135    H    GLY  28           H        GLY  28  -5.228   6.472  -3.517
  136    HA2  GLY  28           2HA      GLY  28  -4.197   6.843  -1.501
  137    HA3  GLY  28           3HA      GLY  28  -4.522   8.549  -1.770
  138    H    LEU  29           H        LEU  29  -6.146   5.558  -0.732
  139    HA   LEU  29           HA       LEU  29  -7.760   7.192   1.112
  140    HB3  LEU  29           2HB      LEU  29  -9.105   4.884   1.076
  141    HG   LEU  29           HG       LEU  29  -9.466   7.360  -0.363
  142   HD11  LEU  29          1HD1      LEU  29 -11.248   5.936  -1.838
  143   HD12  LEU  29          2HD1      LEU  29  -9.842   4.873  -1.865
  144   HD13  LEU  29          3HD1      LEU  29  -9.700   6.536  -2.432
  145   HD21  LEU  29          3HD2      LEU  29 -11.927   6.378   0.005
  146   HD22  LEU  29          1HD2      LEU  29 -10.987   7.124   1.298
  147   HD23  LEU  29          2HD2      LEU  29 -11.043   5.367   1.151
  148    HA   PRO  30           HA       PRO  30  -6.009   5.170   4.591
  149    HB3  PRO  30           2HB      PRO  30  -7.349   6.497   5.905
  150    HG3  PRO  30           2HG      PRO  30  -9.524   7.014   5.264
  151    HD3  PRO  30           2HD      PRO  30  -8.400   7.547   3.322
  Start of MODEL    5
    1    H1   SER   1           H        SER   1  -7.373   4.323   2.878
    2    HA   SER   1           HA       SER   1  -7.651   2.459   4.879
    3    HB3  SER   1           2HB      SER   1  -6.926   1.467   2.156
    4    HG   SER   1           HG       SER   1  -9.351   0.836   3.220
    5    H    CYS   2           H        CYS   2  -5.029   2.445   2.456
    6    HA   CYS   2           HA       CYS   2  -3.389   0.929   4.371
    7    HB3  CYS   2           2HB      CYS   2  -2.035   0.304   2.346
    8    H    ASN   3           H        ASN   3  -1.905   2.073   5.405
    9    HA   ASN   3           HA       ASN   3  -0.336   4.051   3.942
   10    HB3  ASN   3           2HB      ASN   3  -0.762   5.849   5.362
   11   HD21  ASN   3          1HD2      ASN   3  -3.462   4.825   6.946
   12   HD22  ASN   3          2HD2      ASN   3  -4.656   5.231   5.763
   13    H    ASN   4           H        ASN   4   0.677   1.680   4.513
   14    HA   ASN   4           HA       ASN   4   2.498   2.226   6.753
   15    HB3  ASN   4           2HB      ASN   4   1.246   0.575   7.775
   16   HD21  ASN   4          1HD2      ASN   4   1.919  -1.772   5.370
   17   HD22  ASN   4          2HD2      ASN   4   0.289  -2.063   4.880
   18    H    SER   5           H        SER   5   4.599   1.338   6.542
   19    HA   SER   5           HA       SER   5   5.551   1.281   3.851
   20    HB3  SER   5           2HB      SER   5   7.766   0.940   4.865
   21    HG   SER   5           HG       SER   5   7.826   2.894   5.762
   22    H    CYS   6           H        CYS   6   6.682  -0.434   2.813
   23    HA   CYS   6           HA       CYS   6   6.804  -3.066   3.838
   24    HB3  CYS   6           2HB      CYS   6   4.432  -3.164   3.595
   25    H    GLN   7           H        GLN   7   7.044  -4.667   1.830
   26    HA   GLN   7           HA       GLN   7   8.483  -3.309  -0.333
   27    HB3  GLN   7           2HB      GLN   7  10.197  -5.253  -0.101
   28    HG3  GLN   7           2HG      GLN   7  11.464  -4.016   1.709
   29   HE21  GLN   7          1HE2      GLN   7  12.879  -2.431   1.003
   30   HE22  GLN   7          2HE2      GLN   7  12.833  -1.797  -0.603
   31    H    SER   8           H        SER   8   7.243  -6.397   0.902
   32    HA   SER   8           HA       SER   8   6.281  -7.013  -1.797
   33    HB3  SER   8           2HB      SER   8   7.181  -9.197  -1.830
   34    HG   SER   8           HG       SER   8   9.454  -8.404  -0.682
   35    H    HIS   9           H        HIS   9   4.406  -6.133  -0.426
   36    HA   HIS   9           HA       HIS   9   2.450  -6.469   0.698
   37    HB3  HIS   9           2HB      HIS   9   2.576  -9.388   0.064
   38    HD1  HIS   9           1HD      HIS   9   0.271  -7.068  -1.684
   39    HD2  HIS   9           2HD      HIS   9   0.256  -9.484   1.696
   40    HE1  HIS   9           1HE      HIS   9  -2.139  -7.233  -0.986
   41    H    SER  10           H        SER  10   4.927  -6.798   2.202
   42    HA   SER  10           HA       SER  10   4.575  -8.982   4.025
   43    HB3  SER  10           2HB      SER  10   6.346  -7.688   5.357
   44    HG   SER  10           HG       SER  10   7.224  -9.226   4.136
   45    H    ASP  11           H        ASP  11   3.830  -5.538   4.035
   46    HA   ASP  11           HA       ASP  11   2.394  -5.916   6.581
   47    HB3  ASP  11           2HB      ASP  11   2.601  -3.291   6.580
   48    H    CYS  12           H        CYS  12   2.171  -4.997   3.272
   49    HA   CYS  12           HA       CYS  12  -0.190  -3.467   3.339
   50    HB3  CYS  12           2HB      CYS  12  -0.336  -3.868   0.968
   51    H    ALA  13           H        ALA  13  -2.314  -4.148   2.479
   52    HA   ALA  13           HA       ALA  13  -3.046  -6.916   2.591
   53    HB1  ALA  13           1HB      ALA  13  -3.041  -6.733   4.918
   54    HB2  ALA  13           2HB      ALA  13  -3.718  -5.105   4.884
   55    HB3  ALA  13           3HB      ALA  13  -4.731  -6.489   4.477
   56    H    SER  14           H        SER  14  -5.447  -7.189   2.325
   57    HA   SER  14           HA       SER  14  -7.328  -6.800   1.106
   58    HB3  SER  14           2HB      SER  14  -8.151  -4.364   1.142
   59    HG   SER  14           HG       SER  14  -7.860  -4.788   3.756
   60    H    HIS  15           H        HIS  15  -5.161  -7.153  -0.450
   61    HA   HIS  15           HA       HIS  15  -4.264  -6.787  -2.513
   62    HB3  HIS  15           2HB      HIS  15  -5.812  -6.153  -4.254
   63    HD1  HIS  15           1HD      HIS  15  -5.354  -8.819  -2.623
   64    HD2  HIS  15           2HD      HIS  15  -9.033  -7.098  -3.496
   65    HE1  HIS  15           1HE      HIS  15  -7.020 -10.699  -2.510
   66    H    CYS  16           H        CYS  16  -3.128  -5.079  -0.909
   67    HA   CYS  16           HA       CYS  16  -3.353  -2.426  -2.165
   68    HB3  CYS  16           2HB      CYS  16  -1.859  -1.911   0.004
   69    H    ILE  17           H        ILE  17  -1.858  -2.059  -3.655
   70    HA   ILE  17           HA       ILE  17   0.411  -3.592  -4.125
   71    HB   ILE  17           HB       ILE  17  -0.003  -0.693  -4.865
   72   HG13  ILE  17          2HG1      ILE  17  -0.862  -1.559  -6.987
   73   HG21  ILE  17          1HG2      ILE  17   2.069  -2.693  -5.526
   74   HG22  ILE  17          2HG2      ILE  17   1.480  -1.695  -6.855
   75   HG23  ILE  17          3HG2      ILE  17   2.178  -0.935  -5.424
   76   HD11  ILE  17          3HD1      ILE  17  -1.465  -3.912  -7.240
   77   HD12  ILE  17          1HD1      ILE  17   0.281  -3.689  -7.128
   78   HD13  ILE  17          2HD1      ILE  17  -0.623  -4.285  -5.735
   79    H    CYS  18           H        CYS  18   2.506  -3.511  -3.487
   80    HA   CYS  18           HA       CYS  18   3.188  -1.522  -1.421
   81    HB3  CYS  18           2HB      CYS  18   4.960  -3.461  -0.905
   82    H    THR  19           H        THR  19   5.020  -0.356  -1.638
   83    HA   THR  19           HA       THR  19   7.016  -1.121  -3.617
   84    HB   THR  19           HB       THR  19   6.972   1.329  -4.461
   85    HG1  THR  19           1HG      THR  19   4.214   1.183  -3.930
   86   HG21  THR  19          3HG2      THR  19   4.631  -0.340  -5.337
   87   HG22  THR  19          1HG2      THR  19   6.291  -0.824  -5.683
   88   HG23  THR  19          2HG2      THR  19   5.669   0.703  -6.311
   89    H    PHE  20           H        PHE  20   8.751   0.776  -3.658
   90    HA   PHE  20           HA       PHE  20   9.995   0.798  -1.174
   91    HB3  PHE  20           2HB      PHE  20  11.081   1.234  -3.401
   92    HD1  PHE  20           2HD      PHE  20   9.365   2.031  -5.066
   93    HD2  PHE  20           1HD      PHE  20  11.318   4.642  -2.331
   94    HE1  PHE  20           2HE      PHE  20   8.752   3.956  -6.471
   95    HE2  PHE  20           1HE      PHE  20  10.707   6.572  -3.730
   96    HZ   PHE  20           HZ       PHE  20   9.422   6.230  -5.802
   97    H    ARG  21           H        ARG  21   7.561   2.891  -2.465
   98    HA   ARG  21           HA       ARG  21   7.950   4.851  -0.332
   99    HB3  ARG  21           2HB      ARG  21   7.588   5.788  -2.521
  100    HG3  ARG  21           2HG      ARG  21   5.832   3.657  -2.941
  101    HD3  ARG  21           2HD      ARG  21   4.043   5.041  -1.971
  102    HE   ARG  21           HE       ARG  21   4.288   7.277  -2.439
  103   HH11  ARG  21          1HH1      ARG  21   4.414   5.442  -5.395
  104   HH12  ARG  21          2HH1      ARG  21   4.340   6.839  -6.418
  105   HH21  ARG  21          1HH2      ARG  21   4.191   9.123  -3.775
  106   HH22  ARG  21          2HH2      ARG  21   4.214   8.932  -5.495
  107    H    GLY  22           H        GLY  22   7.014   2.139   0.239
  108    HA2  GLY  22           2HA      GLY  22   5.552   1.272   1.808
  109    HA3  GLY  22           3HA      GLY  22   4.787   2.851   1.910
  110    H    CYS  23           H        CYS  23   3.018   1.004   2.070
  111    HA   CYS  23           HA       CYS  23   2.123  -0.114  -0.394
  112    HB3  CYS  23           2HB      CYS  23   0.167  -0.822   0.840
  113    H    GLY  24           H        GLY  24  -0.491   0.339  -0.681
  114    HA2  GLY  24           2HA      GLY  24  -1.108   3.159  -0.629
  115    HA3  GLY  24           3HA      GLY  24  -0.768   2.539  -2.237
  116    H    ALA  25           H        ALA  25  -3.257   3.617  -1.014
  117    HA   ALA  25           HA       ALA  25  -4.994   1.257  -1.287
  118    HB1  ALA  25           1HB      ALA  25  -4.956   3.214   0.669
  119    HB2  ALA  25           2HB      ALA  25  -6.321   3.658  -0.354
  120    HB3  ALA  25           3HB      ALA  25  -6.249   2.052   0.371
  121    H    VAL  26           H        VAL  26  -7.081   1.611  -2.384
  122    HA   VAL  26           HA       VAL  26  -6.770   2.538  -4.985
  123    HB   VAL  26           HB       VAL  26  -9.248   2.424  -5.158
  124   HG11  VAL  26          1HG1      VAL  26  -9.182   0.177  -5.318
  125   HG12  VAL  26          2HG1      VAL  26  -7.472   0.398  -4.942
  126   HG13  VAL  26          3HG1      VAL  26  -8.610  -0.029  -3.664
  127   HG21  VAL  26          3HG2      VAL  26  -9.925   3.220  -3.011
  128   HG22  VAL  26          1HG2      VAL  26 -10.475   1.552  -3.158
  129   HG23  VAL  26          2HG2      VAL  26  -9.048   1.927  -2.192
  130    H    ASN  27           H        ASN  27  -6.945   4.464  -5.951
  131    HA   ASN  27           HA       ASN  27  -7.226   6.698  -6.266
  132    HB3  ASN  27           2HB      ASN  27  -9.207   7.737  -5.414
  133   HD21  ASN  27          1HD2      ASN  27 -10.810   5.096  -4.358
  134   HD22  ASN  27          2HD2      ASN  27 -11.373   4.467  -5.865
  135    H    GLY  28           H        GLY  28  -5.578   5.515  -3.952
  136    HA2  GLY  28           2HA      GLY  28  -4.164   6.332  -2.340
  137    HA3  GLY  28           3HA      GLY  28  -4.410   7.906  -3.082
  138    H    LEU  29           H        LEU  29  -6.230   5.611  -1.045
  139    HA   LEU  29           HA       LEU  29  -7.134   7.919   0.548
  140    HB3  LEU  29           2HB      LEU  29  -8.925   6.086   1.237
  141    HG   LEU  29           HG       LEU  29  -8.968   8.053  -0.941
  142   HD11  LEU  29          1HD1      LEU  29 -10.912   5.750  -0.925
  143   HD12  LEU  29          2HD1      LEU  29  -9.766   6.152  -2.202
  144   HD13  LEU  29          3HD1      LEU  29 -11.106   7.241  -1.847
  145   HD21  LEU  29          3HD2      LEU  29 -11.272   8.381   0.165
  146   HD22  LEU  29          1HD2      LEU  29  -9.828   8.783   1.093
  147   HD23  LEU  29          2HD2      LEU  29 -10.673   7.266   1.394
  148    HA   PRO  30           HA       PRO  30  -5.196   6.266   4.122
  149    HB3  PRO  30           2HB      PRO  30  -5.902   8.147   5.236
  150    HG3  PRO  30           2HG      PRO  30  -7.983   9.089   4.801
  151    HD3  PRO  30           2HD      PRO  30  -7.183   8.884   2.649
  Start of MODEL    6
    1    H1   SER   1           H        SER   1  -7.146   3.662   2.944
    2    HA   SER   1           HA       SER   1  -7.106   2.020   5.182
    3    HB3  SER   1           2HB      SER   1  -7.160   1.426   2.231
    4    HG   SER   1           HG       SER   1  -7.643  -0.553   4.170
    5    H    CYS   2           H        CYS   2  -4.910   1.728   2.384
    6    HA   CYS   2           HA       CYS   2  -2.935   0.477   4.161
    7    HB3  CYS   2           2HB      CYS   2  -1.918  -0.443   2.162
    8    H    ASN   3           H        ASN   3  -2.091   2.368   5.075
    9    HA   ASN   3           HA       ASN   3  -0.468   3.985   3.223
   10    HB3  ASN   3           2HB      ASN   3  -0.775   5.801   5.075
   11   HD21  ASN   3          1HD2      ASN   3  -2.043   7.548   4.468
   12   HD22  ASN   3          2HD2      ASN   3  -2.978   7.546   3.016
   13    H    ASN   4           H        ASN   4   0.614   1.738   4.268
   14    HA   ASN   4           HA       ASN   4   2.438   2.783   6.331
   15    HB3  ASN   4           2HB      ASN   4   1.253   1.172   7.530
   16   HD21  ASN   4          1HD2      ASN   4   2.419  -1.272   5.363
   17   HD22  ASN   4          2HD2      ASN   4   0.873  -1.901   4.915
   18    H    SER   5           H        SER   5   4.436   1.153   6.416
   19    HA   SER   5           HA       SER   5   5.550   1.227   3.721
   20    HB3  SER   5           2HB      SER   5   7.710   0.997   4.777
   21    HG   SER   5           HG       SER   5   7.565   2.760   6.311
   22    H    CYS   6           H        CYS   6   6.728  -0.562   2.840
   23    HA   CYS   6           HA       CYS   6   6.705  -3.148   3.980
   24    HB3  CYS   6           2HB      CYS   6   4.372  -3.253   3.603
   25    H    GLN   7           H        GLN   7   6.901  -4.823   1.953
   26    HA   GLN   7           HA       GLN   7   8.543  -3.610  -0.138
   27    HB3  GLN   7           2HB      GLN   7   9.589  -6.040   1.271
   28    HG3  GLN   7           2HG      GLN   7  11.172  -3.803   0.071
   29   HE21  GLN   7          1HE2      GLN   7  12.822  -5.476  -1.366
   30   HE22  GLN   7          2HE2      GLN   7  13.735  -6.455  -0.274
   31    H    SER   8           H        SER   8   7.248  -6.656   1.161
   32    HA   SER   8           HA       SER   8   6.472  -7.389  -1.580
   33    HB3  SER   8           2HB      SER   8   7.073  -9.714  -1.156
   34    HG   SER   8           HG       SER   8   9.266  -8.107  -0.362
   35    H    HIS   9           H        HIS   9   4.566  -6.212  -0.375
   36    HA   HIS   9           HA       HIS   9   2.481  -6.324   0.540
   37    HB3  HIS   9           2HB      HIS   9   2.367  -9.252  -0.052
   38    HD1  HIS   9           1HD      HIS   9   0.194  -8.830   1.504
   39    HD2  HIS   9           2HD      HIS   9   0.204  -6.986  -2.219
   40    HE1  HIS   9           1HE      HIS   9  -2.200  -8.204   1.057
   41    H    SER  10           H        SER  10   4.751  -6.883   2.291
   42    HA   SER  10           HA       SER  10   4.009  -8.987   4.083
   43    HB3  SER  10           2HB      SER  10   5.863  -8.312   5.404
   44    HG   SER  10           HG       SER  10   6.578  -9.069   3.413
   45    H    ASP  11           H        ASP  11   3.992  -5.433   4.383
   46    HA   ASP  11           HA       ASP  11   2.259  -5.623   6.714
   47    HB3  ASP  11           2HB      ASP  11   2.600  -3.224   6.934
   48    H    CYS  12           H        CYS  12   2.033  -5.081   3.335
   49    HA   CYS  12           HA       CYS  12  -0.329  -3.524   3.269
   50    HB3  CYS  12           2HB      CYS  12  -0.431  -4.058   0.935
   51    H    ALA  13           H        ALA  13  -2.408  -4.348   2.309
   52    HA   ALA  13           HA       ALA  13  -3.139  -7.073   2.577
   53    HB1  ALA  13           1HB      ALA  13  -3.766  -5.244   4.871
   54    HB2  ALA  13           2HB      ALA  13  -4.766  -6.651   4.508
   55    HB3  ALA  13           3HB      ALA  13  -3.060  -6.860   4.903
   56    H    SER  14           H        SER  14  -5.551  -7.357   2.398
   57    HA   SER  14           HA       SER  14  -7.474  -6.990   1.239
   58    HB3  SER  14           2HB      SER  14  -8.371  -4.628   1.301
   59    HG   SER  14           HG       SER  14  -7.547  -5.085   3.894
   60    H    HIS  15           H        HIS  15  -5.473  -7.441  -0.428
   61    HA   HIS  15           HA       HIS  15  -4.650  -7.126  -2.530
   62    HB3  HIS  15           2HB      HIS  15  -6.261  -6.303  -4.191
   63    HD1  HIS  15           1HD      HIS  15  -5.796  -8.977  -2.206
   64    HD2  HIS  15           2HD      HIS  15  -9.264  -7.507  -3.960
   65    HE1  HIS  15           1HE      HIS  15  -7.372 -10.933  -2.320
   66    H    CYS  16           H        CYS  16  -3.334  -5.479  -1.020
   67    HA   CYS  16           HA       CYS  16  -3.434  -2.858  -2.363
   68    HB3  CYS  16           2HB      CYS  16  -2.057  -2.216  -0.194
   69    H    ILE  17           H        ILE  17  -1.685  -2.218  -3.460
   70    HA   ILE  17           HA       ILE  17   0.460  -4.014  -3.924
   71    HB   ILE  17           HB       ILE  17   1.284  -2.479  -5.469
   72   HG13  ILE  17          2HG1      ILE  17   0.709  -0.048  -5.414
   73   HG21  ILE  17          1HG2      ILE  17  -0.496  -2.294  -6.826
   74   HG22  ILE  17          2HG2      ILE  17  -1.353  -3.110  -5.520
   75   HG23  ILE  17          3HG2      ILE  17  -1.419  -1.353  -5.653
   76   HD11  ILE  17          3HD1      ILE  17  -1.342  -0.210  -4.044
   77   HD12  ILE  17          1HD1      ILE  17  -0.337  -0.607  -2.650
   78   HD13  ILE  17          2HD1      ILE  17  -0.176   0.964  -3.435
   79    H    CYS  18           H        CYS  18   2.801  -3.045  -3.864
   80    HA   CYS  18           HA       CYS  18   3.345  -1.483  -1.481
   81    HB3  CYS  18           2HB      CYS  18   5.081  -3.439  -0.915
   82    H    THR  19           H        THR  19   4.898  -0.101  -1.985
   83    HA   THR  19           HA       THR  19   7.035  -0.958  -3.814
   84    HB   THR  19           HB       THR  19   7.024   1.212  -4.926
   85    HG1  THR  19           1HG      THR  19   4.841   1.729  -3.177
   86   HG21  THR  19          3HG2      THR  19   4.644   1.047  -5.936
   87   HG22  THR  19          1HG2      THR  19   4.480  -0.375  -4.907
   88   HG23  THR  19          2HG2      THR  19   5.746  -0.315  -6.132
   89    H    PHE  20           H        PHE  20   8.651   1.147  -3.861
   90    HA   PHE  20           HA       PHE  20  10.000   1.072  -1.425
   91    HB3  PHE  20           2HB      PHE  20  11.245   1.673  -3.351
   92    HD1  PHE  20           1HD      PHE  20   9.661   4.978  -2.893
   93    HD2  PHE  20           2HD      PHE  20  10.348   1.704  -5.524
   94    HE1  PHE  20           1HE      PHE  20   8.752   6.295  -4.763
   95    HE2  PHE  20           2HE      PHE  20   9.441   3.014  -7.398
   96    HZ   PHE  20           HZ       PHE  20   8.641   5.313  -7.019
   97    H    ARG  21           H        ARG  21   7.364   3.044  -2.462
   98    HA   ARG  21           HA       ARG  21   7.720   4.894  -0.221
   99    HB3  ARG  21           2HB      ARG  21   5.486   5.788  -1.422
  100    HG3  ARG  21           2HG      ARG  21   8.085   6.351  -2.790
  101    HD3  ARG  21           2HD      ARG  21   5.677   7.979  -2.000
  102    HE   ARG  21           HE       ARG  21   8.258   8.980  -2.321
  103   HH11  ARG  21          1HH1      ARG  21   5.068   9.484  -3.621
  104   HH12  ARG  21          2HH1      ARG  21   5.337  11.158  -3.981
  105   HH21  ARG  21          1HH2      ARG  21   8.625  11.182  -2.789
  106   HH22  ARG  21          2HH2      ARG  21   7.361  12.122  -3.507
  107    H    GLY  22           H        GLY  22   6.834   2.002  -0.066
  108    HA2  GLY  22           2HA      GLY  22   5.531   0.969   1.573
  109    HA3  GLY  22           3HA      GLY  22   4.666   2.482   1.805
  110    H    CYS  23           H        CYS  23   2.831   0.909   1.881
  111    HA   CYS  23           HA       CYS  23   2.007  -0.278  -0.612
  112    HB3  CYS  23           2HB      CYS  23   0.113  -1.105   0.594
  113    H    GLY  24           H        GLY  24  -0.672   0.154  -0.762
  114    HA2  GLY  24           2HA      GLY  24  -1.333   2.945  -0.661
  115    HA3  GLY  24           3HA      GLY  24  -0.957   2.407  -2.291
  116    H    ALA  25           H        ALA  25  -3.488   3.295  -0.828
  117    HA   ALA  25           HA       ALA  25  -5.158   0.924  -1.229
  118    HB1  ALA  25           1HB      ALA  25  -6.559   3.319  -0.384
  119    HB2  ALA  25           2HB      ALA  25  -6.473   1.730   0.379
  120    HB3  ALA  25           3HB      ALA  25  -5.209   2.924   0.681
  121    H    VAL  26           H        VAL  26  -7.262   1.239  -2.346
  122    HA   VAL  26           HA       VAL  26  -6.900   2.130  -4.971
  123    HB   VAL  26           HB       VAL  26  -9.315   1.818  -5.263
  124   HG11  VAL  26          1HG1      VAL  26  -7.534  -0.097  -4.908
  125   HG12  VAL  26          2HG1      VAL  26  -8.532  -0.442  -3.493
  126   HG13  VAL  26          3HG1      VAL  26  -9.247  -0.462  -5.105
  127   HG21  VAL  26          3HG2      VAL  26 -10.471   0.880  -3.095
  128   HG22  VAL  26          1HG2      VAL  26  -9.271   1.888  -2.286
  129   HG23  VAL  26          2HG2      VAL  26 -10.416   2.613  -3.414
  130    H    ASN  27           H        ASN  27  -7.182   4.032  -5.967
  131    HA   ASN  27           HA       ASN  27  -7.574   6.246  -6.303
  132    HB3  ASN  27           2HB      ASN  27  -9.689   6.124  -4.162
  133   HD21  ASN  27          1HD2      ASN  27 -11.735   6.969  -5.724
  134   HD22  ASN  27          2HD2      ASN  27 -11.418   8.563  -6.312
  135    H    GLY  28           H        GLY  28  -5.766   5.276  -4.124
  136    HA2  GLY  28           2HA      GLY  28  -4.485   6.147  -2.427
  137    HA3  GLY  28           3HA      GLY  28  -4.802   7.694  -3.199
  138    H    LEU  29           H        LEU  29  -6.251   5.347  -0.959
  139    HA   LEU  29           HA       LEU  29  -7.323   7.623   0.568
  140    HB3  LEU  29           2HB      LEU  29  -9.033   5.502   1.088
  141    HG   LEU  29           HG       LEU  29  -9.631   7.956   0.669
  142   HD11  LEU  29          1HD1      LEU  29  -8.809   8.340  -1.500
  143   HD12  LEU  29          2HD1      LEU  29 -10.562   8.280  -1.669
  144   HD13  LEU  29          3HD1      LEU  29  -9.583   6.891  -2.140
  145   HD21  LEU  29          3HD2      LEU  29 -11.884   7.409   0.359
  146   HD22  LEU  29          1HD2      LEU  29 -11.185   5.967   1.095
  147   HD23  LEU  29          2HD2      LEU  29 -11.500   6.005  -0.639
  148    HA   PRO  30           HA       PRO  30  -5.543   5.843   4.161
  149    HB3  PRO  30           2HB      PRO  30  -6.402   7.612   5.350
  150    HG3  PRO  30           2HG      PRO  30  -8.509   8.471   4.867
  151    HD3  PRO  30           2HD      PRO  30  -7.597   8.443   2.749
  Start of MODEL    7
    1    H1   SER   1           H        SER   1  -6.817   3.860   2.356
    2    HA   SER   1           HA       SER   1  -7.569   2.225   4.484
    3    HB3  SER   1           2HB      SER   1  -6.849   1.099   1.787
    4    HG   SER   1           HG       SER   1  -8.408  -0.316   2.264
    5    H    CYS   2           H        CYS   2  -4.686   2.048   2.411
    6    HA   CYS   2           HA       CYS   2  -3.373   0.474   4.520
    7    HB3  CYS   2           2HB      CYS   2  -2.172  -0.769   2.694
    8    H    ASN   3           H        ASN   3  -1.489   1.287   5.170
    9    HA   ASN   3           HA       ASN   3   0.300   2.654   3.396
   10    HB3  ASN   3           2HB      ASN   3  -0.932   4.273   5.634
   11   HD21  ASN   3          1HD2      ASN   3   1.331   4.675   6.173
   12   HD22  ASN   3          2HD2      ASN   3   2.199   5.865   5.271
   13    H    ASN   4           H        ASN   4   1.863   1.228   4.062
   14    HA   ASN   4           HA       ASN   4   2.890   1.668   6.771
   15    HB3  ASN   4           2HB      ASN   4   3.251  -0.696   7.143
   16   HD21  ASN   4          1HD2      ASN   4   0.643  -1.740   5.419
   17   HD22  ASN   4          2HD2      ASN   4  -0.606  -1.405   6.565
   18    H    SER   5           H        SER   5   5.043   0.020   6.754
   19    HA   SER   5           HA       SER   5   6.719   1.279   4.728
   20    HB3  SER   5           2HB      SER   5   7.853  -0.533   6.812
   21    HG   SER   5           HG       SER   5   9.112   1.689   6.802
   22    H    CYS   6           H        CYS   6   4.856  -1.251   4.564
   23    HA   CYS   6           HA       CYS   6   6.326  -3.521   4.037
   24    HB3  CYS   6           2HB      CYS   6   3.879  -3.494   4.056
   25    H    GLN   7           H        GLN   7   7.650  -4.205   2.459
   26    HA   GLN   7           HA       GLN   7   8.151  -2.359   0.225
   27    HB3  GLN   7           2HB      GLN   7  10.319  -3.841   0.103
   28    HG3  GLN   7           2HG      GLN   7  11.392  -2.448   1.927
   29   HE21  GLN   7          1HE2      GLN   7  12.417  -2.187  -0.121
   30   HE22  GLN   7          2HE2      GLN   7  12.037  -0.831  -1.121
   31    H    SER   8           H        SER   8   7.279  -5.611   1.073
   32    HA   SER   8           HA       SER   8   6.737  -6.169  -1.746
   33    HB3  SER   8           2HB      SER   8   8.265  -8.061   0.059
   34    HG   SER   8           HG       SER   8   8.023  -9.514  -1.476
   35    H    HIS   9           H        HIS   9   4.693  -5.510  -0.361
   36    HA   HIS   9           HA       HIS   9   2.661  -6.119   0.462
   37    HB3  HIS   9           2HB      HIS   9   3.225  -8.936  -0.427
   38    HD1  HIS   9           1HD      HIS   9   0.560  -6.490  -1.516
   39    HD2  HIS   9           2HD      HIS   9   0.955  -9.972   0.715
   40    HE1  HIS   9           1HE      HIS   9  -1.789  -7.231  -1.004
   41    H    SER  10           H        SER  10   4.859  -6.208   2.265
   42    HA   SER  10           HA       SER  10   4.643  -8.587   3.868
   43    HB3  SER  10           2HB      SER  10   6.074  -5.956   4.224
   44    HG   SER  10           HG       SER  10   5.946  -8.147   6.025
   45    H    ASP  11           H        ASP  11   4.234  -5.212   4.908
   46    HA   ASP  11           HA       ASP  11   2.399  -5.978   6.969
   47    HB3  ASP  11           2HB      ASP  11   2.156  -3.315   6.966
   48    H    CYS  12           H        CYS  12   2.123  -4.973   3.686
   49    HA   CYS  12           HA       CYS  12  -0.435  -3.840   3.681
   50    HB3  CYS  12           2HB      CYS  12  -0.473  -4.297   1.308
   51    H    ALA  13           H        ALA  13  -2.410  -4.835   2.733
   52    HA   ALA  13           HA       ALA  13  -2.816  -7.625   2.710
   53    HB1  ALA  13           1HB      ALA  13  -2.606  -7.722   5.029
   54    HB2  ALA  13           2HB      ALA  13  -3.466  -6.200   5.266
   55    HB3  ALA  13           3HB      ALA  13  -4.349  -7.642   4.768
   56    H    SER  14           H        SER  14  -5.151  -8.189   2.543
   57    HA   SER  14           HA       SER  14  -7.207  -7.901   1.613
   58    HB3  SER  14           2HB      SER  14  -7.091  -4.978   2.322
   59    HG   SER  14           HG       SER  14  -9.278  -6.576   2.880
   60    H    HIS  15           H        HIS  15  -5.302  -7.982  -0.213
   61    HA   HIS  15           HA       HIS  15  -4.667  -7.382  -2.319
   62    HB3  HIS  15           2HB      HIS  15  -6.570  -6.279  -3.671
   63    HD1  HIS  15           1HD      HIS  15  -6.434  -9.305  -1.418
   64    HD2  HIS  15           2HD      HIS  15  -7.815  -8.209  -5.180
   65    HE1  HIS  15           1HE      HIS  15  -7.127 -11.451  -2.531
   66    H    CYS  16           H        CYS  16  -3.557  -5.706  -0.549
   67    HA   CYS  16           HA       CYS  16  -3.953  -3.010  -1.665
   68    HB3  CYS  16           2HB      CYS  16  -2.510  -2.445   0.481
   69    H    ILE  17           H        ILE  17  -2.525  -2.561  -3.203
   70    HA   ILE  17           HA       ILE  17  -0.144  -3.924  -3.695
   71    HB   ILE  17           HB       ILE  17  -0.826  -1.088  -4.483
   72   HG13  ILE  17          2HG1      ILE  17  -1.612  -2.083  -6.586
   73   HG21  ILE  17          1HG2      ILE  17   0.728  -2.075  -6.473
   74   HG22  ILE  17          2HG2      ILE  17   1.326  -1.097  -5.134
   75   HG23  ILE  17          3HG2      ILE  17   1.447  -2.855  -5.064
   76   HD11  ILE  17          3HD1      ILE  17  -2.013  -4.477  -6.774
   77   HD12  ILE  17          1HD1      ILE  17  -0.291  -4.117  -6.657
   78   HD13  ILE  17          2HD1      ILE  17  -1.158  -4.741  -5.254
   79    H    CYS  18           H        CYS  18   1.963  -3.613  -3.140
   80    HA   CYS  18           HA       CYS  18   2.530  -1.474  -1.194
   81    HB3  CYS  18           2HB      CYS  18   4.331  -3.306  -0.449
   82    H    THR  19           H        THR  19   3.744  -0.036  -2.243
   83    HA   THR  19           HA       THR  19   5.872  -1.017  -4.024
   84    HB   THR  19           HB       THR  19   5.368   1.854  -4.128
   85    HG1  THR  19           1HG      THR  19   3.279   0.140  -5.028
   86   HG21  THR  19          3HG2      THR  19   6.316  -0.186  -5.788
   87   HG22  THR  19          1HG2      THR  19   6.111   1.515  -6.204
   88   HG23  THR  19          2HG2      THR  19   4.817   0.363  -6.538
   89    H    PHE  20           H        PHE  20   7.590   0.999  -4.166
   90    HA   PHE  20           HA       PHE  20   9.149   0.777  -1.867
   91    HB3  PHE  20           2HB      PHE  20  10.244   1.359  -3.889
   92    HD1  PHE  20           1HD      PHE  20   8.895   4.730  -3.196
   93    HD2  PHE  20           2HD      PHE  20   9.174   1.516  -5.973
   94    HE1  PHE  20           1HE      PHE  20   7.898   6.154  -4.937
   95    HE2  PHE  20           2HE      PHE  20   8.179   2.935  -7.719
   96    HZ   PHE  20           HZ       PHE  20   7.538   5.257  -7.202
   97    H    ARG  21           H        ARG  21   6.548   2.918  -2.610
   98    HA   ARG  21           HA       ARG  21   7.222   4.722  -0.413
   99    HB3  ARG  21           2HB      ARG  21   4.870   5.671  -1.315
  100    HG3  ARG  21           2HG      ARG  21   7.361   6.153  -2.918
  101    HD3  ARG  21           2HD      ARG  21   5.057   7.909  -2.081
  102    HE   ARG  21           HE       ARG  21   7.628   8.652  -3.091
  103   HH11  ARG  21          1HH1      ARG  21   4.238   9.444  -3.130
  104   HH12  ARG  21          2HH1      ARG  21   4.499  11.114  -3.514
  105   HH21  ARG  21          1HH2      ARG  21   7.985  10.848  -3.596
  106   HH22  ARG  21          2HH2      ARG  21   6.630  11.910  -3.779
  107    H    GLY  22           H        GLY  22   6.278   1.850  -0.151
  108    HA2  GLY  22           2HA      GLY  22   5.184   0.863   1.668
  109    HA3  GLY  22           3HA      GLY  22   4.373   2.391   1.980
  110    H    CYS  23           H        CYS  23   2.499   0.954   2.295
  111    HA   CYS  23           HA       CYS  23   1.378  -0.311  -0.046
  112    HB3  CYS  23           2HB      CYS  23  -0.407  -1.021   1.394
  113    H    GLY  24           H        GLY  24  -1.015   0.157  -0.526
  114    HA2  GLY  24           2HA      GLY  24  -1.851   2.900  -0.138
  115    HA3  GLY  24           3HA      GLY  24  -1.360   2.524  -1.783
  116    H    ALA  25           H        ALA  25  -3.899   3.381  -1.332
  117    HA   ALA  25           HA       ALA  25  -5.479   0.926  -1.739
  118    HB1  ALA  25           1HB      ALA  25  -6.764   3.385  -0.646
  119    HB2  ALA  25           2HB      ALA  25  -7.221   1.692  -0.452
  120    HB3  ALA  25           3HB      ALA  25  -5.840   2.339   0.435
  121    H    VAL  26           H        VAL  26  -7.766   1.754  -2.696
  122    HA   VAL  26           HA       VAL  26  -7.303   2.427  -5.346
  123    HB   VAL  26           HB       VAL  26  -9.735   2.920  -5.491
  124   HG11  VAL  26          1HG1      VAL  26  -8.603   0.448  -4.327
  125   HG12  VAL  26          2HG1      VAL  26 -10.361   0.598  -4.328
  126   HG13  VAL  26          3HG1      VAL  26  -9.465   0.697  -5.845
  127   HG21  VAL  26          3HG2      VAL  26  -9.566   2.623  -2.501
  128   HG22  VAL  26          1HG2      VAL  26 -10.187   3.990  -3.426
  129   HG23  VAL  26          2HG2      VAL  26 -11.075   2.467  -3.400
  130    H    ASN  27           H        ASN  27  -6.894   4.269  -6.378
  131    HA   ASN  27           HA       ASN  27  -6.568   6.478  -6.810
  132    HB3  ASN  27           2HB      ASN  27  -8.795   6.988  -4.832
  133   HD21  ASN  27          1HD2      ASN  27  -8.894   9.080  -4.504
  134   HD22  ASN  27          2HD2      ASN  27  -8.597  10.314  -5.676
  135    H    GLY  28           H        GLY  28  -5.208   5.151  -4.530
  136    HA2  GLY  28           2HA      GLY  28  -3.759   5.704  -2.837
  137    HA3  GLY  28           3HA      GLY  28  -3.700   7.292  -3.587
  138    H    LEU  29           H        LEU  29  -5.748   5.316  -1.452
  139    HA   LEU  29           HA       LEU  29  -6.313   7.763   0.088
  140    HB3  LEU  29           2HB      LEU  29  -8.421   6.021   0.578
  141    HG   LEU  29           HG       LEU  29  -8.381   8.604   0.038
  142   HD11  LEU  29          1HD1      LEU  29  -9.008   7.305  -2.597
  143   HD12  LEU  29          2HD1      LEU  29  -7.836   8.576  -2.251
  144   HD13  LEU  29          3HD1      LEU  29  -9.563   8.926  -2.182
  145   HD21  LEU  29          3HD2      LEU  29 -10.687   8.577   0.184
  146   HD22  LEU  29          1HD2      LEU  29 -10.258   7.003   0.856
  147   HD23  LEU  29          2HD2      LEU  29 -10.838   7.123  -0.805
  148    HA   PRO  30           HA       PRO  30  -4.985   5.674   3.711
  149    HB3  PRO  30           2HB      PRO  30  -5.491   7.584   4.885
  150    HG3  PRO  30           2HG      PRO  30  -7.376   8.844   4.368
  151    HD3  PRO  30           2HD      PRO  30  -6.456   8.628   2.267
  Start of MODEL    8
    1    H1   SER   1           H        SER   1  -6.985   3.742   2.553
    2    HA   SER   1           HA       SER   1  -7.471   2.081   4.691
    3    HB3  SER   1           2HB      SER   1  -6.717   1.442   1.839
    4    HG   SER   1           HG       SER   1  -6.496  -0.546   2.451
    5    H    CYS   2           H        CYS   2  -4.440   2.877   3.221
    6    HA   CYS   2           HA       CYS   2  -3.084   1.113   5.142
    7    HB3  CYS   2           2HB      CYS   2  -1.284   0.827   3.361
    8    H    ASN   3           H        ASN   3  -1.574   2.095   6.335
    9    HA   ASN   3           HA       ASN   3  -0.414   4.613   5.368
   10    HB3  ASN   3           2HB      ASN   3  -2.254   5.197   6.885
   11   HD21  ASN   3          1HD2      ASN   3  -0.705   5.314   9.675
   12   HD22  ASN   3          2HD2      ASN   3  -1.406   3.969  10.501
   13    H    ASN   4           H        ASN   4   0.537   1.805   5.635
   14    HA   ASN   4           HA       ASN   4   2.713   2.215   7.575
   15    HB3  ASN   4           2HB      ASN   4   1.745   0.215   8.220
   16   HD21  ASN   4          1HD2      ASN   4   2.434  -1.329   5.233
   17   HD22  ASN   4          2HD2      ASN   4   0.805  -1.711   4.801
   18    H    SER   5           H        SER   5   4.688   0.708   6.799
   19    HA   SER   5           HA       SER   5   5.253   1.436   3.999
   20    HB3  SER   5           2HB      SER   5   7.382   2.220   4.536
   21    HG   SER   5           HG       SER   5   7.015   3.354   6.706
   22    H    CYS   6           H        CYS   6   5.565  -0.298   2.789
   23    HA   CYS   6           HA       CYS   6   7.025  -2.581   3.914
   24    HB3  CYS   6           2HB      CYS   6   4.836  -3.402   4.079
   25    H    GLN   7           H        GLN   7   7.800  -4.086   2.196
   26    HA   GLN   7           HA       GLN   7   8.676  -2.524  -0.128
   27    HB3  GLN   7           2HB      GLN   7  10.484  -4.154  -0.336
   28    HG3  GLN   7           2HG      GLN   7  10.579  -2.256   1.416
   29   HE21  GLN   7          1HE2      GLN   7  10.997  -5.495   2.811
   30   HE22  GLN   7          2HE2      GLN   7  10.367  -5.091   4.368
   31    H    SER   8           H        SER   8   7.754  -5.888   0.625
   32    HA   SER   8           HA       SER   8   6.302  -5.983  -1.923
   33    HB3  SER   8           2HB      SER   8   8.358  -7.982  -0.969
   34    HG   SER   8           HG       SER   8   7.487  -8.794  -3.242
   35    H    HIS   9           H        HIS   9   4.437  -5.745  -0.571
   36    HA   HIS   9           HA       HIS   9   2.675  -6.472   0.680
   37    HB3  HIS   9           2HB      HIS   9   3.337  -9.307   0.014
   38    HD1  HIS   9           1HD      HIS   9   0.551  -6.963  -1.063
   39    HD2  HIS   9           2HD      HIS   9   1.153 -10.372   1.235
   40    HE1  HIS   9           1HE      HIS   9  -1.744  -7.721  -0.370
   41    H    SER  10           H        SER  10   5.263  -6.284   2.011
   42    HA   SER  10           HA       SER  10   5.557  -8.488   3.797
   43    HB3  SER  10           2HB      SER  10   6.954  -6.728   5.102
   44    HG   SER  10           HG       SER  10   8.133  -6.805   2.669
   45    H    ASP  11           H        ASP  11   3.965  -5.343   3.978
   46    HA   ASP  11           HA       ASP  11   2.461  -6.302   6.299
   47    HB3  ASP  11           2HB      ASP  11   2.708  -3.789   7.107
   48    H    CYS  12           H        CYS  12   1.926  -5.857   3.410
   49    HA   CYS  12           HA       CYS  12   0.036  -3.634   3.442
   50    HB3  CYS  12           2HB      CYS  12  -0.129  -3.919   1.074
   51    H    ALA  13           H        ALA  13  -2.178  -3.882   2.950
   52    HA   ALA  13           HA       ALA  13  -3.382  -6.463   2.680
   53    HB1  ALA  13           1HB      ALA  13  -3.185  -5.220   5.354
   54    HB2  ALA  13           2HB      ALA  13  -4.746  -5.912   4.914
   55    HB3  ALA  13           3HB      ALA  13  -3.299  -6.919   4.896
   56    H    SER  14           H        SER  14  -5.870  -6.228   2.993
   57    HA   SER  14           HA       SER  14  -7.773  -5.326   2.125
   58    HB3  SER  14           2HB      SER  14  -8.193  -2.929   2.747
   59    HG   SER  14           HG       SER  14  -8.248  -4.885   4.256
   60    H    HIS  15           H        HIS  15  -6.076  -5.777   0.140
   61    HA   HIS  15           HA       HIS  15  -5.567  -5.244  -2.012
   62    HB3  HIS  15           2HB      HIS  15  -7.425  -2.890  -1.848
   63    HD1  HIS  15           1HD      HIS  15  -5.094  -3.983  -3.953
   64    HD2  HIS  15           2HD      HIS  15  -9.228  -3.967  -4.367
   65    HE1  HIS  15           1HE      HIS  15  -5.521  -4.056  -6.430
   66    H    CYS  16           H        CYS  16  -3.508  -4.567  -0.834
   67    HA   CYS  16           HA       CYS  16  -2.875  -1.825  -1.655
   68    HB3  CYS  16           2HB      CYS  16  -1.334  -1.883   0.496
   69    H    ILE  17           H        ILE  17  -1.018  -1.663  -2.753
   70    HA   ILE  17           HA       ILE  17   0.731  -4.031  -2.825
   71    HB   ILE  17           HB       ILE  17  -0.396  -3.404  -4.969
   72   HG13  ILE  17          2HG1      ILE  17   2.625  -3.209  -4.901
   73   HG21  ILE  17          1HG2      ILE  17  -0.229  -1.373  -5.916
   74   HG22  ILE  17          2HG2      ILE  17   0.173  -0.845  -4.283
   75   HG23  ILE  17          3HG2      ILE  17   1.460  -1.178  -5.444
   76   HD11  ILE  17          3HD1      ILE  17   0.927  -5.379  -4.287
   77   HD12  ILE  17          1HD1      ILE  17   1.667  -5.703  -5.855
   78   HD13  ILE  17          2HD1      ILE  17   2.683  -5.367  -4.453
   79    H    CYS  18           H        CYS  18   2.924  -3.814  -2.590
   80    HA   CYS  18           HA       CYS  18   3.865  -1.157  -1.733
   81    HB3  CYS  18           2HB      CYS  18   5.339  -2.195  -0.204
   82    H    THR  19           H        THR  19   5.224  -0.197  -3.076
   83    HA   THR  19           HA       THR  19   7.021  -1.869  -4.706
   84    HB   THR  19           HB       THR  19   5.555   0.628  -5.574
   85    HG1  THR  19           1HG      THR  19   5.467  -2.105  -6.361
   86   HG21  THR  19          3HG2      THR  19   7.755  -0.925  -6.935
   87   HG22  THR  19          1HG2      THR  19   7.773   0.775  -6.466
   88   HG23  THR  19          2HG2      THR  19   6.711   0.229  -7.764
   89    H    PHE  20           H        PHE  20   6.704   1.649  -4.419
   90    HA   PHE  20           HA       PHE  20   9.421   1.724  -3.281
   91    HB3  PHE  20           2HB      PHE  20   9.234   2.457  -5.701
   92    HD1  PHE  20           2HD      PHE  20   6.836   2.759  -6.381
   93    HD2  PHE  20           1HD      PHE  20   9.036   5.761  -4.314
   94    HE1  PHE  20           2HE      PHE  20   5.197   4.449  -7.096
   95    HE2  PHE  20           1HE      PHE  20   7.399   7.455  -5.027
   96    HZ   PHE  20           HZ       PHE  20   5.477   6.800  -6.421
   97    H    ARG  21           H        ARG  21   6.226   3.169  -3.400
   98    HA   ARG  21           HA       ARG  21   6.902   4.951  -1.178
   99    HB3  ARG  21           2HB      ARG  21   5.740   5.994  -3.033
  100    HG3  ARG  21           2HG      ARG  21   4.336   3.642  -3.300
  101    HD3  ARG  21           2HD      ARG  21   2.111   5.479  -3.001
  102    HE   ARG  21           HE       ARG  21   2.057   2.993  -1.576
  103   HH11  ARG  21          1HH1      ARG  21   1.848   4.469  -4.722
  104   HH12  ARG  21          2HH1      ARG  21   0.929   3.174  -5.413
  105   HH21  ARG  21          1HH2      ARG  21   0.846   1.281  -2.475
  106   HH22  ARG  21          2HH2      ARG  21   0.358   1.361  -4.134
  107    H    GLY  22           H        GLY  22   6.652   2.051  -0.846
  108    HA2  GLY  22           2HA      GLY  22   5.846   0.649   0.791
  109    HA3  GLY  22           3HA      GLY  22   5.071   2.048   1.518
  110    H    CYS  23           H        CYS  23   3.325   0.548   2.000
  111    HA   CYS  23           HA       CYS  23   1.784  -0.525  -0.186
  112    HB3  CYS  23           2HB      CYS  23   0.347  -1.445   1.485
  113    H    GLY  24           H        GLY  24  -0.021   0.299  -1.100
  114    HA2  GLY  24           2HA      GLY  24  -1.241   2.682   0.114
  115    HA3  GLY  24           3HA      GLY  24  -0.682   2.765  -1.551
  116    H    ALA  25           H        ALA  25  -3.362   3.178  -0.646
  117    HA   ALA  25           HA       ALA  25  -4.791   0.787  -1.539
  118    HB1  ALA  25           1HB      ALA  25  -6.455   3.064  -0.865
  119    HB2  ALA  25           2HB      ALA  25  -6.446   1.433  -0.195
  120    HB3  ALA  25           3HB      ALA  25  -5.333   2.650   0.431
  121    H    VAL  26           H        VAL  26  -6.875   1.405  -2.859
  122    HA   VAL  26           HA       VAL  26  -6.011   2.258  -5.399
  123    HB   VAL  26           HB       VAL  26  -8.423   2.226  -6.015
  124   HG11  VAL  26          1HG1      VAL  26  -8.633  -0.112  -5.924
  125   HG12  VAL  26          2HG1      VAL  26  -6.893   0.188  -5.901
  126   HG13  VAL  26          3HG1      VAL  26  -7.740  -0.218  -4.409
  127   HG21  VAL  26          3HG2      VAL  26  -8.741   2.503  -3.195
  128   HG22  VAL  26          1HG2      VAL  26  -9.975   2.523  -4.455
  129   HG23  VAL  26          2HG2      VAL  26  -9.503   0.997  -3.706
  130    H    ASN  27           H        ASN  27  -6.103   4.174  -6.441
  131    HA   ASN  27           HA       ASN  27  -6.234   6.424  -6.753
  132    HB3  ASN  27           2HB      ASN  27  -8.314   7.541  -5.820
  133   HD21  ASN  27          1HD2      ASN  27 -10.100   4.852  -6.259
  134   HD22  ASN  27          2HD2      ASN  27 -10.259   4.875  -7.979
  135    H    GLY  28           H        GLY  28  -4.877   5.257  -4.323
  136    HA2  GLY  28           2HA      GLY  28  -3.751   6.020  -2.472
  137    HA3  GLY  28           3HA      GLY  28  -3.867   7.604  -3.226
  138    H    LEU  29           H        LEU  29  -5.672   5.306  -1.217
  139    HA   LEU  29           HA       LEU  29  -6.879   7.614   0.156
  140    HB3  LEU  29           2HB      LEU  29  -8.630   5.471   0.498
  141    HG   LEU  29           HG       LEU  29  -8.940   8.080  -0.251
  142   HD11  LEU  29          1HD1      LEU  29  -8.572   7.771  -2.564
  143   HD12  LEU  29          2HD1      LEU  29 -10.319   7.903  -2.359
  144   HD13  LEU  29          3HD1      LEU  29  -9.578   6.323  -2.607
  145   HD21  LEU  29          3HD2      LEU  29 -10.454   6.221   0.891
  146   HD22  LEU  29          1HD2      LEU  29 -11.234   6.251  -0.691
  147   HD23  LEU  29          2HD2      LEU  29 -11.126   7.729   0.267
  148    HA   PRO  30           HA       PRO  30  -5.511   5.891   3.953
  149    HB3  PRO  30           2HB      PRO  30  -6.460   7.700   5.003
  150    HG3  PRO  30           2HG      PRO  30  -8.487   8.581   4.280
  151    HD3  PRO  30           2HD      PRO  30  -7.356   8.489   2.274
  Start of MODEL    9
    1    H1   SER   1           H        SER   1  -6.540   3.852   2.714
    2    HA   SER   1           HA       SER   1  -7.145   2.439   5.145
    3    HB3  SER   1           2HB      SER   1  -6.577   1.128   2.494
    4    HG   SER   1           HG       SER   1  -8.628   0.054   3.489
    5    H    CYS   2           H        CYS   2  -4.699   1.796   2.629
    6    HA   CYS   2           HA       CYS   2  -2.966   0.668   4.715
    7    HB3  CYS   2           2HB      CYS   2  -1.860  -0.571   2.987
    8    H    ASN   3           H        ASN   3  -1.696   2.226   5.526
    9    HA   ASN   3           HA       ASN   3  -0.046   3.746   3.633
   10    HB3  ASN   3           2HB      ASN   3  -1.059   5.036   6.152
   11   HD21  ASN   3          1HD2      ASN   3  -0.157   6.942   6.411
   12   HD22  ASN   3          2HD2      ASN   3   0.642   7.865   5.189
   13    H    ASN   4           H        ASN   4   1.285   1.798   4.352
   14    HA   ASN   4           HA       ASN   4   2.930   2.636   6.630
   15    HB3  ASN   4           2HB      ASN   4   1.354   0.788   7.312
   16   HD21  ASN   4          1HD2      ASN   4   0.164  -0.642   6.270
   17   HD22  ASN   4          2HD2      ASN   4   0.762  -1.924   5.277
   18    H    SER   5           H        SER   5   4.870   0.793   6.620
   19    HA   SER   5           HA       SER   5   6.077   1.152   3.973
   20    HB3  SER   5           2HB      SER   5   7.517   2.072   5.574
   21    HG   SER   5           HG       SER   5   8.072   0.583   7.458
   22    H    CYS   6           H        CYS   6   6.149  -0.516   2.638
   23    HA   CYS   6           HA       CYS   6   6.629  -3.197   3.689
   24    HB3  CYS   6           2HB      CYS   6   4.231  -3.167   3.576
   25    H    GLN   7           H        GLN   7   7.027  -4.770   1.857
   26    HA   GLN   7           HA       GLN   7   8.250  -3.412  -0.448
   27    HB3  GLN   7           2HB      GLN   7  10.083  -5.097  -0.358
   28    HG3  GLN   7           2HG      GLN   7   9.840  -3.523   2.195
   29   HE21  GLN   7          1HE2      GLN   7  11.962  -2.786   2.940
   30   HE22  GLN   7          2HE2      GLN   7  13.312  -3.851   2.774
   31    H    SER   8           H        SER   8   6.947  -6.428   0.858
   32    HA   SER   8           HA       SER   8   5.945  -7.081  -1.814
   33    HB3  SER   8           2HB      SER   8   7.283  -9.162  -0.075
   34    HG   SER   8           HG       SER   8   6.091 -10.228  -1.506
   35    H    HIS   9           H        HIS   9   4.179  -6.066  -0.303
   36    HA   HIS   9           HA       HIS   9   2.233  -6.321   0.850
   37    HB3  HIS   9           2HB      HIS   9   2.175  -9.233   0.180
   38    HD1  HIS   9           1HD      HIS   9  -0.085  -7.031  -1.654
   39    HD2  HIS   9           2HD      HIS   9  -0.053  -8.945   2.034
   40    HE1  HIS   9           1HE      HIS   9  -2.470  -6.993  -0.856
   41    H    SER  10           H        SER  10   4.759  -6.849   2.252
   42    HA   SER  10           HA       SER  10   4.325  -9.023   4.061
   43    HB3  SER  10           2HB      SER  10   6.191  -7.699   5.361
   44    HG   SER  10           HG       SER  10   7.327  -9.179   4.421
   45    H    ASP  11           H        ASP  11   3.670  -5.580   4.071
   46    HA   ASP  11           HA       ASP  11   2.401  -5.874   6.715
   47    HB3  ASP  11           2HB      ASP  11   2.647  -3.220   6.550
   48    H    CYS  12           H        CYS  12   2.005  -4.948   3.408
   49    HA   CYS  12           HA       CYS  12  -0.399  -3.469   3.680
   50    HB3  CYS  12           2HB      CYS  12  -0.585  -3.630   1.297
   51    H    ALA  13           H        ALA  13  -2.496  -4.204   2.705
   52    HA   ALA  13           HA       ALA  13  -3.098  -6.995   2.638
   53    HB1  ALA  13           1HB      ALA  13  -3.085  -7.043   4.956
   54    HB2  ALA  13           2HB      ALA  13  -3.762  -5.419   5.095
   55    HB3  ALA  13           3HB      ALA  13  -4.786  -6.761   4.582
   56    H    SER  14           H        SER  14  -5.461  -7.377   2.337
   57    HA   SER  14           HA       SER  14  -7.417  -6.967   1.250
   58    HB3  SER  14           2HB      SER  14  -7.112  -4.030   1.829
   59    HG   SER  14           HG       SER  14  -9.449  -4.633   2.404
   60    H    HIS  15           H        HIS  15  -5.363  -7.266  -0.412
   61    HA   HIS  15           HA       HIS  15  -4.535  -6.814  -2.488
   62    HB3  HIS  15           2HB      HIS  15  -6.260  -5.666  -4.033
   63    HD1  HIS  15           1HD      HIS  15  -6.105  -8.648  -1.807
   64    HD2  HIS  15           2HD      HIS  15  -7.857  -7.537  -5.406
   65    HE1  HIS  15           1HE      HIS  15  -6.923 -10.788  -2.846
   66    H    CYS  16           H        CYS  16  -3.485  -5.104  -0.693
   67    HA   CYS  16           HA       CYS  16  -3.673  -2.431  -1.898
   68    HB3  CYS  16           2HB      CYS  16  -2.151  -1.987   0.258
   69    H    ILE  17           H        ILE  17  -2.215  -2.034  -3.418
   70    HA   ILE  17           HA       ILE  17   0.029  -3.528  -4.019
   71    HB   ILE  17           HB       ILE  17  -0.301  -0.569  -4.524
   72   HG13  ILE  17          2HG1      ILE  17  -1.238  -1.276  -6.705
   73   HG21  ILE  17          1HG2      ILE  17   1.579  -2.647  -5.528
   74   HG22  ILE  17          2HG2      ILE  17   1.065  -1.365  -6.623
   75   HG23  ILE  17          3HG2      ILE  17   1.878  -0.960  -5.112
   76   HD11  ILE  17          3HD1      ILE  17  -2.093  -3.900  -5.985
   77   HD12  ILE  17          1HD1      ILE  17  -1.236  -3.362  -7.428
   78   HD13  ILE  17          2HD1      ILE  17  -0.331  -3.830  -5.988
   79    H    CYS  18           H        CYS  18   2.226  -3.335  -3.603
   80    HA   CYS  18           HA       CYS  18   2.985  -1.527  -1.408
   81    HB3  CYS  18           2HB      CYS  18   4.630  -3.577  -0.906
   82    H    THR  19           H        THR  19   4.641  -0.263  -1.905
   83    HA   THR  19           HA       THR  19   6.688  -1.231  -3.768
   84    HB   THR  19           HB       THR  19   6.725   0.918  -4.960
   85    HG1  THR  19           1HG      THR  19   4.585   1.485  -3.194
   86   HG21  THR  19          3HG2      THR  19   4.172  -0.664  -4.938
   87   HG22  THR  19          1HG2      THR  19   5.490  -0.707  -6.108
   88   HG23  THR  19          2HG2      THR  19   4.405   0.683  -6.051
   89    H    PHE  20           H        PHE  20   8.375   0.792  -3.932
   90    HA   PHE  20           HA       PHE  20   9.698   0.835  -1.473
   91    HB3  PHE  20           2HB      PHE  20  10.721   1.246  -3.739
   92    HD1  PHE  20           2HD      PHE  20   8.921   2.019  -5.345
   93    HD2  PHE  20           1HD      PHE  20  11.000   4.663  -2.738
   94    HE1  PHE  20           2HE      PHE  20   8.257   3.923  -6.755
   95    HE2  PHE  20           1HE      PHE  20  10.340   6.572  -4.143
   96    HZ   PHE  20           HZ       PHE  20   8.966   6.204  -6.153
   97    H    ARG  21           H        ARG  21   7.145   2.799  -2.674
   98    HA   ARG  21           HA       ARG  21   7.599   4.879  -0.674
   99    HB3  ARG  21           2HB      ARG  21   5.328   5.664  -1.854
  100    HG3  ARG  21           2HG      ARG  21   7.582   6.070  -3.679
  101    HD3  ARG  21           2HD      ARG  21   6.330   8.177  -1.989
  102    HE   ARG  21           HE       ARG  21   7.741   8.152  -4.430
  103   HH11  ARG  21          1HH1      ARG  21   5.045   9.702  -2.867
  104   HH12  ARG  21          2HH1      ARG  21   5.188  11.166  -3.781
  105   HH21  ARG  21          1HH2      ARG  21   7.940  10.074  -5.642
  106   HH22  ARG  21          2HH2      ARG  21   6.834  11.376  -5.361
  107    H    GLY  22           H        GLY  22   6.716   2.041  -0.110
  108    HA2  GLY  22           2HA      GLY  22   5.454   1.151   1.617
  109    HA3  GLY  22           3HA      GLY  22   4.739   2.736   1.865
  110    H    CYS  23           H        CYS  23   2.918   1.023   2.194
  111    HA   CYS  23           HA       CYS  23   1.721  -0.141  -0.091
  112    HB3  CYS  23           2HB      CYS  23  -0.196  -0.555   1.341
  113    H    GLY  24           H        GLY  24  -0.825   0.487  -0.318
  114    HA2  GLY  24           2HA      GLY  24  -1.541   3.203  -0.241
  115    HA3  GLY  24           3HA      GLY  24  -0.848   2.860  -1.820
  116    H    ALA  25           H        ALA  25  -3.677   3.299  -0.442
  117    HA   ALA  25           HA       ALA  25  -5.136   0.995  -1.365
  118    HB1  ALA  25           1HB      ALA  25  -6.964   1.898  -0.336
  119    HB2  ALA  25           2HB      ALA  25  -5.681   2.705   0.568
  120    HB3  ALA  25           3HB      ALA  25  -6.511   3.555  -0.736
  121    H    VAL  26           H        VAL  26  -7.288   1.732  -2.652
  122    HA   VAL  26           HA       VAL  26  -6.283   2.602  -5.235
  123    HB   VAL  26           HB       VAL  26  -8.430   1.897  -6.128
  124   HG11  VAL  26          1HG1      VAL  26  -6.648   0.190  -4.639
  125   HG12  VAL  26          2HG1      VAL  26  -8.278  -0.486  -4.686
  126   HG13  VAL  26          3HG1      VAL  26  -7.440  -0.093  -6.188
  127   HG21  VAL  26          3HG2      VAL  26 -10.109   2.401  -4.662
  128   HG22  VAL  26          1HG2      VAL  26  -9.930   0.681  -4.321
  129   HG23  VAL  26          2HG2      VAL  26  -9.189   1.872  -3.253
  130    H    ASN  27           H        ASN  27  -6.934   4.402  -6.349
  131    HA   ASN  27           HA       ASN  27  -7.678   6.524  -6.684
  132    HB3  ASN  27           2HB      ASN  27  -9.892   6.059  -4.710
  133   HD21  ASN  27          1HD2      ASN  27  -9.235   6.867  -8.106
  134   HD22  ASN  27          2HD2      ASN  27 -10.202   8.297  -8.128
  135    H    GLY  28           H        GLY  28  -5.815   5.923  -4.498
  136    HA2  GLY  28           2HA      GLY  28  -4.799   6.985  -2.732
  137    HA3  GLY  28           3HA      GLY  28  -5.490   8.452  -3.409
  138    H    LEU  29           H        LEU  29  -6.166   5.731  -1.251
  139    HA   LEU  29           HA       LEU  29  -7.844   7.533   0.349
  140    HB3  LEU  29           2HB      LEU  29  -8.501   4.708  -0.465
  141    HG   LEU  29           HG       LEU  29  -9.188   5.630   1.987
  142   HD11  LEU  29          1HD1      LEU  29 -11.292   6.605   2.037
  143   HD12  LEU  29          2HD1      LEU  29 -11.644   6.171   0.364
  144   HD13  LEU  29          3HD1      LEU  29 -10.491   7.457   0.718
  145   HD21  LEU  29          3HD2      LEU  29 -11.323   4.085   1.446
  146   HD22  LEU  29          1HD2      LEU  29  -9.703   3.449   1.733
  147   HD23  LEU  29          2HD2      LEU  29 -10.284   3.666   0.082
  148    HA   PRO  30           HA       PRO  30  -5.290   6.103   3.649
  149    HB3  PRO  30           2HB      PRO  30  -5.907   8.024   4.747
  150    HG3  PRO  30           2HG      PRO  30  -8.031   8.932   4.476
  151    HD3  PRO  30           2HD      PRO  30  -7.439   8.643   2.268
  Start of MODEL   10
    1    H1   SER   1           H        SER   1  -6.956   3.744   2.754
    2    HA   SER   1           HA       SER   1  -7.301   2.481   5.318
    3    HB3  SER   1           2HB      SER   1  -7.288   1.275   2.539
    4    HG   SER   1           HG       SER   1  -8.788  -0.137   4.073
    5    H    CYS   2           H        CYS   2  -4.859   2.560   2.797
    6    HA   CYS   2           HA       CYS   2  -3.096   0.974   4.545
    7    HB3  CYS   2           2HB      CYS   2  -1.996   0.104   2.508
    8    H    ASN   3           H        ASN   3  -2.160   2.788   5.482
    9    HA   ASN   3           HA       ASN   3  -0.603   4.501   3.658
   10    HB3  ASN   3           2HB      ASN   3  -2.426   5.577   5.099
   11   HD21  ASN   3          1HD2      ASN   3  -0.695   7.105   7.148
   12   HD22  ASN   3          2HD2      ASN   3  -0.940   6.208   8.605
   13    H    ASN   4           H        ASN   4   0.104   1.867   4.850
   14    HA   ASN   4           HA       ASN   4   2.353   2.658   6.567
   15    HB3  ASN   4           2HB      ASN   4   0.889   0.948   7.520
   16   HD21  ASN   4          1HD2      ASN   4   1.041  -1.687   7.437
   17   HD22  ASN   4          2HD2      ASN   4   0.356  -2.320   5.983
   18    H    SER   5           H        SER   5   4.423   1.563   6.217
   19    HA   SER   5           HA       SER   5   5.088   1.548   3.400
   20    HB3  SER   5           2HB      SER   5   7.446   1.133   4.357
   21    HG   SER   5           HG       SER   5   7.090   3.425   5.479
   22    H    CYS   6           H        CYS   6   6.384  -0.168   2.434
   23    HA   CYS   6           HA       CYS   6   6.618  -2.733   3.594
   24    HB3  CYS   6           2HB      CYS   6   4.270  -2.982   3.403
   25    H    GLN   7           H        GLN   7   7.006  -4.431   1.757
   26    HA   GLN   7           HA       GLN   7   8.389  -3.119  -0.485
   27    HB3  GLN   7           2HB      GLN   7   9.992  -5.222  -0.159
   28    HG3  GLN   7           2HG      GLN   7  10.229  -2.760   1.557
   29   HE21  GLN   7          1HE2      GLN   7  11.149  -4.559   2.991
   30   HE22  GLN   7          2HE2      GLN   7  12.836  -4.878   2.802
   31    H    SER   8           H        SER   8   7.203  -6.237   0.755
   32    HA   SER   8           HA       SER   8   6.174  -6.828  -1.926
   33    HB3  SER   8           2HB      SER   8   7.111  -8.978  -2.021
   34    HG   SER   8           HG       SER   8   8.749  -7.427  -2.293
   35    H    HIS   9           H        HIS   9   4.356  -5.936  -0.432
   36    HA   HIS   9           HA       HIS   9   2.408  -6.298   0.688
   37    HB3  HIS   9           2HB      HIS   9   2.524  -9.216   0.069
   38    HD1  HIS   9           1HD      HIS   9   0.474  -9.172   1.756
   39    HD2  HIS   9           2HD      HIS   9  -0.042  -7.003  -1.750
   40    HE1  HIS   9           1HE      HIS   9  -1.997  -8.738   1.592
   41    H    SER  10           H        SER  10   4.979  -6.702   2.096
   42    HA   SER  10           HA       SER  10   4.573  -8.845   3.964
   43    HB3  SER  10           2HB      SER  10   6.463  -6.502   4.247
   44    HG   SER  10           HG       SER  10   7.655  -8.047   5.437
   45    H    ASP  11           H        ASP  11   3.905  -5.412   3.857
   46    HA   ASP  11           HA       ASP  11   2.709  -5.601   6.544
   47    HB3  ASP  11           2HB      ASP  11   3.239  -3.350   6.955
   48    H    CYS  12           H        CYS  12   2.215  -4.833   3.211
   49    HA   CYS  12           HA       CYS  12  -0.157  -3.322   3.431
   50    HB3  CYS  12           2HB      CYS  12  -0.467  -3.757   1.085
   51    H    ALA  13           H        ALA  13  -2.330  -4.037   2.792
   52    HA   ALA  13           HA       ALA  13  -3.010  -6.816   2.963
   53    HB1  ALA  13           1HB      ALA  13  -4.482  -6.498   4.994
   54    HB2  ALA  13           2HB      ALA  13  -2.745  -6.555   5.297
   55    HB3  ALA  13           3HB      ALA  13  -3.589  -5.007   5.296
   56    H    SER  14           H        SER  14  -5.379  -7.154   2.819
   57    HA   SER  14           HA       SER  14  -7.394  -6.771   1.837
   58    HB3  SER  14           2HB      SER  14  -6.908  -3.828   2.327
   59    HG   SER  14           HG       SER  14  -8.927  -3.689   1.800
   60    H    HIS  15           H        HIS  15  -5.449  -7.211   0.071
   61    HA   HIS  15           HA       HIS  15  -4.747  -6.902  -2.076
   62    HB3  HIS  15           2HB      HIS  15  -6.570  -5.794  -3.565
   63    HD1  HIS  15           1HD      HIS  15  -6.032  -8.729  -1.401
   64    HD2  HIS  15           2HD      HIS  15  -8.426  -7.699  -4.637
   65    HE1  HIS  15           1HE      HIS  15  -6.938 -10.902  -2.286
   66    H    CYS  16           H        CYS  16  -3.561  -5.103  -0.472
   67    HA   CYS  16           HA       CYS  16  -3.781  -2.519  -1.858
   68    HB3  CYS  16           2HB      CYS  16  -2.209  -1.890   0.192
   69    H    ILE  17           H        ILE  17  -2.378  -2.290  -3.464
   70    HA   ILE  17           HA       ILE  17  -0.156  -3.853  -3.983
   71    HB   ILE  17           HB       ILE  17  -1.193  -2.363  -5.647
   72   HG13  ILE  17          2HG1      ILE  17   1.754  -1.829  -5.206
   73   HG21  ILE  17          1HG2      ILE  17   0.312  -0.072  -4.433
   74   HG22  ILE  17          2HG2      ILE  17  -0.981  -0.041  -5.632
   75   HG23  ILE  17          3HG2      ILE  17  -1.345  -0.440  -3.953
   76   HD11  ILE  17          3HD1      ILE  17   0.351  -4.235  -5.973
   77   HD12  ILE  17          1HD1      ILE  17   1.472  -3.695  -7.223
   78   HD13  ILE  17          2HD1      ILE  17   2.053  -3.991  -5.584
   79    H    CYS  18           H        CYS  18   2.055  -3.616  -3.670
   80    HA   CYS  18           HA       CYS  18   2.870  -1.612  -1.672
   81    HB3  CYS  18           2HB      CYS  18   4.586  -3.582  -1.094
   82    H    THR  19           H        THR  19   4.668  -0.489  -2.128
   83    HA   THR  19           HA       THR  19   6.561  -1.504  -4.103
   84    HB   THR  19           HB       THR  19   6.560   0.596  -5.380
   85    HG1  THR  19           1HG      THR  19   5.376   2.260  -4.773
   86   HG21  THR  19          3HG2      THR  19   3.777  -0.562  -5.244
   87   HG22  THR  19          1HG2      THR  19   5.132  -1.336  -6.065
   88   HG23  THR  19          2HG2      THR  19   4.538   0.228  -6.625
   89    H    PHE  20           H        PHE  20   8.259   0.488  -4.420
   90    HA   PHE  20           HA       PHE  20   9.704   0.609  -2.042
   91    HB3  PHE  20           2HB      PHE  20  10.757   0.927  -4.218
   92    HD1  PHE  20           2HD      PHE  20   9.312   1.148  -6.147
   93    HD2  PHE  20           1HD      PHE  20  10.157   4.479  -3.635
   94    HE1  PHE  20           2HE      PHE  20   8.444   2.667  -7.876
   95    HE2  PHE  20           1HE      PHE  20   9.289   6.004  -5.361
   96    HZ   PHE  20           HZ       PHE  20   8.432   5.098  -7.485
   97    H    ARG  21           H        ARG  21   7.127   2.595  -3.200
   98    HA   ARG  21           HA       ARG  21   7.667   4.675  -1.219
   99    HB3  ARG  21           2HB      ARG  21   5.450   5.577  -2.347
  100    HG3  ARG  21           2HG      ARG  21   7.032   6.222  -4.416
  101    HD3  ARG  21           2HD      ARG  21   6.087   7.535  -2.320
  102    HE   ARG  21           HE       ARG  21   8.704   6.843  -1.412
  103   HH11  ARG  21          1HH1      ARG  21   6.311   9.372  -1.429
  104   HH12  ARG  21          2HH1      ARG  21   6.878  10.097   0.039
  105   HH21  ARG  21          1HH2      ARG  21   9.459   7.788   0.521
  106   HH22  ARG  21          2HH2      ARG  21   8.668   9.196   1.147
  107    H    GLY  22           H        GLY  22   6.773   1.898  -0.559
  108    HA2  GLY  22           2HA      GLY  22   5.517   1.079   1.211
  109    HA3  GLY  22           3HA      GLY  22   4.770   2.662   1.370
  110    H    CYS  23           H        CYS  23   2.845   1.273   1.753
  111    HA   CYS  23           HA       CYS  23   1.722  -0.029  -0.583
  112    HB3  CYS  23           2HB      CYS  23  -0.049  -0.747   0.863
  113    H    GLY  24           H        GLY  24  -0.814   0.454  -0.769
  114    HA2  GLY  24           2HA      GLY  24  -1.645   3.149  -0.415
  115    HA3  GLY  24           3HA      GLY  24  -1.078   2.895  -2.059
  116    H    ALA  25           H        ALA  25  -3.773   3.516  -1.028
  117    HA   ALA  25           HA       ALA  25  -5.236   1.093  -1.814
  118    HB1  ALA  25           1HB      ALA  25  -6.552   3.537  -0.700
  119    HB2  ALA  25           2HB      ALA  25  -7.060   1.850  -0.608
  120    HB3  ALA  25           3HB      ALA  25  -5.703   2.417   0.366
  121    H    VAL  26           H        VAL  26  -7.498   1.855  -2.846
  122    HA   VAL  26           HA       VAL  26  -6.885   2.715  -5.454
  123    HB   VAL  26           HB       VAL  26  -9.326   2.804  -5.814
  124   HG11  VAL  26          1HG1      VAL  26  -9.699   0.492  -5.626
  125   HG12  VAL  26          2HG1      VAL  26  -7.950   0.660  -5.782
  126   HG13  VAL  26          3HG1      VAL  26  -8.669   0.357  -4.200
  127   HG21  VAL  26          3HG2      VAL  26  -9.388   2.453  -2.830
  128   HG22  VAL  26          1HG2      VAL  26 -10.184   3.685  -3.810
  129   HG23  VAL  26          2HG2      VAL  26 -10.753   2.017  -3.856
  130    H    ASN  27           H        ASN  27  -6.759   4.671  -6.350
  131    HA   ASN  27           HA       ASN  27  -6.707   6.936  -6.565
  132    HB3  ASN  27           2HB      ASN  27  -8.756   8.147  -5.669
  133   HD21  ASN  27          1HD2      ASN  27  -9.949   5.000  -6.497
  134   HD22  ASN  27          2HD2      ASN  27 -10.303   5.345  -8.153
  135    H    GLY  28           H        GLY  28  -5.429   5.661  -4.209
  136    HA2  GLY  28           2HA      GLY  28  -4.212   6.363  -2.392
  137    HA3  GLY  28           3HA      GLY  28  -4.555   8.008  -2.907
  138    H    LEU  29           H        LEU  29  -6.561   5.331  -1.671
  139    HA   LEU  29           HA       LEU  29  -7.933   7.221   0.075
  140    HB3  LEU  29           2HB      LEU  29  -8.459   4.336  -0.612
  141    HG   LEU  29           HG       LEU  29  -9.357   5.385   1.719
  142   HD11  LEU  29          1HD1      LEU  29 -11.902   5.609   0.421
  143   HD12  LEU  29          2HD1      LEU  29 -10.781   6.795  -0.244
  144   HD13  LEU  29          3HD1      LEU  29 -11.089   6.750   1.491
  145   HD21  LEU  29          3HD2      LEU  29 -11.002   3.558  -0.020
  146   HD22  LEU  29          1HD2      LEU  29 -10.928   3.600   1.742
  147   HD23  LEU  29          2HD2      LEU  29  -9.532   3.051   0.814
  148    HA   PRO  30           HA       PRO  30  -5.618   6.064   3.646
  149    HB3  PRO  30           2HB      PRO  30  -6.364   8.031   4.571
  150    HG3  PRO  30           2HG      PRO  30  -8.480   8.862   4.079
  151    HD3  PRO  30           2HD      PRO  30  -7.707   8.456   1.945
  Start of MODEL   11
    1    H1   SER   1           H        SER   1  -7.413   3.898   3.158
    2    HA   SER   1           HA       SER   1  -7.208   2.368   5.491
    3    HB3  SER   1           2HB      SER   1  -7.492   1.304   2.671
    4    HG   SER   1           HG       SER   1  -8.188   0.316   5.232
    5    H    CYS   2           H        CYS   2  -5.270   2.259   2.512
    6    HA   CYS   2           HA       CYS   2  -3.271   0.654   3.962
    7    HB3  CYS   2           2HB      CYS   2  -2.542  -0.223   1.849
    8    H    ASN   3           H        ASN   3  -1.894   2.104   4.832
    9    HA   ASN   3           HA       ASN   3  -0.312   3.705   2.997
   10    HB3  ASN   3           2HB      ASN   3  -1.606   4.997   5.406
   11   HD21  ASN   3          1HD2      ASN   3  -1.348   7.275   5.447
   12   HD22  ASN   3          2HD2      ASN   3   0.022   8.020   4.703
   13    H    ASN   4           H        ASN   4   0.859   1.667   3.916
   14    HA   ASN   4           HA       ASN   4   2.500   2.603   6.162
   15    HB3  ASN   4           2HB      ASN   4   1.242   1.022   7.310
   16   HD21  ASN   4          1HD2      ASN   4   2.327  -1.616   5.444
   17   HD22  ASN   4          2HD2      ASN   4   0.789  -2.113   4.832
   18    H    SER   5           H        SER   5   4.425   0.851   6.351
   19    HA   SER   5           HA       SER   5   5.732   0.977   3.752
   20    HB3  SER   5           2HB      SER   5   7.742   0.185   5.143
   21    HG   SER   5           HG       SER   5   8.086   2.245   5.134
   22    H    CYS   6           H        CYS   6   6.479  -0.768   2.611
   23    HA   CYS   6           HA       CYS   6   6.523  -3.424   3.599
   24    HB3  CYS   6           2HB      CYS   6   4.143  -3.386   3.496
   25    H    GLN   7           H        GLN   7   7.081  -4.998   1.911
   26    HA   GLN   7           HA       GLN   7   8.372  -3.679  -0.386
   27    HB3  GLN   7           2HB      GLN   7   9.281  -6.341   0.624
   28    HG3  GLN   7           2HG      GLN   7  10.899  -4.008  -0.355
   29   HE21  GLN   7          1HE2      GLN   7  12.160  -4.902   1.545
   30   HE22  GLN   7          2HE2      GLN   7  13.251  -6.196   1.203
   31    H    SER   8           H        SER   8   6.843  -6.706   0.677
   32    HA   SER   8           HA       SER   8   5.774  -7.031  -2.034
   33    HB3  SER   8           2HB      SER   8   6.453  -9.268  -2.243
   34    HG   SER   8           HG       SER   8   8.462  -8.746  -2.482
   35    H    HIS   9           H        HIS   9   3.845  -6.205  -1.012
   36    HA   HIS   9           HA       HIS   9   1.914  -6.332   0.235
   37    HB3  HIS   9           2HB      HIS   9   1.433  -7.709  -1.739
   38    HD1  HIS   9           1HD      HIS   9   3.394  -9.149  -2.671
   39    HD2  HIS   9           2HD      HIS   9   1.344 -10.872   0.504
   40    HE1  HIS   9           1HE      HIS   9   4.107 -11.560  -2.641
   41    H    SER  10           H        SER  10   4.101  -6.689   1.910
   42    HA   SER  10           HA       SER  10   3.707  -9.025   3.548
   43    HB3  SER  10           2HB      SER  10   5.418  -6.556   3.914
   44    HG   SER  10           HG       SER  10   6.166  -8.683   5.379
   45    H    ASP  11           H        ASP  11   3.512  -5.535   4.270
   46    HA   ASP  11           HA       ASP  11   1.662  -6.134   6.455
   47    HB3  ASP  11           2HB      ASP  11   2.009  -3.503   6.712
   48    H    CYS  12           H        CYS  12   1.722  -4.860   3.266
   49    HA   CYS  12           HA       CYS  12  -0.410  -3.108   3.217
   50    HB3  CYS  12           2HB      CYS  12  -0.656  -3.669   0.859
   51    H    ALA  13           H        ALA  13  -2.507  -3.284   3.634
   52    HA   ALA  13           HA       ALA  13  -3.655  -5.942   4.023
   53    HB1  ALA  13           1HB      ALA  13  -3.948  -4.352   5.828
   54    HB2  ALA  13           2HB      ALA  13  -4.728  -3.213   4.729
   55    HB3  ALA  13           3HB      ALA  13  -5.510  -4.748   5.109
   56    H    SER  14           H        SER  14  -5.911  -6.306   3.283
   57    HA   SER  14           HA       SER  14  -7.346  -6.623   1.541
   58    HB3  SER  14           2HB      SER  14  -7.963  -4.419   0.324
   59    HG   SER  14           HG       SER  14  -8.368  -3.914   2.979
   60    H    HIS  15           H        HIS  15  -4.555  -7.088   1.013
   61    HA   HIS  15           HA       HIS  15  -3.127  -7.516  -0.708
   62    HB3  HIS  15           2HB      HIS  15  -4.348  -7.741  -3.006
   63    HD1  HIS  15           1HD      HIS  15  -2.790  -9.529  -0.962
   64    HD2  HIS  15           2HD      HIS  15  -6.724 -10.122  -2.161
   65    HE1  HIS  15           1HE      HIS  15  -3.256 -11.966  -0.559
   66    H    CYS  16           H        CYS  16  -3.744  -4.700   0.029
   67    HA   CYS  16           HA       CYS  16  -3.804  -3.052  -2.242
   68    HB3  CYS  16           2HB      CYS  16  -2.549  -1.440  -0.569
   69    H    ILE  17           H        ILE  17  -2.185  -2.024  -3.410
   70    HA   ILE  17           HA       ILE  17   0.044  -3.478  -4.130
   71    HB   ILE  17           HB       ILE  17   0.865  -1.526  -5.268
   72   HG13  ILE  17          2HG1      ILE  17  -0.704  -0.113  -3.185
   73   HG21  ILE  17          1HG2      ILE  17  -2.035  -1.004  -5.501
   74   HG22  ILE  17          2HG2      ILE  17  -0.840  -1.352  -6.749
   75   HG23  ILE  17          3HG2      ILE  17  -1.500  -2.662  -5.771
   76   HD11  ILE  17          3HD1      ILE  17   1.441   1.268  -4.621
   77   HD12  ILE  17          1HD1      ILE  17   1.147   1.106  -2.890
   78   HD13  ILE  17          2HD1      ILE  17   1.934  -0.200  -3.777
   79    H    CYS  18           H        CYS  18   2.354  -2.854  -3.911
   80    HA   CYS  18           HA       CYS  18   3.082  -1.466  -1.468
   81    HB3  CYS  18           2HB      CYS  18   4.606  -3.617  -1.019
   82    H    THR  19           H        THR  19   4.630  -0.133  -2.108
   83    HA   THR  19           HA       THR  19   6.775  -1.179  -3.823
   84    HB   THR  19           HB       THR  19   6.865   0.930  -5.070
   85    HG1  THR  19           1HG      THR  19   5.715   2.599  -4.453
   86   HG21  THR  19          3HG2      THR  19   4.674   0.689  -6.296
   87   HG22  THR  19          1HG2      THR  19   4.211  -0.502  -5.080
   88   HG23  THR  19          2HG2      THR  19   5.605  -0.798  -6.121
   89    H    PHE  20           H        PHE  20   8.508   0.777  -3.963
   90    HA   PHE  20           HA       PHE  20   9.718   0.890  -1.452
   91    HB3  PHE  20           2HB      PHE  20  10.833   1.207  -3.699
   92    HD1  PHE  20           2HD      PHE  20   9.077   2.014  -5.359
   93    HD2  PHE  20           1HD      PHE  20  11.230   4.625  -2.777
   94    HE1  PHE  20           2HE      PHE  20   8.529   3.911  -6.826
   95    HE2  PHE  20           1HE      PHE  20  10.685   6.527  -4.240
   96    HZ   PHE  20           HZ       PHE  20   9.332   6.172  -6.267
   97    H    ARG  21           H        ARG  21   7.278   2.876  -2.852
   98    HA   ARG  21           HA       ARG  21   7.677   5.002  -0.889
   99    HB3  ARG  21           2HB      ARG  21   5.463   5.760  -2.240
  100    HG3  ARG  21           2HG      ARG  21   7.902   6.183  -3.824
  101    HD3  ARG  21           2HD      ARG  21   5.722   7.481  -3.933
  102    HE   ARG  21           HE       ARG  21   6.166   7.940  -1.231
  103   HH11  ARG  21          1HH1      ARG  21   5.515   9.793  -4.105
  104   HH12  ARG  21          2HH1      ARG  21   4.697  11.064  -3.259
  105   HH21  ARG  21          1HH2      ARG  21   5.091   9.608  -0.105
  106   HH22  ARG  21          2HH2      ARG  21   4.457  10.958  -0.983
  107    H    GLY  22           H        GLY  22   6.669   2.195  -0.322
  108    HA2  GLY  22           2HA      GLY  22   5.316   1.440   1.418
  109    HA3  GLY  22           3HA      GLY  22   4.559   3.025   1.481
  110    H    CYS  23           H        CYS  23   2.855   1.070   1.780
  111    HA   CYS  23           HA       CYS  23   1.845  -0.069  -0.624
  112    HB3  CYS  23           2HB      CYS  23  -0.026  -0.810   0.723
  113    H    GLY  24           H        GLY  24  -0.840   0.336  -0.648
  114    HA2  GLY  24           2HA      GLY  24  -1.569   3.097  -0.560
  115    HA3  GLY  24           3HA      GLY  24  -1.196   2.586  -2.200
  116    H    ALA  25           H        ALA  25  -3.741   3.440  -0.892
  117    HA   ALA  25           HA       ALA  25  -5.339   1.002  -1.282
  118    HB1  ALA  25           1HB      ALA  25  -6.924   3.155  -0.307
  119    HB2  ALA  25           2HB      ALA  25  -6.495   1.645   0.497
  120    HB3  ALA  25           3HB      ALA  25  -5.452   3.057   0.660
  121    H    VAL  26           H        VAL  26  -7.617   1.534  -2.173
  122    HA   VAL  26           HA       VAL  26  -7.410   2.274  -4.830
  123    HB   VAL  26           HB       VAL  26  -9.895   2.504  -4.805
  124   HG11  VAL  26          1HG1      VAL  26  -9.545   0.053  -3.255
  125   HG12  VAL  26          2HG1      VAL  26 -10.073   0.275  -4.924
  126   HG13  VAL  26          3HG1      VAL  26  -8.351   0.258  -4.536
  127   HG21  VAL  26          3HG2      VAL  26  -9.463   2.194  -1.845
  128   HG22  VAL  26          1HG2      VAL  26 -10.349   3.460  -2.698
  129   HG23  VAL  26          2HG2      VAL  26 -11.002   1.823  -2.623
  130    H    ASN  27           H        ASN  27  -7.139   4.160  -5.812
  131    HA   ASN  27           HA       ASN  27  -7.051   6.394  -6.225
  132    HB3  ASN  27           2HB      ASN  27  -8.953   7.756  -5.506
  133   HD21  ASN  27          1HD2      ASN  27  -9.238   7.396  -7.716
  134   HD22  ASN  27          2HD2      ASN  27 -10.309   6.176  -8.306
  135    H    GLY  28           H        GLY  28  -5.576   5.256  -3.945
  136    HA2  GLY  28           2HA      GLY  28  -4.285   5.961  -2.180
  137    HA3  GLY  28           3HA      GLY  28  -4.377   7.542  -2.941
  138    H    LEU  29           H        LEU  29  -6.328   5.361  -0.911
  139    HA   LEU  29           HA       LEU  29  -7.257   7.740   0.559
  140    HB3  LEU  29           2HB      LEU  29  -9.068   5.730   1.116
  141    HG   LEU  29           HG       LEU  29  -9.539   8.171   0.481
  142   HD11  LEU  29          1HD1      LEU  29  -8.739   8.491  -1.646
  143   HD12  LEU  29          2HD1      LEU  29 -10.442   8.167  -1.971
  144   HD13  LEU  29          3HD1      LEU  29  -9.243   6.892  -2.196
  145   HD21  LEU  29          3HD2      LEU  29 -11.827   7.636  -0.148
  146   HD22  LEU  29          1HD2      LEU  29 -11.258   6.538   1.110
  147   HD23  LEU  29          2HD2      LEU  29 -11.345   5.992  -0.565
  148    HA   PRO  30           HA       PRO  30  -5.679   6.070   4.296
  149    HB3  PRO  30           2HB      PRO  30  -6.525   7.915   5.370
  150    HG3  PRO  30           2HG      PRO  30  -8.582   8.817   4.767
  151    HD3  PRO  30           2HD      PRO  30  -7.592   8.665   2.691
  Start of MODEL   12
    1    H1   SER   1           H        SER   1  -6.724   3.488   2.445
    2    HA   SER   1           HA       SER   1  -7.757   2.030   4.704
    3    HB3  SER   1           2HB      SER   1  -6.866   1.036   1.985
    4    HG   SER   1           HG       SER   1  -8.545  -0.616   2.737
    5    H    CYS   2           H        CYS   2  -4.696   2.277   2.980
    6    HA   CYS   2           HA       CYS   2  -3.424   0.787   5.174
    7    HB3  CYS   2           2HB      CYS   2  -1.885  -0.254   3.554
    8    H    ASN   3           H        ASN   3  -2.015   2.044   6.182
    9    HA   ASN   3           HA       ASN   3  -0.448   3.967   4.601
   10    HB3  ASN   3           2HB      ASN   3  -2.006   5.373   5.671
   11   HD21  ASN   3          1HD2      ASN   3  -3.205   6.083   7.496
   12   HD22  ASN   3          2HD2      ASN   3  -3.648   4.970   8.741
   13    H    ASN   4           H        ASN   4   0.774   1.726   4.921
   14    HA   ASN   4           HA       ASN   4   2.708   2.225   7.063
   15    HB3  ASN   4           2HB      ASN   4   1.574   0.528   8.154
   16   HD21  ASN   4          1HD2      ASN   4   2.086  -1.970   5.984
   17   HD22  ASN   4          2HD2      ASN   4   0.449  -2.225   5.492
   18    H    SER   5           H        SER   5   4.777   1.157   6.711
   19    HA   SER   5           HA       SER   5   5.498   1.214   3.917
   20    HB3  SER   5           2HB      SER   5   7.793   1.027   4.702
   21    HG   SER   5           HG       SER   5   7.706   3.009   5.372
   22    H    CYS   6           H        CYS   6   6.554  -0.476   2.788
   23    HA   CYS   6           HA       CYS   6   6.815  -3.101   3.853
   24    HB3  CYS   6           2HB      CYS   6   4.446  -3.260   3.711
   25    H    GLN   7           H        GLN   7   7.154  -4.721   1.959
   26    HA   GLN   7           HA       GLN   7   8.468  -3.347  -0.286
   27    HB3  GLN   7           2HB      GLN   7  10.196  -5.239  -0.151
   28    HG3  GLN   7           2HG      GLN   7  10.067  -3.110   1.963
   29   HE21  GLN   7          1HE2      GLN   7  11.566  -3.056   3.489
   30   HE22  GLN   7          2HE2      GLN   7  12.934  -4.106   3.596
   31    H    SER   8           H        SER   8   7.031  -6.328   0.943
   32    HA   SER   8           HA       SER   8   6.002  -6.901  -1.717
   33    HB3  SER   8           2HB      SER   8   7.748  -8.840  -0.183
   34    HG   SER   8           HG       SER   8   7.182  -9.892  -2.454
   35    H    HIS   9           H        HIS   9   4.214  -6.103  -0.205
   36    HA   HIS   9           HA       HIS   9   2.333  -6.501   1.020
   37    HB3  HIS   9           2HB      HIS   9   1.389  -8.867   0.715
   38    HD1  HIS   9           1HD      HIS   9   0.572  -6.093  -0.224
   39    HD2  HIS   9           2HD      HIS   9   1.761  -9.126  -2.802
   40    HE1  HIS   9           1HE      HIS   9  -0.435  -5.512  -2.454
   41    H    SER  10           H        SER  10   4.902  -6.811   2.363
   42    HA   SER  10           HA       SER  10   4.643  -9.029   4.180
   43    HB3  SER  10           2HB      SER  10   6.461  -6.648   4.539
   44    HG   SER  10           HG       SER  10   6.601  -8.058   6.224
   45    H    ASP  11           H        ASP  11   3.980  -5.578   4.225
   46    HA   ASP  11           HA       ASP  11   2.799  -5.890   6.907
   47    HB3  ASP  11           2HB      ASP  11   3.174  -3.492   7.236
   48    H    CYS  12           H        CYS  12   2.269  -4.990   3.619
   49    HA   CYS  12           HA       CYS  12  -0.093  -3.472   3.944
   50    HB3  CYS  12           2HB      CYS  12  -0.415  -3.755   1.582
   51    H    ALA  13           H        ALA  13  -2.254  -4.202   3.104
   52    HA   ALA  13           HA       ALA  13  -2.928  -6.971   3.194
   53    HB1  ALA  13           1HB      ALA  13  -2.853  -7.027   5.479
   54    HB2  ALA  13           2HB      ALA  13  -3.280  -5.323   5.647
   55    HB3  ALA  13           3HB      ALA  13  -4.522  -6.506   5.239
   56    H    SER  14           H        SER  14  -5.294  -7.313   3.010
   57    HA   SER  14           HA       SER  14  -7.300  -6.893   2.023
   58    HB3  SER  14           2HB      SER  14  -6.964  -3.948   2.495
   59    HG   SER  14           HG       SER  14  -9.164  -4.132   2.945
   60    H    HIS  15           H        HIS  15  -5.329  -7.239   0.263
   61    HA   HIS  15           HA       HIS  15  -4.604  -6.827  -1.859
   62    HB3  HIS  15           2HB      HIS  15  -6.369  -5.793  -3.373
   63    HD1  HIS  15           1HD      HIS  15  -5.214  -8.612  -2.919
   64    HD2  HIS  15           2HD      HIS  15  -9.218  -7.615  -2.422
   65    HE1  HIS  15           1HE      HIS  15  -6.481 -10.768  -3.180
   66    H    CYS  16           H        CYS  16  -3.435  -5.101  -0.177
   67    HA   CYS  16           HA       CYS  16  -3.676  -2.451  -1.427
   68    HB3  CYS  16           2HB      CYS  16  -2.080  -1.948   0.657
   69    H    ILE  17           H        ILE  17  -2.277  -2.117  -3.017
   70    HA   ILE  17           HA       ILE  17  -0.060  -3.634  -3.651
   71    HB   ILE  17           HB       ILE  17  -1.139  -1.964  -5.155
   72   HG13  ILE  17          2HG1      ILE  17   1.858  -1.732  -4.799
   73   HG21  ILE  17          1HG2      ILE  17  -1.010   0.277  -4.863
   74   HG22  ILE  17          2HG2      ILE  17  -0.848  -0.193  -3.171
   75   HG23  ILE  17          3HG2      ILE  17   0.587   0.199  -4.120
   76   HD11  ILE  17          3HD1      ILE  17   0.179  -3.602  -6.446
   77   HD12  ILE  17          1HD1      ILE  17   1.908  -3.354  -6.695
   78   HD13  ILE  17          2HD1      ILE  17   1.322  -4.014  -5.167
   79    H    CYS  18           H        CYS  18   2.139  -3.471  -3.293
   80    HA   CYS  18           HA       CYS  18   2.967  -1.630  -1.146
   81    HB3  CYS  18           2HB      CYS  18   4.697  -3.637  -0.767
   82    H    THR  19           H        THR  19   3.905  -0.116  -2.474
   83    HA   THR  19           HA       THR  19   6.067  -1.036  -4.243
   84    HB   THR  19           HB       THR  19   5.930   1.188  -5.308
   85    HG1  THR  19           1HG      THR  19   4.186   2.556  -4.716
   86   HG21  THR  19          3HG2      THR  19   4.477  -0.844  -5.955
   87   HG22  THR  19          1HG2      THR  19   4.036   0.737  -6.599
   88   HG23  THR  19          2HG2      THR  19   3.148   0.063  -5.233
   89    H    PHE  20           H        PHE  20   7.691   1.021  -4.492
   90    HA   PHE  20           HA       PHE  20   9.234   1.008  -2.149
   91    HB3  PHE  20           2HB      PHE  20  10.069   1.423  -4.489
   92    HD1  PHE  20           2HD      PHE  20   8.172   2.214  -5.956
   93    HD2  PHE  20           1HD      PHE  20  10.430   4.836  -3.477
   94    HE1  PHE  20           2HE      PHE  20   7.409   4.132  -7.296
   95    HE2  PHE  20           1HE      PHE  20   9.670   6.758  -4.812
   96    HZ   PHE  20           HZ       PHE  20   8.159   6.407  -6.726
   97    H    ARG  21           H        ARG  21   6.544   2.905  -3.041
   98    HA   ARG  21           HA       ARG  21   7.196   5.037  -1.153
   99    HB3  ARG  21           2HB      ARG  21   5.177   6.140  -2.018
  100    HG3  ARG  21           2HG      ARG  21   6.525   5.163  -4.487
  101    HD3  ARG  21           2HD      ARG  21   6.388   7.461  -5.136
  102    HE   ARG  21           HE       ARG  21   3.762   7.341  -3.984
  103   HH11  ARG  21          1HH1      ARG  21   5.889   5.988  -6.386
  104   HH12  ARG  21          2HH1      ARG  21   4.600   5.439  -7.406
  105   HH21  ARG  21          1HH2      ARG  21   2.057   6.624  -5.319
  106   HH22  ARG  21          2HH2      ARG  21   2.421   5.802  -6.798
  107    H    GLY  22           H        GLY  22   6.500   2.207  -0.404
  108    HA2  GLY  22           2HA      GLY  22   5.459   1.277   1.434
  109    HA3  GLY  22           3HA      GLY  22   4.816   2.867   1.815
  110    H    CYS  23           H        CYS  23   3.181   0.836   2.300
  111    HA   CYS  23           HA       CYS  23   1.586  -0.079   0.178
  112    HB3  CYS  23           2HB      CYS  23  -0.011  -0.740   1.865
  113    H    GLY  24           H        GLY  24  -0.213   0.707  -0.816
  114    HA2  GLY  24           2HA      GLY  24  -1.442   3.166   0.161
  115    HA3  GLY  24           3HA      GLY  24  -0.666   3.250  -1.413
  116    H    ALA  25           H        ALA  25  -3.444   3.684  -0.843
  117    HA   ALA  25           HA       ALA  25  -4.692   1.354  -2.137
  118    HB1  ALA  25           1HB      ALA  25  -6.571   1.724  -0.953
  119    HB2  ALA  25           2HB      ALA  25  -5.482   2.599   0.124
  120    HB3  ALA  25           3HB      ALA  25  -6.431   3.478  -1.076
  121    H    VAL  26           H        VAL  26  -6.561   1.943  -3.614
  122    HA   VAL  26           HA       VAL  26  -5.648   3.328  -5.833
  123    HB   VAL  26           HB       VAL  26  -8.057   3.379  -6.566
  124   HG11  VAL  26          1HG1      VAL  26  -7.367   0.649  -5.553
  125   HG12  VAL  26          2HG1      VAL  26  -8.069   1.122  -7.102
  126   HG13  VAL  26          3HG1      VAL  26  -6.363   1.431  -6.775
  127   HG21  VAL  26          3HG2      VAL  26  -9.038   3.598  -4.316
  128   HG22  VAL  26          1HG2      VAL  26  -9.707   2.232  -5.208
  129   HG23  VAL  26          2HG2      VAL  26  -8.509   1.958  -3.943
  130    H    ASN  27           H        ASN  27  -5.665   5.400  -6.484
  131    HA   ASN  27           HA       ASN  27  -5.855   7.665  -6.413
  132    HB3  ASN  27           2HB      ASN  27  -8.395   7.452  -4.842
  133   HD21  ASN  27          1HD2      ASN  27  -9.411   8.236  -7.682
  134   HD22  ASN  27          2HD2      ASN  27  -9.123   9.940  -7.721
  135    H    GLY  28           H        GLY  28  -4.589   6.200  -4.174
  136    HA2  GLY  28           2HA      GLY  28  -3.638   6.670  -2.138
  137    HA3  GLY  28           3HA      GLY  28  -3.930   8.358  -2.534
  138    H    LEU  29           H        LEU  29  -6.081   5.616  -1.787
  139    HA   LEU  29           HA       LEU  29  -7.584   7.350   0.015
  140    HB3  LEU  29           2HB      LEU  29  -8.117   4.587  -1.059
  141    HG   LEU  29           HG       LEU  29  -9.226   5.397   1.275
  142   HD11  LEU  29          1HD1      LEU  29 -10.391   7.082  -0.640
  143   HD12  LEU  29          2HD1      LEU  29 -10.884   6.848   1.037
  144   HD13  LEU  29          3HD1      LEU  29 -11.612   5.874  -0.239
  145   HD21  LEU  29          3HD2      LEU  29  -9.396   3.182   0.247
  146   HD22  LEU  29          1HD2      LEU  29 -10.588   3.803  -0.894
  147   HD23  LEU  29          2HD2      LEU  29 -10.962   3.748   0.828
  148    HA   PRO  30           HA       PRO  30  -5.692   5.697   3.638
  149    HB3  PRO  30           2HB      PRO  30  -6.474   7.572   4.710
  150    HG3  PRO  30           2HG      PRO  30  -8.502   8.538   4.110
  151    HD3  PRO  30           2HD      PRO  30  -7.521   8.350   2.032
  Start of MODEL   13
    1    H1   SER   1           H        SER   1  -6.902   3.601   2.582
    2    HA   SER   1           HA       SER   1  -7.564   2.193   4.999
    3    HB3  SER   1           2HB      SER   1  -7.828   1.643   2.068
    4    HG   SER   1           HG       SER   1  -8.859  -0.418   3.164
    5    H    CYS   2           H        CYS   2  -5.002   2.092   2.604
    6    HA   CYS   2           HA       CYS   2  -3.547   0.212   4.331
    7    HB3  CYS   2           2HB      CYS   2  -2.753  -1.049   2.453
    8    H    ASN   3           H        ASN   3  -2.656   2.312   5.055
    9    HA   ASN   3           HA       ASN   3  -0.549   3.261   3.225
   10    HB3  ASN   3           2HB      ASN   3  -1.949   4.808   5.417
   11   HD21  ASN   3          1HD2      ASN   3  -1.402   7.014   5.524
   12   HD22  ASN   3          2HD2      ASN   3   0.141   7.581   4.994
   13    H    ASN   4           H        ASN   4   1.008   1.798   3.933
   14    HA   ASN   4           HA       ASN   4   2.284   2.521   6.432
   15    HB3  ASN   4           2HB      ASN   4   0.617   0.659   6.932
   16   HD21  ASN   4          1HD2      ASN   4  -0.352  -0.807   5.711
   17   HD22  ASN   4          2HD2      ASN   4   0.432  -2.116   4.899
   18    H    SER   5           H        SER   5   4.262   0.817   6.675
   19    HA   SER   5           HA       SER   5   5.736   1.128   4.176
   20    HB3  SER   5           2HB      SER   5   6.802   1.964   6.207
   21    HG   SER   5           HG       SER   5   7.349  -0.463   7.316
   22    H    CYS   6           H        CYS   6   5.979  -0.499   2.809
   23    HA   CYS   6           HA       CYS   6   6.383  -3.202   3.767
   24    HB3  CYS   6           2HB      CYS   6   3.995  -3.244   3.665
   25    H    GLN   7           H        GLN   7   6.532  -4.704   1.706
   26    HA   GLN   7           HA       GLN   7   7.812  -3.256  -0.497
   27    HB3  GLN   7           2HB      GLN   7   9.082  -5.731   0.640
   28    HG3  GLN   7           2HG      GLN   7   9.994  -3.511  -1.148
   29   HE21  GLN   7          1HE2      GLN   7  11.614  -2.571   0.055
   30   HE22  GLN   7          2HE2      GLN   7  13.065  -3.404   0.483
   31    H    SER   8           H        SER   8   6.751  -6.432   0.696
   32    HA   SER   8           HA       SER   8   5.686  -6.984  -1.989
   33    HB3  SER   8           2HB      SER   8   6.367  -9.354  -1.742
   34    HG   SER   8           HG       SER   8   7.815  -7.537  -2.576
   35    H    HIS   9           H        HIS   9   3.942  -5.963  -0.392
   36    HA   HIS   9           HA       HIS   9   1.973  -6.238   0.718
   37    HB3  HIS   9           2HB      HIS   9   0.869  -8.542   0.315
   38    HD1  HIS   9           1HD      HIS   9   2.635  -6.660  -2.497
   39    HD2  HIS   9           2HD      HIS   9  -1.182  -7.620  -1.164
   40    HE1  HIS   9           1HE      HIS   9   1.061  -5.638  -4.171
   41    H    SER  10           H        SER  10   4.525  -6.936   2.068
   42    HA   SER  10           HA       SER  10   4.053  -9.152   3.791
   43    HB3  SER  10           2HB      SER  10   5.981  -8.300   5.067
   44    HG   SER  10           HG       SER  10   6.573  -9.405   3.246
   45    H    ASP  11           H        ASP  11   3.574  -5.663   4.083
   46    HA   ASP  11           HA       ASP  11   2.176  -6.124   6.634
   47    HB3  ASP  11           2HB      ASP  11   2.497  -3.533   6.796
   48    H    CYS  12           H        CYS  12   1.888  -4.955   3.393
   49    HA   CYS  12           HA       CYS  12  -0.335  -3.308   3.545
   50    HB3  CYS  12           2HB      CYS  12  -0.730  -3.848   1.207
   51    H    ALA  13           H        ALA  13  -2.485  -3.601   3.767
   52    HA   ALA  13           HA       ALA  13  -3.401  -6.336   4.331
   53    HB1  ALA  13           1HB      ALA  13  -5.298  -5.223   5.492
   54    HB2  ALA  13           2HB      ALA  13  -3.720  -4.846   6.184
   55    HB3  ALA  13           3HB      ALA  13  -4.536  -3.668   5.156
   56    H    SER  14           H        SER  14  -5.681  -6.823   3.725
   57    HA   SER  14           HA       SER  14  -7.190  -7.217   2.064
   58    HB3  SER  14           2HB      SER  14  -7.066  -4.339   1.249
   59    HG   SER  14           HG       SER  14  -9.383  -4.693   1.464
   60    H    HIS  15           H        HIS  15  -4.426  -7.538   1.367
   61    HA   HIS  15           HA       HIS  15  -3.075  -7.870  -0.436
   62    HB3  HIS  15           2HB      HIS  15  -4.420  -8.134  -2.663
   63    HD1  HIS  15           1HD      HIS  15  -2.597  -9.879  -0.893
   64    HD2  HIS  15           2HD      HIS  15  -6.627 -10.636  -1.566
   65    HE1  HIS  15           1HE      HIS  15  -2.901 -12.338  -0.464
   66    H    CYS  16           H        CYS  16  -3.771  -5.100   0.370
   67    HA   CYS  16           HA       CYS  16  -4.030  -3.457  -1.908
   68    HB3  CYS  16           2HB      CYS  16  -2.883  -1.747  -0.277
   69    H    ILE  17           H        ILE  17  -2.502  -2.309  -3.094
   70    HA   ILE  17           HA       ILE  17  -0.196  -3.612  -3.863
   71    HB   ILE  17           HB       ILE  17   0.475  -1.608  -5.006
   72   HG13  ILE  17          2HG1      ILE  17  -1.141  -0.306  -2.886
   73   HG21  ILE  17          1HG2      ILE  17  -2.098  -2.749  -5.196
   74   HG22  ILE  17          2HG2      ILE  17  -2.281  -1.014  -5.447
   75   HG23  ILE  17          3HG2      ILE  17  -1.171  -1.938  -6.457
   76   HD11  ILE  17          3HD1      ILE  17   0.929   1.148  -4.396
   77   HD12  ILE  17          1HD1      ILE  17   0.606   1.097  -2.664
   78   HD13  ILE  17          2HD1      ILE  17   1.471  -0.230  -3.439
   79    H    CYS  18           H        CYS  18   2.069  -2.904  -3.658
   80    HA   CYS  18           HA       CYS  18   2.770  -1.427  -1.262
   81    HB3  CYS  18           2HB      CYS  18   4.369  -3.511  -0.757
   82    H    THR  19           H        THR  19   4.293  -0.079  -1.925
   83    HA   THR  19           HA       THR  19   6.442  -1.102  -3.647
   84    HB   THR  19           HB       THR  19   6.461   0.967  -4.949
   85    HG1  THR  19           1HG      THR  19   4.314   1.629  -3.226
   86   HG21  THR  19          3HG2      THR  19   4.255   0.667  -6.126
   87   HG22  THR  19          1HG2      THR  19   3.823  -0.489  -4.868
   88   HG23  THR  19          2HG2      THR  19   5.201  -0.807  -5.922
   89    H    PHE  20           H        PHE  20   8.078   0.968  -3.861
   90    HA   PHE  20           HA       PHE  20   9.385   1.123  -1.412
   91    HB3  PHE  20           2HB      PHE  20  10.604   1.545  -3.434
   92    HD1  PHE  20           1HD      PHE  20   9.311   4.972  -3.075
   93    HD2  PHE  20           2HD      PHE  20   9.544   1.522  -5.557
   94    HE1  PHE  20           1HE      PHE  20   8.429   6.277  -4.965
   95    HE2  PHE  20           2HE      PHE  20   8.663   2.822  -7.452
   96    HZ   PHE  20           HZ       PHE  20   8.104   5.202  -7.157
   97    H    ARG  21           H        ARG  21   6.785   3.021  -2.676
   98    HA   ARG  21           HA       ARG  21   7.108   5.062  -0.610
   99    HB3  ARG  21           2HB      ARG  21   4.936   5.914  -1.846
  100    HG3  ARG  21           2HG      ARG  21   6.589   6.672  -3.807
  101    HD3  ARG  21           2HD      ARG  21   7.078   7.744  -1.056
  102    HE   ARG  21           HE       ARG  21   7.957   9.307  -2.484
  103   HH11  ARG  21          1HH1      ARG  21   4.845   8.288  -3.664
  104   HH12  ARG  21          2HH1      ARG  21   4.768   9.505  -4.896
  105   HH21  ARG  21          1HH2      ARG  21   7.867  10.914  -4.100
  106   HH22  ARG  21          2HH2      ARG  21   6.488  10.997  -5.143
  107    H    GLY  22           H        GLY  22   6.304   2.236  -0.072
  108    HA2  GLY  22           2HA      GLY  22   4.992   1.354   1.635
  109    HA3  GLY  22           3HA      GLY  22   4.104   2.869   1.700
  110    H    CYS  23           H        CYS  23   2.279   1.317   1.939
  111    HA   CYS  23           HA       CYS  23   1.471  -0.028  -0.513
  112    HB3  CYS  23           2HB      CYS  23  -0.266  -1.040   0.786
  113    H    GLY  24           H        GLY  24  -1.073   0.167  -0.858
  114    HA2  GLY  24           2HA      GLY  24  -2.135   2.814  -0.455
  115    HA3  GLY  24           3HA      GLY  24  -1.622   2.520  -2.110
  116    H    ALA  25           H        ALA  25  -4.307   2.877  -0.673
  117    HA   ALA  25           HA       ALA  25  -5.655   0.374  -1.212
  118    HB1  ALA  25           1HB      ALA  25  -6.720   3.059  -0.345
  119    HB2  ALA  25           2HB      ALA  25  -7.683   1.587  -0.494
  120    HB3  ALA  25           3HB      ALA  25  -6.379   1.671   0.690
  121    H    VAL  26           H        VAL  26  -6.655   3.632  -2.205
  122    HA   VAL  26           HA       VAL  26  -6.666   2.831  -5.006
  123    HB   VAL  26           HB       VAL  26  -9.059   3.753  -5.193
  124   HG11  VAL  26          1HG1      VAL  26  -9.953   1.597  -5.083
  125   HG12  VAL  26          2HG1      VAL  26  -8.234   1.332  -5.380
  126   HG13  VAL  26          3HG1      VAL  26  -8.892   1.126  -3.757
  127   HG21  VAL  26          3HG2      VAL  26  -9.009   3.055  -2.259
  128   HG22  VAL  26          1HG2      VAL  26  -9.247   4.660  -2.951
  129   HG23  VAL  26          2HG2      VAL  26 -10.458   3.403  -3.200
  130    H    ASN  27           H        ASN  27  -5.637   4.439  -5.984
  131    HA   ASN  27           HA       ASN  27  -4.940   6.517  -6.589
  132    HB3  ASN  27           2HB      ASN  27  -6.751   8.364  -6.198
  133   HD21  ASN  27          1HD2      ASN  27  -7.289   8.972  -8.161
  134   HD22  ASN  27          2HD2      ASN  27  -7.546   7.929  -9.515
  135    H    GLY  28           H        GLY  28  -4.605   5.520  -3.754
  136    HA2  GLY  28           2HA      GLY  28  -3.235   6.410  -2.077
  137    HA3  GLY  28           3HA      GLY  28  -3.544   8.021  -2.710
  138    H    LEU  29           H        LEU  29  -5.688   5.433  -1.528
  139    HA   LEU  29           HA       LEU  29  -6.994   7.426   0.186
  140    HB3  LEU  29           2HB      LEU  29  -7.918   4.748  -0.837
  141    HG   LEU  29           HG       LEU  29  -8.850   5.721   1.512
  142   HD11  LEU  29          1HD1      LEU  29 -10.876   6.908   1.206
  143   HD12  LEU  29          2HD1      LEU  29 -10.800   6.728  -0.546
  144   HD13  LEU  29          3HD1      LEU  29  -9.644   7.770   0.284
  145   HD21  LEU  29          3HD2      LEU  29 -10.528   4.334  -0.575
  146   HD22  LEU  29          1HD2      LEU  29 -10.751   4.282   1.174
  147   HD23  LEU  29          2HD2      LEU  29  -9.326   3.539   0.444
  148    HA   PRO  30           HA       PRO  30  -5.248   5.572   3.785
  149    HB3  PRO  30           2HB      PRO  30  -5.747   7.546   4.851
  150    HG3  PRO  30           2HG      PRO  30  -7.643   8.768   4.286
  151    HD3  PRO  30           2HD      PRO  30  -6.748   8.429   2.189
  Start of MODEL   14
    1    H1   SER   1           H        SER   1  -7.106   3.786   2.924
    2    HA   SER   1           HA       SER   1  -7.338   2.227   5.264
    3    HB3  SER   1           2HB      SER   1  -6.948   1.084   2.500
    4    HG   SER   1           HG       SER   1  -7.790  -0.620   3.392
    5    H    CYS   2           H        CYS   2  -5.072   1.686   2.563
    6    HA   CYS   2           HA       CYS   2  -3.203   0.468   4.466
    7    HB3  CYS   2           2HB      CYS   2  -2.186  -0.626   2.597
    8    H    ASN   3           H        ASN   3  -2.178   2.226   5.360
    9    HA   ASN   3           HA       ASN   3  -0.496   3.779   3.511
   10    HB3  ASN   3           2HB      ASN   3  -0.808   5.770   4.852
   11   HD21  ASN   3          1HD2      ASN   3  -1.786   6.678   3.160
   12   HD22  ASN   3          2HD2      ASN   3  -3.453   6.480   2.755
   13    H    ASN   4           H        ASN   4   0.759   1.720   4.300
   14    HA   ASN   4           HA       ASN   4   2.437   2.602   6.546
   15    HB3  ASN   4           2HB      ASN   4   1.330   0.889   7.635
   16   HD21  ASN   4          1HD2      ASN   4   2.341  -1.590   5.540
   17   HD22  ASN   4          2HD2      ASN   4   0.781  -2.066   4.969
   18    H    SER   5           H        SER   5   4.452   0.955   6.567
   19    HA   SER   5           HA       SER   5   5.637   1.258   3.914
   20    HB3  SER   5           2HB      SER   5   7.755   1.140   4.970
   21    HG   SER   5           HG       SER   5   6.924   3.073   5.560
   22    H    CYS   6           H        CYS   6   6.421  -0.408   2.703
   23    HA   CYS   6           HA       CYS   6   6.695  -3.070   3.705
   24    HB3  CYS   6           2HB      CYS   6   4.312  -3.166   3.549
   25    H    GLN   7           H        GLN   7   6.834  -4.618   1.629
   26    HA   GLN   7           HA       GLN   7   8.178  -3.206  -0.555
   27    HB3  GLN   7           2HB      GLN   7   9.447  -5.660   0.615
   28    HG3  GLN   7           2HG      GLN   7  10.147  -4.675  -1.616
   29   HE21  GLN   7          1HE2      GLN   7  10.639  -2.921  -2.717
   30   HE22  GLN   7          2HE2      GLN   7  11.195  -1.426  -2.053
   31    H    SER   8           H        SER   8   7.147  -6.383   0.668
   32    HA   SER   8           HA       SER   8   6.110  -6.981  -2.018
   33    HB3  SER   8           2HB      SER   8   8.214  -8.209  -1.741
   34    HG   SER   8           HG       SER   8   8.553  -8.650   0.320
   35    H    HIS   9           H        HIS   9   4.273  -6.023  -0.584
   36    HA   HIS   9           HA       HIS   9   2.314  -6.316   0.544
   37    HB3  HIS   9           2HB      HIS   9   2.460  -9.198  -0.327
   38    HD1  HIS   9           1HD      HIS   9  -0.115  -6.509  -0.989
   39    HD2  HIS   9           2HD      HIS   9   0.308 -10.056   1.133
   40    HE1  HIS   9           1HE      HIS   9  -2.412  -7.049  -0.119
   41    H    SER  10           H        SER  10   4.791  -6.791   2.015
   42    HA   SER  10           HA       SER  10   4.383  -9.015   3.770
   43    HB3  SER  10           2HB      SER  10   6.203  -7.882   5.125
   44    HG   SER  10           HG       SER  10   7.696  -8.599   3.745
   45    H    ASP  11           H        ASP  11   3.751  -5.547   3.924
   46    HA   ASP  11           HA       ASP  11   2.330  -5.972   6.470
   47    HB3  ASP  11           2HB      ASP  11   2.644  -3.577   6.897
   48    H    CYS  12           H        CYS  12   2.038  -5.000   3.178
   49    HA   CYS  12           HA       CYS  12  -0.285  -3.445   3.276
   50    HB3  CYS  12           2HB      CYS  12  -0.542  -3.946   0.925
   51    H    ALA  13           H        ALA  13  -2.471  -3.946   2.990
   52    HA   ALA  13           HA       ALA  13  -3.226  -6.767   3.304
   53    HB1  ALA  13           1HB      ALA  13  -4.132  -4.469   5.019
   54    HB2  ALA  13           2HB      ALA  13  -5.015  -5.993   4.917
   55    HB3  ALA  13           3HB      ALA  13  -3.359  -5.972   5.524
   56    H    SER  14           H        SER  14  -5.590  -7.108   2.894
   57    HA   SER  14           HA       SER  14  -7.334  -7.035   1.433
   58    HB3  SER  14           2HB      SER  14  -8.266  -4.732   0.967
   59    HG   SER  14           HG       SER  14  -9.168  -5.304   2.783
   60    H    HIS  15           H        HIS  15  -4.813  -7.419   0.274
   61    HA   HIS  15           HA       HIS  15  -3.730  -7.412  -1.729
   62    HB3  HIS  15           2HB      HIS  15  -5.119  -7.320  -3.729
   63    HD1  HIS  15           1HD      HIS  15  -4.486  -9.511  -1.484
   64    HD2  HIS  15           2HD      HIS  15  -8.182  -8.706  -3.202
   65    HE1  HIS  15           1HE      HIS  15  -5.833 -11.615  -1.197
   66    H    CYS  16           H        CYS  16  -3.267  -5.142  -0.305
   67    HA   CYS  16           HA       CYS  16  -3.618  -2.872  -2.104
   68    HB3  CYS  16           2HB      CYS  16  -2.251  -1.791  -0.088
   69    H    ILE  17           H        ILE  17  -2.051  -2.055  -3.355
   70    HA   ILE  17           HA       ILE  17   0.221  -3.463  -4.039
   71    HB   ILE  17           HB       ILE  17   0.994  -1.511  -5.208
   72   HG13  ILE  17          2HG1      ILE  17  -0.628  -0.104  -3.161
   73   HG21  ILE  17          1HG2      ILE  17  -1.411  -2.696  -5.626
   74   HG22  ILE  17          2HG2      ILE  17  -1.876  -0.998  -5.531
   75   HG23  ILE  17          3HG2      ILE  17  -0.673  -1.518  -6.712
   76   HD11  ILE  17          3HD1      ILE  17   1.531   1.246  -4.642
   77   HD12  ILE  17          1HD1      ILE  17   1.164   1.234  -2.917
   78   HD13  ILE  17          2HD1      ILE  17   2.000  -0.135  -3.651
   79    H    CYS  18           H        CYS  18   2.497  -2.910  -3.759
   80    HA   CYS  18           HA       CYS  18   3.165  -1.433  -1.332
   81    HB3  CYS  18           2HB      CYS  18   4.778  -3.522  -0.901
   82    H    THR  19           H        THR  19   4.819  -0.139  -1.747
   83    HA   THR  19           HA       THR  19   6.887  -1.020  -3.638
   84    HB   THR  19           HB       THR  19   7.001   1.222  -4.630
   85    HG1  THR  19           1HG      THR  19   4.655   1.747  -3.091
   86   HG21  THR  19          3HG2      THR  19   5.121  -0.720  -5.160
   87   HG22  THR  19          1HG2      THR  19   5.495   0.659  -6.193
   88   HG23  THR  19          2HG2      THR  19   4.153   0.749  -5.052
   89    H    PHE  20           H        PHE  20   8.632   0.965  -3.598
   90    HA   PHE  20           HA       PHE  20   9.909   0.738  -1.113
   91    HB3  PHE  20           2HB      PHE  20  11.260   1.175  -3.020
   92    HD1  PHE  20           1HD      PHE  20   9.597   4.479  -2.542
   93    HD2  PHE  20           2HD      PHE  20  10.893   1.476  -5.265
   94    HE1  PHE  20           1HE      PHE  20   8.895   5.892  -4.430
   95    HE2  PHE  20           2HE      PHE  20  10.194   2.885  -7.157
   96    HZ   PHE  20           HZ       PHE  20   9.194   5.096  -6.742
   97    H    ARG  21           H        ARG  21   7.427   2.833  -2.167
   98    HA   ARG  21           HA       ARG  21   7.930   4.711   0.034
   99    HB3  ARG  21           2HB      ARG  21   7.615   5.896  -1.986
  100    HG3  ARG  21           2HG      ARG  21   5.142   4.251  -2.479
  101    HD3  ARG  21           2HD      ARG  21   4.697   6.441  -3.265
  102    HE   ARG  21           HE       ARG  21   7.162   6.702  -4.797
  103   HH11  ARG  21          1HH1      ARG  21   5.261   7.651  -2.040
  104   HH12  ARG  21          2HH1      ARG  21   6.159   9.105  -1.756
  105   HH21  ARG  21          1HH2      ARG  21   8.353   8.614  -4.434
  106   HH22  ARG  21          2HH2      ARG  21   7.917   9.652  -3.119
  107    H    GLY  22           H        GLY  22   6.857   1.977   0.353
  108    HA2  GLY  22           2HA      GLY  22   5.381   1.116   1.936
  109    HA3  GLY  22           3HA      GLY  22   4.606   2.691   2.030
  110    H    CYS  23           H        CYS  23   2.709   1.138   2.094
  111    HA   CYS  23           HA       CYS  23   1.944   0.036  -0.480
  112    HB3  CYS  23           2HB      CYS  23   0.060  -0.912   0.663
  113    H    GLY  24           H        GLY  24  -0.742   0.416  -0.601
  114    HA2  GLY  24           2HA      GLY  24  -1.497   3.155  -0.263
  115    HA3  GLY  24           3HA      GLY  24  -1.066   2.798  -1.929
  116    H    ALA  25           H        ALA  25  -3.635   3.625  -1.015
  117    HA   ALA  25           HA       ALA  25  -5.233   1.187  -1.425
  118    HB1  ALA  25           1HB      ALA  25  -6.762   1.956   0.023
  119    HB2  ALA  25           2HB      ALA  25  -5.467   3.019   0.573
  120    HB3  ALA  25           3HB      ALA  25  -6.657   3.606  -0.588
  121    H    VAL  26           H        VAL  26  -7.489   1.874  -2.442
  122    HA   VAL  26           HA       VAL  26  -7.099   2.375  -5.121
  123    HB   VAL  26           HB       VAL  26  -9.566   3.040  -5.146
  124   HG11  VAL  26          1HG1      VAL  26 -10.107   0.850  -5.291
  125   HG12  VAL  26          2HG1      VAL  26  -8.361   0.636  -5.148
  126   HG13  VAL  26          3HG1      VAL  26  -9.392   0.458  -3.727
  127   HG21  VAL  26          3HG2      VAL  26  -9.387   2.226  -2.247
  128   HG22  VAL  26          1HG2      VAL  26  -9.594   3.883  -2.816
  129   HG23  VAL  26          2HG2      VAL  26 -10.843   2.679  -3.135
  130    H    ASN  27           H        ASN  27  -6.611   4.122  -6.270
  131    HA   ASN  27           HA       ASN  27  -5.977   6.290  -6.679
  132    HB3  ASN  27           2HB      ASN  27  -8.389   6.223  -7.275
  133   HD21  ASN  27          1HD2      ASN  27  -9.775   5.047  -5.969
  134   HD22  ASN  27          2HD2      ASN  27 -10.642   5.766  -4.659
  135    H    GLY  28           H        GLY  28  -5.103   5.432  -4.132
  136    HA2  GLY  28           2HA      GLY  28  -4.173   6.308  -2.226
  137    HA3  GLY  28           3HA      GLY  28  -4.406   7.889  -2.957
  138    H    LEU  29           H        LEU  29  -5.559   5.613  -0.654
  139    HA   LEU  29           HA       LEU  29  -7.331   7.634   0.453
  140    HB3  LEU  29           2HB      LEU  29  -8.789   5.246   0.682
  141    HG   LEU  29           HG       LEU  29  -9.409   7.843  -0.006
  142   HD11  LEU  29          1HD1      LEU  29  -9.585   6.077  -2.391
  143   HD12  LEU  29          2HD1      LEU  29  -9.215   7.798  -2.281
  144   HD13  LEU  29          3HD1      LEU  29 -10.879   7.241  -2.106
  145   HD21  LEU  29          3HD2      LEU  29 -11.388   5.631  -0.361
  146   HD22  LEU  29          1HD2      LEU  29 -11.587   7.203   0.413
  147   HD23  LEU  29          2HD2      LEU  29 -10.672   5.933   1.223
  148    HA   PRO  30           HA       PRO  30  -5.902   6.080   4.301
  149    HB3  PRO  30           2HB      PRO  30  -7.024   7.822   5.295
  150    HG3  PRO  30           2HG      PRO  30  -9.091   8.529   4.497
  151    HD3  PRO  30           2HD      PRO  30  -7.892   8.503   2.529
  Start of MODEL   15
    1    H1   SER   1           H        SER   1  -6.988   4.086   2.593
    2    HA   SER   1           HA       SER   1  -7.423   2.762   5.054
    3    HB3  SER   1           2HB      SER   1  -7.273   1.467   2.326
    4    HG   SER   1           HG       SER   1  -9.071   0.271   3.432
    5    H    CYS   2           H        CYS   2  -4.808   2.698   2.723
    6    HA   CYS   2           HA       CYS   2  -3.309   0.935   4.545
    7    HB3  CYS   2           2HB      CYS   2  -2.080   0.272   2.328
    8    H    ASN   3           H        ASN   3  -2.082   2.441   5.562
    9    HA   ASN   3           HA       ASN   3  -0.264   4.012   3.864
   10    HB3  ASN   3           2HB      ASN   3  -1.761   5.649   4.679
   11   HD21  ASN   3          1HD2      ASN   3  -3.663   4.713   5.477
   12   HD22  ASN   3          2HD2      ASN   3  -3.952   4.565   7.174
   13    H    ASN   4           H        ASN   4   0.972   1.950   4.338
   14    HA   ASN   4           HA       ASN   4   2.632   2.414   6.705
   15    HB3  ASN   4           2HB      ASN   4   1.405   0.672   7.607
   16   HD21  ASN   4          1HD2      ASN   4   2.309  -1.162   4.757
   17   HD22  ASN   4          2HD2      ASN   4   0.707  -1.652   4.334
   18    H    SER   5           H        SER   5   4.635   0.919   6.586
   19    HA   SER   5           HA       SER   5   5.737   1.224   3.899
   20    HB3  SER   5           2HB      SER   5   6.909   2.126   5.965
   21    HG   SER   5           HG       SER   5   7.975  -0.400   6.398
   22    H    CYS   6           H        CYS   6   6.557  -0.436   2.692
   23    HA   CYS   6           HA       CYS   6   6.824  -3.098   3.737
   24    HB3  CYS   6           2HB      CYS   6   4.473  -3.240   3.453
   25    H    GLN   7           H        GLN   7   7.300  -4.667   1.855
   26    HA   GLN   7           HA       GLN   7   8.639  -3.280  -0.356
   27    HB3  GLN   7           2HB      GLN   7  10.615  -4.713  -0.105
   28    HG3  GLN   7           2HG      GLN   7  11.277  -3.951   2.312
   29   HE21  GLN   7          1HE2      GLN   7  12.913  -3.675   0.663
   30   HE22  GLN   7          2HE2      GLN   7  13.097  -2.134  -0.098
   31    H    SER   8           H        SER   8   7.507  -6.355   0.977
   32    HA   SER   8           HA       SER   8   6.860  -7.209  -1.761
   33    HB3  SER   8           2HB      SER   8   7.443  -9.550  -1.084
   34    HG   SER   8           HG       SER   8   8.966  -7.961  -2.101
   35    H    HIS   9           H        HIS   9   4.877  -6.057  -0.649
   36    HA   HIS   9           HA       HIS   9   2.768  -6.215   0.206
   37    HB3  HIS   9           2HB      HIS   9   1.718  -8.557  -0.147
   38    HD1  HIS   9           1HD      HIS   9  -0.005  -7.818  -1.742
   39    HD2  HIS   9           2HD      HIS   9   3.816  -6.862  -3.062
   40    HE1  HIS   9           1HE      HIS   9  -0.323  -6.720  -3.982
   41    H    SER  10           H        SER  10   4.817  -6.441   2.122
   42    HA   SER  10           HA       SER  10   4.196  -8.610   3.911
   43    HB3  SER  10           2HB      SER  10   5.761  -7.386   5.464
   44    HG   SER  10           HG       SER  10   6.679  -8.891   4.105
   45    H    ASP  11           H        ASP  11   4.193  -5.103   4.530
   46    HA   ASP  11           HA       ASP  11   2.330  -5.327   6.663
   47    HB3  ASP  11           2HB      ASP  11   2.250  -2.790   6.441
   48    H    CYS  12           H        CYS  12   2.030  -4.881   3.241
   49    HA   CYS  12           HA       CYS  12  -0.423  -3.643   2.990
   50    HB3  CYS  12           2HB      CYS  12  -0.598  -5.364   0.949
   51    H    ALA  13           H        ALA  13  -2.543  -4.267   3.068
   52    HA   ALA  13           HA       ALA  13  -3.218  -7.043   3.615
   53    HB1  ALA  13           1HB      ALA  13  -2.920  -6.454   5.844
   54    HB2  ALA  13           2HB      ALA  13  -3.573  -4.833   5.604
   55    HB3  ALA  13           3HB      ALA  13  -4.652  -6.227   5.594
   56    H    SER  14           H        SER  14  -5.653  -7.298   3.794
   57    HA   SER  14           HA       SER  14  -7.652  -7.169   2.707
   58    HB3  SER  14           2HB      SER  14  -8.606  -4.804   2.573
   59    HG   SER  14           HG       SER  14  -9.166  -5.098   4.578
   60    H    HIS  15           H        HIS  15  -5.415  -7.424   1.012
   61    HA   HIS  15           HA       HIS  15  -4.883  -7.371  -1.199
   62    HB3  HIS  15           2HB      HIS  15  -7.467  -6.023  -1.874
   63    HD1  HIS  15           1HD      HIS  15  -4.659  -6.742  -3.442
   64    HD2  HIS  15           2HD      HIS  15  -8.374  -8.571  -3.782
   65    HE1  HIS  15           1HE      HIS  15  -4.665  -7.838  -5.706
   66    H    CYS  16           H        CYS  16  -3.488  -5.572  -0.154
   67    HA   CYS  16           HA       CYS  16  -4.029  -3.028  -1.542
   68    HB3  CYS  16           2HB      CYS  16  -2.240  -2.249   0.270
   69    H    ILE  17           H        ILE  17  -2.395  -2.057  -2.710
   70    HA   ILE  17           HA       ILE  17  -0.326  -3.836  -3.657
   71    HB   ILE  17           HB       ILE  17  -1.395  -1.193  -4.508
   72   HG13  ILE  17          2HG1      ILE  17  -0.537  -3.614  -6.103
   73   HG21  ILE  17          1HG2      ILE  17   0.865  -0.572  -4.497
   74   HG22  ILE  17          2HG2      ILE  17   1.394  -2.161  -5.048
   75   HG23  ILE  17          3HG2      ILE  17   0.552  -1.079  -6.157
   76   HD11  ILE  17          3HD1      ILE  17  -2.266  -4.345  -4.585
   77   HD12  ILE  17          1HD1      ILE  17  -3.271  -2.966  -5.029
   78   HD13  ILE  17          2HD1      ILE  17  -2.908  -4.213  -6.222
   79    H    CYS  18           H        CYS  18   1.834  -3.683  -3.313
   80    HA   CYS  18           HA       CYS  18   2.742  -1.574  -1.464
   81    HB3  CYS  18           2HB      CYS  18   4.565  -3.481  -1.015
   82    H    THR  19           H        THR  19   4.519  -0.429  -1.997
   83    HA   THR  19           HA       THR  19   6.260  -1.360  -4.144
   84    HB   THR  19           HB       THR  19   6.127   0.756  -5.372
   85    HG1  THR  19           1HG      THR  19   4.413   2.217  -4.818
   86   HG21  THR  19          3HG2      THR  19   3.846   0.478  -6.309
   87   HG22  THR  19          1HG2      THR  19   3.463  -0.611  -4.977
   88   HG23  THR  19          2HG2      THR  19   4.713  -1.049  -6.142
   89    H    PHE  20           H        PHE  20   7.892   0.679  -4.542
   90    HA   PHE  20           HA       PHE  20   9.523   0.761  -2.285
   91    HB3  PHE  20           2HB      PHE  20  10.219   1.200  -4.668
   92    HD1  PHE  20           2HD      PHE  20   8.185   1.949  -5.992
   93    HD2  PHE  20           1HD      PHE  20  10.590   4.613  -3.704
   94    HE1  PHE  20           2HE      PHE  20   7.303   3.849  -7.283
   95    HE2  PHE  20           1HE      PHE  20   9.711   6.517  -4.991
   96    HZ   PHE  20           HZ       PHE  20   8.064   6.137  -6.783
   97    H    ARG  21           H        ARG  21   6.828   2.727  -3.174
   98    HA   ARG  21           HA       ARG  21   7.489   4.756  -1.177
   99    HB3  ARG  21           2HB      ARG  21   5.185   5.662  -2.103
  100    HG3  ARG  21           2HG      ARG  21   6.673   6.292  -4.303
  101    HD3  ARG  21           2HD      ARG  21   5.614   7.697  -2.390
  102    HE   ARG  21           HE       ARG  21   8.119   7.059  -1.172
  103   HH11  ARG  21          1HH1      ARG  21   5.710   9.547  -1.529
  104   HH12  ARG  21          2HH1      ARG  21   6.097  10.318  -0.026
  105   HH21  ARG  21          1HH2      ARG  21   8.638   8.065   0.807
  106   HH22  ARG  21          2HH2      ARG  21   7.763   9.475   1.301
  107    H    GLY  22           H        GLY  22   6.695   1.951  -0.529
  108    HA2  GLY  22           2HA      GLY  22   5.626   1.137   1.380
  109    HA3  GLY  22           3HA      GLY  22   4.735   2.647   1.497
  110    H    CYS  23           H        CYS  23   2.904   1.236   1.970
  111    HA   CYS  23           HA       CYS  23   1.830  -0.177  -0.362
  112    HB3  CYS  23           2HB      CYS  23   0.062  -0.866   1.435
  113    H    GLY  24           H        GLY  24  -0.025   0.425  -1.379
  114    HA2  GLY  24           2HA      GLY  24  -1.227   2.966  -0.474
  115    HA3  GLY  24           3HA      GLY  24  -1.118   2.464  -2.155
  116    H    ALA  25           H        ALA  25  -3.518   3.230  -1.501
  117    HA   ALA  25           HA       ALA  25  -5.022   0.725  -1.139
  118    HB1  ALA  25           1HB      ALA  25  -5.021   2.813   0.669
  119    HB2  ALA  25           2HB      ALA  25  -6.491   3.072  -0.268
  120    HB3  ALA  25           3HB      ALA  25  -6.229   1.533   0.551
  121    H    VAL  26           H        VAL  26  -7.525   1.485  -1.674
  122    HA   VAL  26           HA       VAL  26  -7.656   1.632  -4.442
  123    HB   VAL  26           HB       VAL  26 -10.068   2.303  -4.095
  124   HG11  VAL  26          1HG1      VAL  26  -9.337  -0.035  -4.261
  125   HG12  VAL  26          2HG1      VAL  26  -9.083  -0.072  -2.514
  126   HG13  VAL  26          3HG1      VAL  26 -10.707   0.149  -3.168
  127   HG21  VAL  26          3HG2      VAL  26  -9.097   3.086  -1.583
  128   HG22  VAL  26          1HG2      VAL  26 -10.769   3.097  -2.143
  129   HG23  VAL  26          2HG2      VAL  26 -10.135   1.689  -1.290
  130    H    ASN  27           H        ASN  27  -7.135   3.235  -5.763
  131    HA   ASN  27           HA       ASN  27  -6.798   5.311  -6.628
  132    HB3  ASN  27           2HB      ASN  27  -8.502   7.087  -5.718
  133   HD21  ASN  27          1HD2      ASN  27  -8.269   7.047  -8.033
  134   HD22  ASN  27          2HD2      ASN  27  -9.403   6.162  -8.989
  135    H    GLY  28           H        GLY  28  -5.358   4.498  -4.196
  136    HA2  GLY  28           2HA      GLY  28  -3.843   5.404  -2.729
  137    HA3  GLY  28           3HA      GLY  28  -3.954   6.871  -3.691
  138    H    LEU  29           H        LEU  29  -6.232   5.141  -1.562
  139    HA   LEU  29           HA       LEU  29  -6.727   7.700  -0.196
  140    HB3  LEU  29           2HB      LEU  29  -8.753   6.022   0.579
  141    HG   LEU  29           HG       LEU  29  -9.212   8.284  -0.163
  142   HD11  LEU  29          1HD1      LEU  29  -8.083   8.920  -1.993
  143   HD12  LEU  29          2HD1      LEU  29  -9.476   8.278  -2.862
  144   HD13  LEU  29          3HD1      LEU  29  -8.033   7.286  -2.658
  145   HD21  LEU  29          3HD2      LEU  29 -11.175   7.721  -1.735
  146   HD22  LEU  29          1HD2      LEU  29 -11.161   7.017  -0.118
  147   HD23  LEU  29          2HD2      LEU  29 -10.680   6.044  -1.507
  148    HA   PRO  30           HA       PRO  30  -5.248   6.172   3.641
  149    HB3  PRO  30           2HB      PRO  30  -5.848   8.187   4.569
  150    HG3  PRO  30           2HG      PRO  30  -7.804   9.267   3.928
  151    HD3  PRO  30           2HD      PRO  30  -6.895   8.831   1.856
  Start of MODEL   16
    1    H1   SER   1           H        SER   1  -6.415   4.310   2.140
    2    HA   SER   1           HA       SER   1  -7.521   2.687   4.209
    3    HB3  SER   1           2HB      SER   1  -6.517   1.621   1.579
    4    HG   SER   1           HG       SER   1  -8.517   0.415   1.845
    5    H    CYS   2           H        CYS   2  -4.507   2.463   2.320
    6    HA   CYS   2           HA       CYS   2  -3.292   1.050   4.596
    7    HB3  CYS   2           2HB      CYS   2  -2.167  -0.485   3.127
    8    H    ASN   3           H        ASN   3  -2.050   2.689   5.353
    9    HA   ASN   3           HA       ASN   3  -0.096   3.846   3.475
   10    HB3  ASN   3           2HB      ASN   3  -0.087   5.862   4.963
   11   HD21  ASN   3          1HD2      ASN   3  -0.677   5.381   2.393
   12   HD22  ASN   3          2HD2      ASN   3  -2.152   6.161   1.946
   13    H    ASN   4           H        ASN   4   1.158   1.912   4.122
   14    HA   ASN   4           HA       ASN   4   2.772   2.536   6.483
   15    HB3  ASN   4           2HB      ASN   4   1.493   0.886   7.490
   16   HD21  ASN   4          1HD2      ASN   4   2.364  -1.724   5.583
   17   HD22  ASN   4          2HD2      ASN   4   0.827  -2.044   4.864
   18    H    SER   5           H        SER   5   4.674   0.785   6.504
   19    HA   SER   5           HA       SER   5   5.917   1.032   3.873
   20    HB3  SER   5           2HB      SER   5   8.012   0.403   5.105
   21    HG   SER   5           HG       SER   5   7.871   2.380   6.517
   22    H    CYS   6           H        CYS   6   6.746  -0.686   2.719
   23    HA   CYS   6           HA       CYS   6   6.871  -3.346   3.656
   24    HB3  CYS   6           2HB      CYS   6   4.490  -3.384   3.636
   25    H    GLN   7           H        GLN   7   6.967  -4.910   1.654
   26    HA   GLN   7           HA       GLN   7   8.212  -3.528  -0.618
   27    HB3  GLN   7           2HB      GLN   7   9.412  -6.054   0.470
   28    HG3  GLN   7           2HG      GLN   7  10.534  -3.753  -1.109
   29   HE21  GLN   7          1HE2      GLN   7  12.415  -3.333  -0.100
   30   HE22  GLN   7          2HE2      GLN   7  13.652  -4.505   0.189
   31    H    SER   8           H        SER   8   6.905  -6.563   0.655
   32    HA   SER   8           HA       SER   8   5.777  -7.109  -1.994
   33    HB3  SER   8           2HB      SER   8   6.621  -9.262  -2.157
   34    HG   SER   8           HG       SER   8   8.393  -7.807  -2.208
   35    H    HIS   9           H        HIS   9   4.106  -6.052  -0.390
   36    HA   HIS   9           HA       HIS   9   2.186  -6.258   0.816
   37    HB3  HIS   9           2HB      HIS   9   1.995  -9.143   0.055
   38    HD1  HIS   9           1HD      HIS   9   0.079  -8.961   1.917
   39    HD2  HIS   9           2HD      HIS   9  -0.488  -6.683  -1.512
   40    HE1  HIS   9           1HE      HIS   9  -2.353  -8.328   1.926
   41    H    SER  10           H        SER  10   4.691  -6.865   2.159
   42    HA   SER  10           HA       SER  10   4.192  -9.082   3.928
   43    HB3  SER  10           2HB      SER  10   6.274  -6.894   4.145
   44    HG   SER  10           HG       SER  10   7.152  -8.107   5.668
   45    H    ASP  11           H        ASP  11   3.739  -5.621   3.966
   46    HA   ASP  11           HA       ASP  11   2.638  -5.827   6.693
   47    HB3  ASP  11           2HB      ASP  11   3.275  -3.587   7.119
   48    H    CYS  12           H        CYS  12   2.057  -4.947   3.408
   49    HA   CYS  12           HA       CYS  12  -0.140  -3.249   3.667
   50    HB3  CYS  12           2HB      CYS  12  -0.701  -3.859   1.392
   51    H    ALA  13           H        ALA  13  -2.425  -3.811   3.102
   52    HA   ALA  13           HA       ALA  13  -3.277  -6.477   3.907
   53    HB1  ALA  13           1HB      ALA  13  -4.943  -5.460   5.519
   54    HB2  ALA  13           2HB      ALA  13  -3.258  -5.471   6.041
   55    HB3  ALA  13           3HB      ALA  13  -3.983  -3.984   5.430
   56    H    SER  14           H        SER  14  -5.771  -6.586   3.801
   57    HA   SER  14           HA       SER  14  -7.582  -6.588   2.416
   58    HB3  SER  14           2HB      SER  14  -7.560  -4.218   3.510
   59    HG   SER  14           HG       SER  14  -6.752  -2.687   2.337
   60    H    HIS  15           H        HIS  15  -4.999  -7.133   1.211
   61    HA   HIS  15           HA       HIS  15  -4.119  -7.542  -0.846
   62    HB3  HIS  15           2HB      HIS  15  -6.720  -6.595  -2.041
   63    HD1  HIS  15           1HD      HIS  15  -4.709  -9.795  -2.377
   64    HD2  HIS  15           2HD      HIS  15  -5.971  -6.559  -4.657
   65    HE1  HIS  15           1HE      HIS  15  -4.034 -10.332  -4.738
   66    H    CYS  16           H        CYS  16  -3.766  -4.966   0.365
   67    HA   CYS  16           HA       CYS  16  -3.995  -2.956  -1.674
   68    HB3  CYS  16           2HB      CYS  16  -2.355  -1.772   0.033
   69    H    ILE  17           H        ILE  17  -2.330  -1.992  -2.852
   70    HA   ILE  17           HA       ILE  17  -0.237  -3.771  -3.656
   71    HB   ILE  17           HB       ILE  17  -1.352  -2.256  -5.253
   72   HG13  ILE  17          2HG1      ILE  17   0.515  -2.037  -6.559
   73   HG21  ILE  17          1HG2      ILE  17   0.005  -0.119  -3.627
   74   HG22  ILE  17          2HG2      ILE  17  -0.624   0.149  -5.251
   75   HG23  ILE  17          3HG2      ILE  17  -1.719  -0.307  -3.946
   76   HD11  ILE  17          3HD1      ILE  17   1.818  -0.796  -4.179
   77   HD12  ILE  17          1HD1      ILE  17   2.794  -1.425  -5.508
   78   HD13  ILE  17          2HD1      ILE  17   1.609  -0.153  -5.808
   79    H    CYS  18           H        CYS  18   1.983  -3.527  -3.425
   80    HA   CYS  18           HA       CYS  18   2.849  -1.576  -1.393
   81    HB3  CYS  18           2HB      CYS  18   4.652  -3.517  -1.014
   82    H    THR  19           H        THR  19   4.721  -0.486  -1.770
   83    HA   THR  19           HA       THR  19   6.411  -1.275  -4.017
   84    HB   THR  19           HB       THR  19   6.403   1.299  -4.613
   85    HG1  THR  19           1HG      THR  19   4.927   2.035  -3.128
   86   HG21  THR  19          3HG2      THR  19   4.942  -1.009  -5.576
   87   HG22  THR  19          1HG2      THR  19   5.740   0.274  -6.485
   88   HG23  THR  19          2HG2      THR  19   4.083   0.492  -5.921
   89    H    PHE  20           H        PHE  20   8.269   0.475  -4.187
   90    HA   PHE  20           HA       PHE  20   9.802   0.282  -1.875
   91    HB3  PHE  20           2HB      PHE  20  10.779   0.672  -4.085
   92    HD1  PHE  20           2HD      PHE  20   9.205   1.241  -5.861
   93    HD2  PHE  20           1HD      PHE  20  10.708   4.194  -3.190
   94    HE1  PHE  20           2HE      PHE  20   8.444   3.010  -7.394
   95    HE2  PHE  20           1HE      PHE  20   9.948   5.968  -4.717
   96    HZ   PHE  20           HZ       PHE  20   8.816   5.377  -6.823
   97    H    ARG  21           H        ARG  21   7.405   2.602  -2.773
   98    HA   ARG  21           HA       ARG  21   8.211   4.428  -0.633
   99    HB3  ARG  21           2HB      ARG  21   6.106   5.680  -1.648
  100    HG3  ARG  21           2HG      ARG  21   7.746   6.370  -3.640
  101    HD3  ARG  21           2HD      ARG  21   8.790   7.967  -2.094
  102    HE   ARG  21           HE       ARG  21   6.072   7.801  -2.477
  103   HH11  ARG  21          1HH1      ARG  21   8.201   9.023  -0.008
  104   HH12  ARG  21          2HH1      ARG  21   7.106  10.264   0.505
  105   HH21  ARG  21          1HH2      ARG  21   4.622   9.431  -1.811
  106   HH22  ARG  21          2HH2      ARG  21   5.071  10.495  -0.520
  107    H    GLY  22           H        GLY  22   6.984   1.725  -0.229
  108    HA2  GLY  22           2HA      GLY  22   5.682   0.958   1.550
  109    HA3  GLY  22           3HA      GLY  22   5.023   2.576   1.735
  110    H    CYS  23           H        CYS  23   3.131   0.927   2.033
  111    HA   CYS  23           HA       CYS  23   1.973  -0.081  -0.395
  112    HB3  CYS  23           2HB      CYS  23   0.131  -0.801   0.993
  113    H    GLY  24           H        GLY  24  -0.418   0.484  -0.830
  114    HA2  GLY  24           2HA      GLY  24  -1.087   3.269  -0.319
  115    HA3  GLY  24           3HA      GLY  24  -0.741   2.867  -1.994
  116    H    ALA  25           H        ALA  25  -3.156   3.871  -1.534
  117    HA   ALA  25           HA       ALA  25  -4.933   1.523  -1.673
  118    HB1  ALA  25           1HB      ALA  25  -6.513   2.485  -0.342
  119    HB2  ALA  25           2HB      ALA  25  -5.067   3.208   0.365
  120    HB3  ALA  25           3HB      ALA  25  -6.044   4.127  -0.780
  121    H    VAL  26           H        VAL  26  -7.113   2.226  -2.731
  122    HA   VAL  26           HA       VAL  26  -6.412   3.472  -5.280
  123    HB   VAL  26           HB       VAL  26  -8.435   2.491  -6.168
  124   HG11  VAL  26          1HG1      VAL  26  -6.760   0.624  -4.506
  125   HG12  VAL  26          2HG1      VAL  26  -7.959   0.063  -5.673
  126   HG13  VAL  26          3HG1      VAL  26  -6.579   1.020  -6.214
  127   HG21  VAL  26          3HG2      VAL  26  -9.585   0.843  -4.400
  128   HG22  VAL  26          1HG2      VAL  26  -9.066   2.121  -3.301
  129   HG23  VAL  26          2HG2      VAL  26 -10.128   2.502  -4.657
  130    H    ASN  27           H        ASN  27  -7.914   4.962  -6.304
  131    HA   ASN  27           HA       ASN  27  -9.029   6.947  -6.329
  132    HB3  ASN  27           2HB      ASN  27 -10.743   6.424  -4.022
  133   HD21  ASN  27          1HD2      ASN  27 -12.908   5.497  -5.563
  134   HD22  ASN  27          2HD2      ASN  27 -13.363   6.756  -6.656
  135    H    GLY  28           H        GLY  28  -6.679   6.634  -4.543
  136    HA2  GLY  28           2HA      GLY  28  -5.534   7.861  -2.976
  137    HA3  GLY  28           3HA      GLY  28  -6.609   9.178  -3.422
  138    H    LEU  29           H        LEU  29  -7.079   6.082  -1.718
  139    HA   LEU  29           HA       LEU  29  -8.605   7.524   0.324
  140    HB3  LEU  29           2HB      LEU  29  -8.986   5.004   1.035
  141    HG   LEU  29           HG       LEU  29 -10.440   6.691  -0.831
  142   HD11  LEU  29          1HD1      LEU  29 -10.652   5.167  -2.471
  143   HD12  LEU  29          2HD1      LEU  29 -11.820   4.435  -1.371
  144   HD13  LEU  29          3HD1      LEU  29 -10.167   3.825  -1.434
  145   HD21  LEU  29          3HD2      LEU  29 -11.023   4.827   1.431
  146   HD22  LEU  29          1HD2      LEU  29 -12.334   5.405   0.402
  147   HD23  LEU  29          2HD2      LEU  29 -11.338   6.557   1.291
  148    HA   PRO  30           HA       PRO  30  -5.590   7.107   3.483
  149    HB3  PRO  30           2HB      PRO  30  -7.087   8.106   4.912
  150    HG3  PRO  30           2HG      PRO  30  -9.359   7.625   4.796
  151    HD3  PRO  30           2HD      PRO  30  -8.936   8.082   2.578
  Start of MODEL   17
    1    H1   SER   1           H        SER   1  -6.944   3.865   2.858
    2    HA   SER   1           HA       SER   1  -7.238   2.104   4.995
    3    HB3  SER   1           2HB      SER   1  -6.772   1.616   2.052
    4    HG   SER   1           HG       SER   1  -7.843  -0.511   3.031
    5    H    CYS   2           H        CYS   2  -4.709   1.763   2.510
    6    HA   CYS   2           HA       CYS   2  -2.949   0.640   4.580
    7    HB3  CYS   2           2HB      CYS   2  -1.775  -0.500   2.820
    8    H    ASN   3           H        ASN   3  -1.624   2.118   5.409
    9    HA   ASN   3           HA       ASN   3  -0.146   3.850   3.552
   10    HB3  ASN   3           2HB      ASN   3  -0.443   5.777   4.890
   11   HD21  ASN   3          1HD2      ASN   3  -3.201   4.195   6.245
   12   HD22  ASN   3          2HD2      ASN   3  -4.367   4.818   5.132
   13    H    ASN   4           H        ASN   4   0.635   1.368   4.754
   14    HA   ASN   4           HA       ASN   4   2.698   2.267   6.654
   15    HB3  ASN   4           2HB      ASN   4   1.568   0.622   7.818
   16   HD21  ASN   4          1HD2      ASN   4   2.285  -1.528   5.146
   17   HD22  ASN   4          2HD2      ASN   4   0.659  -2.052   4.885
   18    H    SER   5           H        SER   5   4.823   1.343   6.457
   19    HA   SER   5           HA       SER   5   5.728   1.270   3.751
   20    HB3  SER   5           2HB      SER   5   7.960   0.688   4.895
   21    HG   SER   5           HG       SER   5   7.973   2.775   4.603
   22    H    CYS   6           H        CYS   6   6.663  -0.433   2.612
   23    HA   CYS   6           HA       CYS   6   6.857  -3.073   3.683
   24    HB3  CYS   6           2HB      CYS   6   4.503  -3.203   3.454
   25    H    GLN   7           H        GLN   7   7.149  -4.685   1.731
   26    HA   GLN   7           HA       GLN   7   8.579  -3.336  -0.449
   27    HB3  GLN   7           2HB      GLN   7  10.308  -3.965   1.089
   28    HG3  GLN   7           2HG      GLN   7   9.445  -6.831   0.968
   29   HE21  GLN   7          1HE2      GLN   7   9.972  -6.976   3.812
   30   HE22  GLN   7          2HE2      GLN   7  11.689  -6.931   3.997
   31    H    SER   8           H        SER   8   7.345  -6.443   0.756
   32    HA   SER   8           HA       SER   8   6.402  -7.029  -1.962
   33    HB3  SER   8           2HB      SER   8   7.648  -9.122  -0.172
   34    HG   SER   8           HG       SER   8   7.563  -9.434  -2.904
   35    H    HIS   9           H        HIS   9   4.635  -5.976  -0.380
   36    HA   HIS   9           HA       HIS   9   2.583  -6.252   0.562
   37    HB3  HIS   9           2HB      HIS   9   2.722  -9.191  -0.057
   38    HD1  HIS   9           1HD      HIS   9   0.267  -6.729  -1.443
   39    HD2  HIS   9           2HD      HIS   9   0.476  -9.606   1.546
   40    HE1  HIS   9           1HE      HIS   9  -2.099  -7.049  -0.653
   41    H    SER  10           H        SER  10   5.020  -6.623   2.136
   42    HA   SER  10           HA       SER  10   4.582  -8.729   4.014
   43    HB3  SER  10           2HB      SER  10   6.452  -6.410   3.799
   44    HG   SER  10           HG       SER  10   7.204  -6.797   5.883
   45    H    ASP  11           H        ASP  11   4.122  -5.205   4.124
   46    HA   ASP  11           HA       ASP  11   2.561  -5.521   6.588
   47    HB3  ASP  11           2HB      ASP  11   2.758  -3.051   6.768
   48    H    CYS  12           H        CYS  12   2.248  -4.908   3.233
   49    HA   CYS  12           HA       CYS  12  -0.167  -3.432   3.251
   50    HB3  CYS  12           2HB      CYS  12  -0.297  -3.914   0.906
   51    H    ALA  13           H        ALA  13  -2.292  -4.161   2.697
   52    HA   ALA  13           HA       ALA  13  -2.923  -6.964   2.769
   53    HB1  ALA  13           1HB      ALA  13  -2.674  -6.708   5.120
   54    HB2  ALA  13           2HB      ALA  13  -3.614  -5.215   5.119
   55    HB3  ALA  13           3HB      ALA  13  -4.405  -6.755   4.783
   56    H    SER  14           H        SER  14  -5.307  -7.326   2.635
   57    HA   SER  14           HA       SER  14  -7.315  -6.956   1.635
   58    HB3  SER  14           2HB      SER  14  -6.858  -4.008   2.110
   59    HG   SER  14           HG       SER  14  -9.234  -4.335   2.550
   60    H    HIS  15           H        HIS  15  -5.347  -7.383  -0.113
   61    HA   HIS  15           HA       HIS  15  -4.634  -7.075  -2.257
   62    HB3  HIS  15           2HB      HIS  15  -6.343  -6.351  -3.856
   63    HD1  HIS  15           1HD      HIS  15  -5.717  -8.960  -1.842
   64    HD2  HIS  15           2HD      HIS  15  -9.310  -7.611  -3.433
   65    HE1  HIS  15           1HE      HIS  15  -7.250 -10.953  -1.824
   66    H    CYS  16           H        CYS  16  -3.478  -5.261  -0.643
   67    HA   CYS  16           HA       CYS  16  -3.727  -2.669  -2.001
   68    HB3  CYS  16           2HB      CYS  16  -2.069  -2.106   0.025
   69    H    ILE  17           H        ILE  17  -2.085  -1.812  -3.158
   70    HA   ILE  17           HA       ILE  17   0.054  -3.540  -3.961
   71    HB   ILE  17           HB       ILE  17  -1.026  -1.984  -5.541
   72   HG13  ILE  17          2HG1      ILE  17   0.882  -1.697  -6.771
   73   HG21  ILE  17          1HG2      ILE  17  -1.462  -0.089  -4.175
   74   HG22  ILE  17          2HG2      ILE  17   0.249   0.110  -3.794
   75   HG23  ILE  17          3HG2      ILE  17  -0.334   0.429  -5.428
   76   HD11  ILE  17          3HD1      ILE  17   2.090  -0.527  -4.305
   77   HD12  ILE  17          1HD1      ILE  17   3.115  -1.091  -5.625
   78   HD13  ILE  17          2HD1      ILE  17   1.921   0.175  -5.914
   79    H    CYS  18           H        CYS  18   2.242  -3.331  -3.588
   80    HA   CYS  18           HA       CYS  18   3.014  -1.427  -1.474
   81    HB3  CYS  18           2HB      CYS  18   4.827  -3.360  -1.100
   82    H    THR  19           H        THR  19   4.812  -0.235  -1.794
   83    HA   THR  19           HA       THR  19   6.681  -0.955  -3.912
   84    HB   THR  19           HB       THR  19   6.542   1.595  -4.593
   85    HG1  THR  19           1HG      THR  19   4.272   2.215  -4.560
   86   HG21  THR  19          3HG2      THR  19   5.374  -0.839  -5.593
   87   HG22  THR  19          1HG2      THR  19   6.055   0.521  -6.486
   88   HG23  THR  19          2HG2      THR  19   4.359   0.543  -6.002
   89    H    PHE  20           H        PHE  20   8.421   0.920  -4.019
   90    HA   PHE  20           HA       PHE  20   9.862   0.879  -1.669
   91    HB3  PHE  20           2HB      PHE  20  10.697   1.508  -3.972
   92    HD1  PHE  20           2HD      PHE  20   8.633   2.441  -5.222
   93    HD2  PHE  20           1HD      PHE  20  11.199   4.793  -2.775
   94    HE1  PHE  20           2HE      PHE  20   7.861   4.473  -6.372
   95    HE2  PHE  20           1HE      PHE  20  10.431   6.830  -3.921
   96    HZ   PHE  20           HZ       PHE  20   8.760   6.672  -5.722
   97    H    ARG  21           H        ARG  21   7.346   3.075  -2.665
   98    HA   ARG  21           HA       ARG  21   7.831   4.811  -0.363
   99    HB3  ARG  21           2HB      ARG  21   7.422   6.010  -2.386
  100    HG3  ARG  21           2HG      ARG  21   5.205   4.078  -2.767
  101    HD3  ARG  21           2HD      ARG  21   4.098   6.294  -2.633
  102    HE   ARG  21           HE       ARG  21   6.240   7.301  -4.005
  103   HH11  ARG  21          1HH1      ARG  21   2.796   7.214  -4.500
  104   HH12  ARG  21          2HH1      ARG  21   2.752   8.712  -5.371
  105   HH21  ARG  21          1HH2      ARG  21   6.196   9.273  -5.150
  106   HH22  ARG  21          2HH2      ARG  21   4.687   9.881  -5.741
  107    H    GLY  22           H        GLY  22   7.041   2.245   0.321
  108    HA2  GLY  22           2HA      GLY  22   5.571   1.215   1.757
  109    HA3  GLY  22           3HA      GLY  22   4.797   2.779   1.969
  110    H    CYS  23           H        CYS  23   2.974   1.066   2.083
  111    HA   CYS  23           HA       CYS  23   2.039   0.072  -0.451
  112    HB3  CYS  23           2HB      CYS  23   0.206  -0.859   0.773
  113    H    GLY  24           H        GLY  24  -0.423   0.500  -0.904
  114    HA2  GLY  24           2HA      GLY  24  -1.262   3.220  -0.367
  115    HA3  GLY  24           3HA      GLY  24  -0.795   2.916  -2.033
  116    H    ALA  25           H        ALA  25  -3.413   3.626  -0.850
  117    HA   ALA  25           HA       ALA  25  -4.977   1.230  -1.505
  118    HB1  ALA  25           1HB      ALA  25  -5.222   2.968   0.594
  119    HB2  ALA  25           2HB      ALA  25  -6.455   3.549  -0.525
  120    HB3  ALA  25           3HB      ALA  25  -6.480   1.873   0.021
  121    H    VAL  26           H        VAL  26  -7.047   1.634  -2.700
  122    HA   VAL  26           HA       VAL  26  -6.577   2.635  -5.238
  123    HB   VAL  26           HB       VAL  26  -9.018   2.563  -5.584
  124   HG11  VAL  26          1HG1      VAL  26  -8.609   0.121  -4.001
  125   HG12  VAL  26          2HG1      VAL  26  -9.010   0.317  -5.709
  126   HG13  VAL  26          3HG1      VAL  26  -7.338   0.479  -5.168
  127   HG21  VAL  26          3HG2      VAL  26 -10.260   3.156  -3.814
  128   HG22  VAL  26          1HG2      VAL  26 -10.085   1.473  -3.315
  129   HG23  VAL  26          2HG2      VAL  26  -9.004   2.705  -2.662
  130    H    ASN  27           H        ASN  27  -6.582   4.597  -6.131
  131    HA   ASN  27           HA       ASN  27  -6.735   6.852  -6.378
  132    HB3  ASN  27           2HB      ASN  27  -8.776   7.945  -5.621
  133   HD21  ASN  27          1HD2      ASN  27 -10.931   5.770  -5.346
  134   HD22  ASN  27          2HD2      ASN  27 -11.128   5.206  -6.967
  135    H    GLY  28           H        GLY  28  -5.300   5.609  -4.034
  136    HA2  GLY  28           2HA      GLY  28  -4.095   6.319  -2.214
  137    HA3  GLY  28           3HA      GLY  28  -4.268   7.931  -2.892
  138    H    LEU  29           H        LEU  29  -6.011   5.514  -0.959
  139    HA   LEU  29           HA       LEU  29  -7.216   7.743   0.545
  140    HB3  LEU  29           2HB      LEU  29  -8.842   5.534   0.964
  141    HG   LEU  29           HG       LEU  29  -9.346   8.081   0.236
  142   HD11  LEU  29          1HD1      LEU  29 -10.219   6.465  -2.145
  143   HD12  LEU  29          2HD1      LEU  29  -8.774   7.474  -2.139
  144   HD13  LEU  29          3HD1      LEU  29 -10.360   8.205  -1.899
  145   HD21  LEU  29          3HD2      LEU  29 -11.538   7.567   0.634
  146   HD22  LEU  29          1HD2      LEU  29 -10.762   6.130   1.300
  147   HD23  LEU  29          2HD2      LEU  29 -11.477   6.078  -0.311
  148    HA   PRO  30           HA       PRO  30  -5.585   6.068   4.258
  149    HB3  PRO  30           2HB      PRO  30  -6.614   7.790   5.377
  150    HG3  PRO  30           2HG      PRO  30  -8.728   8.534   4.753
  151    HD3  PRO  30           2HD      PRO  30  -7.679   8.550   2.701
  Start of MODEL   18
    1    H1   SER   1           H        SER   1  -6.624   3.901   2.835
    2    HA   SER   1           HA       SER   1  -7.031   2.541   5.342
    3    HB3  SER   1           2HB      SER   1  -6.663   1.243   2.641
    4    HG   SER   1           HG       SER   1  -8.555   0.358   4.438
    5    H    CYS   2           H        CYS   2  -4.739   1.954   2.668
    6    HA   CYS   2           HA       CYS   2  -2.873   0.791   4.606
    7    HB3  CYS   2           2HB      CYS   2  -1.749  -0.204   2.699
    8    H    ASN   3           H        ASN   3  -2.006   2.657   5.515
    9    HA   ASN   3           HA       ASN   3  -0.327   4.254   3.694
   10    HB3  ASN   3           2HB      ASN   3  -1.338   5.373   6.286
   11   HD21  ASN   3          1HD2      ASN   3  -1.053   7.543   6.422
   12   HD22  ASN   3          2HD2      ASN   3  -0.214   8.478   5.236
   13    H    ASN   4           H        ASN   4   1.066   2.283   4.351
   14    HA   ASN   4           HA       ASN   4   2.816   3.184   6.504
   15    HB3  ASN   4           2HB      ASN   4   1.546   1.624   7.739
   16   HD21  ASN   4          1HD2      ASN   4   2.767  -1.143   6.322
   17   HD22  ASN   4          2HD2      ASN   4   1.306  -1.748   5.624
   18    H    SER   5           H        SER   5   4.762   1.472   6.565
   19    HA   SER   5           HA       SER   5   5.753   1.407   3.813
   20    HB3  SER   5           2HB      SER   5   7.165   2.565   5.425
   21    HG   SER   5           HG       SER   5   7.951   0.362   6.824
   22    H    CYS   6           H        CYS   6   6.580  -0.432   2.851
   23    HA   CYS   6           HA       CYS   6   6.643  -2.946   4.269
   24    HB3  CYS   6           2HB      CYS   6   4.340  -3.058   3.811
   25    H    GLN   7           H        GLN   7   6.868  -4.753   2.357
   26    HA   GLN   7           HA       GLN   7   8.909  -3.694   0.516
   27    HB3  GLN   7           2HB      GLN   7  10.310  -4.947   1.778
   28    HG3  GLN   7           2HG      GLN   7   9.443  -7.149   2.883
   29   HE21  GLN   7          1HE2      GLN   7   7.784  -6.426   5.012
   30   HE22  GLN   7          2HE2      GLN   7   8.568  -5.182   5.920
   31    H    SER   8           H        SER   8   6.977  -6.654   1.014
   32    HA   SER   8           HA       SER   8   5.960  -6.432  -1.708
   33    HB3  SER   8           2HB      SER   8   7.686  -7.814  -2.347
   34    HG   SER   8           HG       SER   8   8.051  -9.659  -0.559
   35    H    HIS   9           H        HIS   9   4.071  -5.949  -0.350
   36    HA   HIS   9           HA       HIS   9   2.061  -6.497   0.562
   37    HB3  HIS   9           2HB      HIS   9   1.343  -8.963   0.094
   38    HD1  HIS   9           1HD      HIS   9  -0.685  -8.231  -1.111
   39    HD2  HIS   9           2HD      HIS   9   2.777  -6.807  -2.912
   40    HE1  HIS   9           1HE      HIS   9  -1.450  -7.032  -3.185
   41    H    SER  10           H        SER  10   4.559  -6.853   2.113
   42    HA   SER  10           HA       SER  10   4.111  -9.117   3.836
   43    HB3  SER  10           2HB      SER  10   6.044  -8.343   5.063
   44    HG   SER  10           HG       SER  10   6.340  -9.186   2.859
   45    H    ASP  11           H        ASP  11   4.141  -5.593   4.402
   46    HA   ASP  11           HA       ASP  11   2.581  -5.965   6.831
   47    HB3  ASP  11           2HB      ASP  11   3.022  -3.641   7.282
   48    H    CYS  12           H        CYS  12   2.176  -4.907   3.551
   49    HA   CYS  12           HA       CYS  12  -0.192  -3.415   3.834
   50    HB3  CYS  12           2HB      CYS  12  -0.464  -3.685   1.454
   51    H    ALA  13           H        ALA  13  -2.303  -4.173   2.756
   52    HA   ALA  13           HA       ALA  13  -2.986  -6.934   2.906
   53    HB1  ALA  13           1HB      ALA  13  -4.757  -6.346   4.791
   54    HB2  ALA  13           2HB      ALA  13  -3.137  -6.930   5.178
   55    HB3  ALA  13           3HB      ALA  13  -3.497  -5.205   5.264
   56    H    SER  14           H        SER  14  -5.334  -7.285   2.550
   57    HA   SER  14           HA       SER  14  -7.250  -6.911   1.381
   58    HB3  SER  14           2HB      SER  14  -6.897  -3.953   1.822
   59    HG   SER  14           HG       SER  14  -9.129  -5.704   1.745
   60    H    HIS  15           H        HIS  15  -5.124  -7.318  -0.187
   61    HA   HIS  15           HA       HIS  15  -4.223  -6.992  -2.256
   62    HB3  HIS  15           2HB      HIS  15  -5.827  -6.140  -3.981
   63    HD1  HIS  15           1HD      HIS  15  -4.982  -8.857  -3.760
   64    HD2  HIS  15           2HD      HIS  15  -8.756  -7.763  -2.413
   65    HE1  HIS  15           1HE      HIS  15  -6.320 -10.986  -3.707
   66    H    CYS  16           H        CYS  16  -3.247  -5.167  -0.533
   67    HA   CYS  16           HA       CYS  16  -3.410  -2.569  -1.891
   68    HB3  CYS  16           2HB      CYS  16  -1.918  -2.010   0.260
   69    H    ILE  17           H        ILE  17  -1.931  -2.238  -3.405
   70    HA   ILE  17           HA       ILE  17   0.356  -3.763  -3.836
   71    HB   ILE  17           HB       ILE  17  -0.683  -2.295  -5.539
   72   HG13  ILE  17          2HG1      ILE  17   2.251  -1.766  -5.017
   73   HG21  ILE  17          1HG2      ILE  17   0.799   0.037  -4.418
   74   HG22  ILE  17          2HG2      ILE  17  -0.594   0.002  -5.496
   75   HG23  ILE  17          3HG2      ILE  17  -0.798  -0.362  -3.783
   76   HD11  ILE  17          3HD1      ILE  17   0.921  -3.936  -6.622
   77   HD12  ILE  17          1HD1      ILE  17   2.651  -3.594  -6.601
   78   HD13  ILE  17          2HD1      ILE  17   1.842  -4.141  -5.131
   79    H    CYS  18           H        CYS  18   2.538  -3.452  -3.418
   80    HA   CYS  18           HA       CYS  18   3.186  -1.410  -1.396
   81    HB3  CYS  18           2HB      CYS  18   4.952  -3.311  -0.740
   82    H    THR  19           H        THR  19   4.344   0.032  -2.528
   83    HA   THR  19           HA       THR  19   6.500  -0.972  -4.265
   84    HB   THR  19           HB       THR  19   5.913   1.875  -4.513
   85    HG1  THR  19           1HG      THR  19   3.829   1.767  -4.854
   86   HG21  THR  19          3HG2      THR  19   5.524   0.870  -6.953
   87   HG22  THR  19          1HG2      THR  19   6.395  -0.488  -6.245
   88   HG23  THR  19          2HG2      THR  19   7.135   1.113  -6.281
   89    H    PHE  20           H        PHE  20   8.116   1.157  -4.490
   90    HA   PHE  20           HA       PHE  20   9.722   1.058  -2.227
   91    HB3  PHE  20           2HB      PHE  20  10.705   1.731  -4.290
   92    HD1  PHE  20           1HD      PHE  20   9.123   4.970  -3.428
   93    HD2  PHE  20           2HD      PHE  20   9.637   1.923  -6.355
   94    HE1  PHE  20           1HE      PHE  20   7.992   6.384  -5.094
   95    HE2  PHE  20           2HE      PHE  20   8.508   3.333  -8.026
   96    HZ   PHE  20           HZ       PHE  20   7.682   5.567  -7.396
   97    H    ARG  21           H        ARG  21   6.988   3.062  -2.930
   98    HA   ARG  21           HA       ARG  21   7.560   4.805  -0.646
   99    HB3  ARG  21           2HB      ARG  21   6.912   6.018  -2.595
  100    HG3  ARG  21           2HG      ARG  21   4.790   3.958  -2.851
  101    HD3  ARG  21           2HD      ARG  21   3.708   6.259  -2.602
  102    HE   ARG  21           HE       ARG  21   5.456   6.891  -4.757
  103   HH11  ARG  21          1HH1      ARG  21   2.256   7.454  -3.508
  104   HH12  ARG  21          2HH1      ARG  21   2.085   8.996  -4.279
  105   HH21  ARG  21          1HH2      ARG  21   5.243   8.920  -5.777
  106   HH22  ARG  21          2HH2      ARG  21   3.784   9.828  -5.570
  107    H    GLY  22           H        GLY  22   7.035   2.235   0.117
  108    HA2  GLY  22           2HA      GLY  22   5.730   1.035   1.574
  109    HA3  GLY  22           3HA      GLY  22   4.924   2.552   1.943
  110    H    CYS  23           H        CYS  23   3.061   1.054   2.174
  111    HA   CYS  23           HA       CYS  23   1.955  -0.230  -0.106
  112    HB3  CYS  23           2HB      CYS  23  -0.024  -0.559   1.265
  113    H    GLY  24           H        GLY  24  -0.585   0.421  -0.436
  114    HA2  GLY  24           2HA      GLY  24  -1.140   3.206  -0.569
  115    HA3  GLY  24           3HA      GLY  24  -0.584   2.615  -2.128
  116    H    ALA  25           H        ALA  25  -3.264   3.530  -0.827
  117    HA   ALA  25           HA       ALA  25  -4.894   1.216  -1.609
  118    HB1  ALA  25           1HB      ALA  25  -5.086   2.781   0.599
  119    HB2  ALA  25           2HB      ALA  25  -6.260   3.550  -0.471
  120    HB3  ALA  25           3HB      ALA  25  -6.415   1.837  -0.078
  121    H    VAL  26           H        VAL  26  -7.068   1.898  -2.634
  122    HA   VAL  26           HA       VAL  26  -6.575   2.940  -5.174
  123    HB   VAL  26           HB       VAL  26  -9.080   3.121  -5.364
  124   HG11  VAL  26          1HG1      VAL  26  -9.311   0.860  -5.689
  125   HG12  VAL  26          2HG1      VAL  26  -7.552   1.003  -5.634
  126   HG13  VAL  26          3HG1      VAL  26  -8.437   0.448  -4.213
  127   HG21  VAL  26          3HG2      VAL  26  -9.650   1.626  -2.969
  128   HG22  VAL  26          1HG2      VAL  26  -8.935   3.189  -2.574
  129   HG23  VAL  26          2HG2      VAL  26 -10.391   3.111  -3.566
  130    H    ASN  27           H        ASN  27  -6.305   4.948  -5.877
  131    HA   ASN  27           HA       ASN  27  -6.298   7.218  -5.999
  132    HB3  ASN  27           2HB      ASN  27  -8.313   8.402  -5.334
  133   HD21  ASN  27          1HD2      ASN  27  -7.889   7.754  -7.677
  134   HD22  ASN  27          2HD2      ASN  27  -9.078   6.730  -8.400
  135    H    GLY  28           H        GLY  28  -4.910   5.885  -3.811
  136    HA2  GLY  28           2HA      GLY  28  -3.679   6.486  -1.968
  137    HA3  GLY  28           3HA      GLY  28  -4.101   8.150  -2.345
  138    H    LEU  29           H        LEU  29  -6.640   5.868  -1.794
  139    HA   LEU  29           HA       LEU  29  -7.827   7.378   0.241
  140    HB3  LEU  29           2HB      LEU  29  -8.177   4.485  -0.519
  141    HG   LEU  29           HG       LEU  29  -9.161   5.424   1.823
  142   HD11  LEU  29          1HD1      LEU  29 -11.493   5.991   1.532
  143   HD12  LEU  29          2HD1      LEU  29 -11.330   5.883  -0.221
  144   HD13  LEU  29          3HD1      LEU  29 -10.482   7.149   0.668
  145   HD21  LEU  29          3HD2      LEU  29 -11.119   3.692   1.088
  146   HD22  LEU  29          1HD2      LEU  29  -9.519   3.213   1.650
  147   HD23  LEU  29          2HD2      LEU  29  -9.856   3.298  -0.079
  148    HA   PRO  30           HA       PRO  30  -5.485   6.269   3.810
  149    HB3  PRO  30           2HB      PRO  30  -6.354   8.165   4.775
  150    HG3  PRO  30           2HG      PRO  30  -8.510   8.883   4.279
  151    HD3  PRO  30           2HD      PRO  30  -7.694   8.576   2.145
  Start of MODEL   19
    1    H1   SER   1           H        SER   1  -6.335   4.399   1.767
    2    HA   SER   1           HA       SER   1  -7.533   2.743   3.708
    3    HB3  SER   1           2HB      SER   1  -6.211   1.722   1.197
    4    HG   SER   1           HG       SER   1  -8.539   0.683   1.467
    5    H    CYS   2           H        CYS   2  -4.268   2.759   2.311
    6    HA   CYS   2           HA       CYS   2  -3.337   1.276   4.670
    7    HB3  CYS   2           2HB      CYS   2  -1.893  -0.121   3.295
    8    H    ASN   3           H        ASN   3  -1.804   2.384   5.670
    9    HA   ASN   3           HA       ASN   3   0.081   3.970   4.069
   10    HB3  ASN   3           2HB      ASN   3  -0.905   4.991   6.716
   11   HD21  ASN   3          1HD2      ASN   3  -0.034   6.890   7.209
   12   HD22  ASN   3          2HD2      ASN   3   0.949   7.842   6.154
   13    H    ASN   4           H        ASN   4   1.056   1.701   4.628
   14    HA   ASN   4           HA       ASN   4   2.719   2.085   7.021
   15    HB3  ASN   4           2HB      ASN   4   1.371   0.381   7.822
   16   HD21  ASN   4          1HD2      ASN   4   2.305  -1.136   4.763
   17   HD22  ASN   4          2HD2      ASN   4   0.714  -1.658   4.336
   18    H    SER   5           H        SER   5   4.627   0.431   6.920
   19    HA   SER   5           HA       SER   5   5.869   0.806   4.303
   20    HB3  SER   5           2HB      SER   5   7.229   1.597   6.093
   21    HG   SER   5           HG       SER   5   7.177  -0.935   7.336
   22    H    CYS   6           H        CYS   6   6.760  -0.855   3.099
   23    HA   CYS   6           HA       CYS   6   6.768  -3.571   3.981
   24    HB3  CYS   6           2HB      CYS   6   4.430  -3.568   3.605
   25    H    GLN   7           H        GLN   7   7.453  -5.064   2.228
   26    HA   GLN   7           HA       GLN   7   8.904  -3.645   0.095
   27    HB3  GLN   7           2HB      GLN   7  10.706  -5.363   0.349
   28    HG3  GLN   7           2HG      GLN   7  10.135  -3.662   2.762
   29   HE21  GLN   7          1HE2      GLN   7  13.205  -3.941   1.253
   30   HE22  GLN   7          2HE2      GLN   7  14.001  -4.796   2.525
   31    H    SER   8           H        SER   8   7.477  -6.706   1.154
   32    HA   SER   8           HA       SER   8   6.934  -7.332  -1.669
   33    HB3  SER   8           2HB      SER   8   7.728  -9.371   0.423
   34    HG   SER   8           HG       SER   8   6.732 -10.529  -1.063
   35    H    HIS   9           H        HIS   9   5.004  -6.070  -0.495
   36    HA   HIS   9           HA       HIS   9   2.834  -6.120   0.188
   37    HB3  HIS   9           2HB      HIS   9   2.677  -9.020  -0.552
   38    HD1  HIS   9           1HD      HIS   9   0.339  -9.213   0.415
   39    HD2  HIS   9           2HD      HIS   9   0.765  -6.021  -2.209
   40    HE1  HIS   9           1HE      HIS   9  -1.994  -8.373  -0.006
   41    H    SER  10           H        SER  10   4.741  -6.615   2.195
   42    HA   SER  10           HA       SER  10   3.874  -8.834   3.809
   43    HB3  SER  10           2HB      SER  10   5.602  -8.273   5.268
   44    HG   SER  10           HG       SER  10   7.328  -7.451   3.909
   45    H    ASP  11           H        ASP  11   3.935  -5.328   4.473
   46    HA   ASP  11           HA       ASP  11   1.929  -5.587   6.512
   47    HB3  ASP  11           2HB      ASP  11   2.055  -3.027   6.455
   48    H    CYS  12           H        CYS  12   1.969  -4.901   3.125
   49    HA   CYS  12           HA       CYS  12  -0.336  -3.432   2.751
   50    HB3  CYS  12           2HB      CYS  12  -0.478  -5.012   0.597
   51    H    ALA  13           H        ALA  13  -2.500  -3.864   2.614
   52    HA   ALA  13           HA       ALA  13  -3.484  -6.578   2.856
   53    HB1  ALA  13           1HB      ALA  13  -3.284  -6.322   5.143
   54    HB2  ALA  13           2HB      ALA  13  -3.658  -4.599   5.089
   55    HB3  ALA  13           3HB      ALA  13  -4.941  -5.788   4.857
   56    H    SER  14           H        SER  14  -5.974  -6.521   3.011
   57    HA   SER  14           HA       SER  14  -7.901  -6.048   1.891
   58    HB3  SER  14           2HB      SER  14  -8.471  -3.533   1.869
   59    HG   SER  14           HG       SER  14  -7.923  -3.957   4.471
   60    H    HIS  15           H        HIS  15  -5.647  -6.487   0.242
   61    HA   HIS  15           HA       HIS  15  -5.038  -6.364  -1.948
   62    HB3  HIS  15           2HB      HIS  15  -7.428  -4.672  -2.576
   63    HD1  HIS  15           1HD      HIS  15  -5.875  -8.001  -3.604
   64    HD2  HIS  15           2HD      HIS  15  -7.332  -4.479  -5.259
   65    HE1  HIS  15           1HE      HIS  15  -5.621  -8.272  -6.091
   66    H    CYS  16           H        CYS  16  -3.583  -4.732  -0.574
   67    HA   CYS  16           HA       CYS  16  -3.699  -2.110  -1.913
   68    HB3  CYS  16           2HB      CYS  16  -2.019  -1.576   0.062
   69    H    ILE  17           H        ILE  17  -1.949  -1.357  -3.016
   70    HA   ILE  17           HA       ILE  17   0.017  -3.297  -3.822
   71    HB   ILE  17           HB       ILE  17  -0.944  -1.697  -5.436
   72   HG13  ILE  17          2HG1      ILE  17   2.038  -1.395  -5.018
   73   HG21  ILE  17          1HG2      ILE  17  -0.968   0.191  -3.721
   74   HG22  ILE  17          2HG2      ILE  17   0.724   0.441  -4.151
   75   HG23  ILE  17          3HG2      ILE  17  -0.532   0.609  -5.377
   76   HD11  ILE  17          3HD1      ILE  17   2.137  -3.572  -5.440
   77   HD12  ILE  17          1HD1      ILE  17   0.434  -3.648  -5.891
   78   HD13  ILE  17          2HD1      ILE  17   1.641  -3.160  -7.083
   79    H    CYS  18           H        CYS  18   2.223  -3.240  -3.479
   80    HA   CYS  18           HA       CYS  18   3.159  -1.348  -1.421
   81    HB3  CYS  18           2HB      CYS  18   4.798  -3.416  -0.978
   82    H    THR  19           H        THR  19   4.974  -0.254  -1.862
   83    HA   THR  19           HA       THR  19   6.771  -1.228  -3.959
   84    HB   THR  19           HB       THR  19   6.913   1.101  -4.901
   85    HG1  THR  19           1HG      THR  19   5.594   1.833  -2.884
   86   HG21  THR  19          3HG2      THR  19   4.206  -0.221  -5.121
   87   HG22  THR  19          1HG2      THR  19   5.648  -0.707  -6.011
   88   HG23  THR  19          2HG2      THR  19   4.931   0.880  -6.291
   89    H    PHE  20           H        PHE  20   8.630   0.603  -4.128
   90    HA   PHE  20           HA       PHE  20  10.132   0.387  -1.800
   91    HB3  PHE  20           2HB      PHE  20  11.295   0.820  -3.816
   92    HD1  PHE  20           1HD      PHE  20   9.970   4.242  -3.252
   93    HD2  PHE  20           2HD      PHE  20  10.438   0.998  -5.968
   94    HE1  PHE  20           1HE      PHE  20   9.088   5.643  -5.072
   95    HE2  PHE  20           2HE      PHE  20   9.558   2.394  -7.792
   96    HZ   PHE  20           HZ       PHE  20   8.883   4.721  -7.346
   97    H    ARG  21           H        ARG  21   7.714   2.696  -2.685
   98    HA   ARG  21           HA       ARG  21   8.460   4.492  -0.502
   99    HB3  ARG  21           2HB      ARG  21   7.928   5.628  -2.535
  100    HG3  ARG  21           2HG      ARG  21   5.565   3.822  -2.619
  101    HD3  ARG  21           2HD      ARG  21   4.627   6.102  -2.591
  102    HE   ARG  21           HE       ARG  21   6.758   6.750  -4.329
  103   HH11  ARG  21          1HH1      ARG  21   3.374   7.384  -3.806
  104   HH12  ARG  21          2HH1      ARG  21   3.422   8.954  -4.537
  105   HH21  ARG  21          1HH2      ARG  21   6.833   8.815  -5.295
  106   HH22  ARG  21          2HH2      ARG  21   5.389   9.766  -5.386
  107    H    GLY  22           H        GLY  22   7.446   1.824   0.055
  108    HA2  GLY  22           2HA      GLY  22   6.109   0.946   1.724
  109    HA3  GLY  22           3HA      GLY  22   5.450   2.554   1.985
  110    H    CYS  23           H        CYS  23   3.580   0.861   2.260
  111    HA   CYS  23           HA       CYS  23   2.359   0.044  -0.229
  112    HB3  CYS  23           2HB      CYS  23   0.457  -0.624   1.372
  113    H    GLY  24           H        GLY  24   0.651   0.974  -1.252
  114    HA2  GLY  24           2HA      GLY  24  -0.241   3.574  -0.173
  115    HA3  GLY  24           3HA      GLY  24  -0.143   3.188  -1.884
  116    H    ALA  25           H        ALA  25  -2.426   4.173  -1.451
  117    HA   ALA  25           HA       ALA  25  -4.283   1.944  -0.921
  118    HB1  ALA  25           1HB      ALA  25  -4.373   3.884   0.679
  119    HB2  ALA  25           2HB      ALA  25  -4.953   4.867  -0.666
  120    HB3  ALA  25           3HB      ALA  25  -5.897   3.483  -0.113
  121    H    VAL  26           H        VAL  26  -6.578   2.820  -1.958
  122    HA   VAL  26           HA       VAL  26  -6.069   3.687  -4.708
  123    HB   VAL  26           HB       VAL  26  -7.682   1.872  -5.489
  124   HG11  VAL  26          1HG1      VAL  26  -4.871   1.361  -4.582
  125   HG12  VAL  26          2HG1      VAL  26  -5.801   0.114  -5.416
  126   HG13  VAL  26          3HG1      VAL  26  -5.479   1.656  -6.212
  127   HG21  VAL  26          3HG2      VAL  26  -6.841   0.049  -3.390
  128   HG22  VAL  26          1HG2      VAL  26  -7.869   1.348  -2.784
  129   HG23  VAL  26          2HG2      VAL  26  -8.439   0.308  -4.088
  130    H    ASN  27           H        ASN  27  -8.108   4.182  -5.881
  131    HA   ASN  27           HA       ASN  27 -10.091   5.280  -6.060
  132    HB3  ASN  27           2HB      ASN  27 -10.766   4.065  -3.373
  133   HD21  ASN  27          1HD2      ASN  27 -13.062   3.625  -3.188
  134   HD22  ASN  27          2HD2      ASN  27 -14.188   4.709  -3.926
  135    H    GLY  28           H        GLY  28  -7.722   6.232  -4.286
  136    HA2  GLY  28           2HA      GLY  28  -7.200   8.229  -3.273
  137    HA3  GLY  28           3HA      GLY  28  -8.795   8.802  -3.737
  138    H    LEU  29           H        LEU  29  -7.831   6.125  -1.608
  139    HA   LEU  29           HA       LEU  29  -9.290   7.471   0.571
  140    HB3  LEU  29           2HB      LEU  29  -9.538   5.002   1.389
  141    HG   LEU  29           HG       LEU  29 -11.665   4.721   0.444
  142   HD11  LEU  29          1HD1      LEU  29 -12.706   6.847   0.695
  143   HD12  LEU  29          2HD1      LEU  29 -11.211   7.693   0.298
  144   HD13  LEU  29          3HD1      LEU  29 -11.339   6.794   1.809
  145   HD21  LEU  29          3HD2      LEU  29 -11.658   6.661  -1.686
  146   HD22  LEU  29          1HD2      LEU  29 -12.099   4.954  -1.722
  147   HD23  LEU  29          2HD2      LEU  29 -10.418   5.434  -1.951
  148    HA   PRO  30           HA       PRO  30  -5.753   7.156   3.147
  149    HB3  PRO  30           2HB      PRO  30  -7.002   8.108   4.824
  150    HG3  PRO  30           2HG      PRO  30  -9.241   7.552   5.117
  151    HD3  PRO  30           2HD      PRO  30  -9.238   8.016   2.858
  Start of MODEL   20
    1    H1   SER   1           H        SER   1  -6.351   4.451   2.812
    2    HA   SER   1           HA       SER   1  -6.693   3.147   5.219
    3    HB3  SER   1           2HB      SER   1  -6.689   2.059   2.400
    4    HG   SER   1           HG       SER   1  -7.247   0.797   4.855
    5    H    CYS   2           H        CYS   2  -4.664   1.761   2.646
    6    HA   CYS   2           HA       CYS   2  -3.028   0.465   4.682
    7    HB3  CYS   2           2HB      CYS   2  -2.119  -0.858   2.861
    8    H    ASN   3           H        ASN   3  -1.553   1.839   5.505
    9    HA   ASN   3           HA       ASN   3   0.375   3.003   3.628
   10    HB3  ASN   3           2HB      ASN   3  -0.905   4.915   4.108
   11   HD21  ASN   3          1HD2      ASN   3  -2.937   4.699   4.893
   12   HD22  ASN   3          2HD2      ASN   3  -3.327   4.710   6.575
   13    H    ASN   4           H        ASN   4   1.944   1.520   4.149
   14    HA   ASN   4           HA       ASN   4   3.129   1.836   6.805
   15    HB3  ASN   4           2HB      ASN   4   3.368  -0.513   7.173
   16   HD21  ASN   4          1HD2      ASN   4   0.883  -1.795   5.630
   17   HD22  ASN   4          2HD2      ASN   4  -0.422  -1.338   6.666
   18    H    SER   5           H        SER   5   5.207   0.096   6.619
   19    HA   SER   5           HA       SER   5   6.780   1.298   4.466
   20    HB3  SER   5           2HB      SER   5   8.700   0.179   5.808
   21    HG   SER   5           HG       SER   5   8.755   1.952   7.171
   22    H    CYS   6           H        CYS   6   4.878  -1.202   4.518
   23    HA   CYS   6           HA       CYS   6   6.279  -3.519   4.004
   24    HB3  CYS   6           2HB      CYS   6   3.821  -3.394   4.161
   25    H    GLN   7           H        GLN   7   7.395  -4.364   2.322
   26    HA   GLN   7           HA       GLN   7   7.894  -2.573   0.044
   27    HB3  GLN   7           2HB      GLN   7   9.925  -4.200  -0.222
   28    HG3  GLN   7           2HG      GLN   7   9.691  -2.104   1.908
   29   HE21  GLN   7          1HE2      GLN   7  11.861  -1.122   2.399
   30   HE22  GLN   7          2HE2      GLN   7  13.149  -2.216   2.754
   31    H    SER   8           H        SER   8   6.990  -5.830   0.960
   32    HA   SER   8           HA       SER   8   6.016  -6.289  -1.751
   33    HB3  SER   8           2HB      SER   8   6.998  -8.711  -1.474
   34    HG   SER   8           HG       SER   8   7.634  -7.132  -3.069
   35    H    HIS   9           H        HIS   9   3.985  -5.985  -0.667
   36    HA   HIS   9           HA       HIS   9   2.169  -6.600   0.603
   37    HB3  HIS   9           2HB      HIS   9   2.000  -8.015  -1.406
   38    HD1  HIS   9           1HD      HIS   9   4.216  -8.976  -2.375
   39    HD2  HIS   9           2HD      HIS   9   2.645 -11.139   0.804
   40    HE1  HIS   9           1HE      HIS   9   5.450 -11.167  -2.378
   41    H    SER  10           H        SER  10   4.479  -6.502   2.192
   42    HA   SER  10           HA       SER  10   4.624  -8.893   3.796
   43    HB3  SER  10           2HB      SER  10   6.002  -7.238   5.297
   44    HG   SER  10           HG       SER  10   6.980  -8.828   4.013
   45    H    ASP  11           H        ASP  11   3.591  -5.537   4.417
   46    HA   ASP  11           HA       ASP  11   2.017  -6.522   6.698
   47    HB3  ASP  11           2HB      ASP  11   1.905  -3.871   7.035
   48    H    CYS  12           H        CYS  12   1.808  -5.064   3.578
   49    HA   CYS  12           HA       CYS  12  -0.671  -3.803   3.700
   50    HB3  CYS  12           2HB      CYS  12  -0.754  -4.042   1.288
   51    H    ALA  13           H        ALA  13  -2.747  -4.518   2.855
   52    HA   ALA  13           HA       ALA  13  -3.286  -7.335   2.644
   53    HB1  ALA  13           1HB      ALA  13  -4.071  -5.811   5.102
   54    HB2  ALA  13           2HB      ALA  13  -5.010  -7.197   4.546
   55    HB3  ALA  13           3HB      ALA  13  -3.310  -7.396   4.973
   56    H    SER  14           H        SER  14  -5.633  -7.750   2.274
   57    HA   SER  14           HA       SER  14  -7.569  -7.351   1.148
   58    HB3  SER  14           2HB      SER  14  -7.273  -4.433   1.858
   59    HG   SER  14           HG       SER  14  -9.699  -5.573   2.173
   60    H    HIS  15           H        HIS  15  -5.435  -7.567  -0.451
   61    HA   HIS  15           HA       HIS  15  -4.557  -7.059  -2.492
   62    HB3  HIS  15           2HB      HIS  15  -6.219  -6.076  -4.128
   63    HD1  HIS  15           1HD      HIS  15  -5.097  -8.799  -3.969
   64    HD2  HIS  15           2HD      HIS  15  -9.072  -8.027  -3.037
   65    HE1  HIS  15           1HE      HIS  15  -6.291 -10.996  -4.243
   66    H    CYS  16           H        CYS  16  -3.658  -5.325  -0.623
   67    HA   CYS  16           HA       CYS  16  -3.908  -2.644  -1.792
   68    HB3  CYS  16           2HB      CYS  16  -2.434  -2.188   0.393
   69    H    ILE  17           H        ILE  17  -2.451  -2.174  -3.294
   70    HA   ILE  17           HA       ILE  17  -0.114  -3.573  -3.835
   71    HB   ILE  17           HB       ILE  17  -0.678  -0.671  -4.453
   72   HG13  ILE  17          2HG1      ILE  17  -1.437  -1.541  -6.645
   73   HG21  ILE  17          1HG2      ILE  17   0.861  -1.705  -6.486
   74   HG22  ILE  17          2HG2      ILE  17   1.434  -0.673  -5.177
   75   HG23  ILE  17          3HG2      ILE  17   1.568  -2.426  -5.040
   76   HD11  ILE  17          3HD1      ILE  17  -0.175  -3.819  -6.190
   77   HD12  ILE  17          1HD1      ILE  17  -1.752  -4.269  -5.544
   78   HD13  ILE  17          2HD1      ILE  17  -1.607  -3.726  -7.216
   79    H    CYS  18           H        CYS  18   1.975  -3.429  -3.195
   80    HA   CYS  18           HA       CYS  18   2.625  -1.405  -1.152
   81    HB3  CYS  18           2HB      CYS  18   4.308  -3.357  -0.454
   82    H    THR  19           H        THR  19   3.824   0.019  -2.280
   83    HA   THR  19           HA       THR  19   6.041  -1.028  -3.910
   84    HB   THR  19           HB       THR  19   5.507   1.820  -4.220
   85    HG1  THR  19           1HG      THR  19   3.399   1.654  -4.310
   86   HG21  THR  19          3HG2      THR  19   6.698  -0.137  -5.673
   87   HG22  THR  19          1HG2      THR  19   6.147   1.397  -6.345
   88   HG23  THR  19          2HG2      THR  19   5.130  -0.037  -6.473
   89    H    PHE  20           H        PHE  20   7.692   1.076  -4.091
   90    HA   PHE  20           HA       PHE  20   9.155   0.999  -1.710
   91    HB3  PHE  20           2HB      PHE  20  10.324   1.503  -3.716
   92    HD1  PHE  20           1HD      PHE  20   8.900   4.879  -3.243
   93    HD2  PHE  20           2HD      PHE  20   9.328   1.537  -5.845
   94    HE1  PHE  20           1HE      PHE  20   7.954   6.200  -5.091
   95    HE2  PHE  20           2HE      PHE  20   8.385   2.853  -7.696
   96    HZ   PHE  20           HZ       PHE  20   7.697   5.188  -7.322
   97    H    ARG  21           H        ARG  21   6.504   2.973  -2.648
   98    HA   ARG  21           HA       ARG  21   7.040   4.953  -0.569
   99    HB3  ARG  21           2HB      ARG  21   4.656   5.707  -1.583
  100    HG3  ARG  21           2HG      ARG  21   7.148   6.245  -3.162
  101    HD3  ARG  21           2HD      ARG  21   4.637   7.768  -2.522
  102    HE   ARG  21           HE       ARG  21   7.159   8.946  -2.887
  103   HH11  ARG  21          1HH1      ARG  21   3.901   9.157  -4.094
  104   HH12  ARG  21          2HH1      ARG  21   4.021  10.837  -4.501
  105   HH21  ARG  21          1HH2      ARG  21   7.330  11.158  -3.418
  106   HH22  ARG  21          2HH2      ARG  21   5.973  11.974  -4.116
  107    H    GLY  22           H        GLY  22   6.231   2.060  -0.128
  108    HA2  GLY  22           2HA      GLY  22   5.133   1.110   1.695
  109    HA3  GLY  22           3HA      GLY  22   4.300   2.635   1.957
  110    H    CYS  23           H        CYS  23   2.559   0.929   2.341
  111    HA   CYS  23           HA       CYS  23   1.427  -0.456   0.153
  112    HB3  CYS  23           2HB      CYS  23  -0.562  -0.693   1.615
  113    H    GLY  24           H        GLY  24  -1.010  -0.002  -0.391
  114    HA2  GLY  24           2HA      GLY  24  -1.623   2.830  -0.627
  115    HA3  GLY  24           3HA      GLY  24  -1.286   2.001  -2.140
  116    H    ALA  25           H        ALA  25  -3.756   3.274  -1.251
  117    HA   ALA  25           HA       ALA  25  -5.529   0.917  -1.264
  118    HB1  ALA  25           1HB      ALA  25  -6.961   1.899   0.198
  119    HB2  ALA  25           2HB      ALA  25  -5.475   2.693   0.718
  120    HB3  ALA  25           3HB      ALA  25  -6.592   3.531  -0.360
  121    H    VAL  26           H        VAL  26  -7.766   1.515  -2.186
  122    HA   VAL  26           HA       VAL  26  -7.557   2.040  -4.886
  123    HB   VAL  26           HB       VAL  26 -10.045   2.574  -4.772
  124   HG11  VAL  26          1HG1      VAL  26 -10.309   0.387  -5.074
  125   HG12  VAL  26          2HG1      VAL  26  -8.637   0.174  -4.550
  126   HG13  VAL  26          3HG1      VAL  26  -9.952   0.052  -3.380
  127   HG21  VAL  26          3HG2      VAL  26  -9.905   1.628  -1.938
  128   HG22  VAL  26          1HG2      VAL  26  -9.741   3.344  -2.310
  129   HG23  VAL  26          2HG2      VAL  26 -11.206   2.477  -2.771
  130    H    ASN  27           H        ASN  27  -7.512   3.810  -6.145
  131    HA   ASN  27           HA       ASN  27  -7.271   5.989  -6.754
  132    HB3  ASN  27           2HB      ASN  27  -8.873   7.575  -5.363
  133   HD21  ASN  27          1HD2      ASN  27 -10.344   8.327  -6.730
  134   HD22  ASN  27          2HD2      ASN  27 -10.972   7.473  -8.094
  135    H    GLY  28           H        GLY  28  -5.611   4.875  -4.543
  136    HA2  GLY  28           2HA      GLY  28  -4.033   5.592  -3.037
  137    HA3  GLY  28           3HA      GLY  28  -4.036   7.078  -3.976
  138    H    LEU  29           H        LEU  29  -5.483   5.423  -1.231
  139    HA   LEU  29           HA       LEU  29  -6.013   8.040  -0.025
  140    HB3  LEU  29           2HB      LEU  29  -8.064   6.412   0.910
  141    HG   LEU  29           HG       LEU  29  -8.085   8.909   0.097
  142   HD11  LEU  29          1HD1      LEU  29  -8.691   7.340  -2.352
  143   HD12  LEU  29          2HD1      LEU  29  -7.851   8.880  -2.172
  144   HD13  LEU  29          3HD1      LEU  29  -9.609   8.815  -2.053
  145   HD21  LEU  29          3HD2      LEU  29 -10.490   8.874   0.170
  146   HD22  LEU  29          1HD2      LEU  29  -9.864   7.709   1.338
  147   HD23  LEU  29          2HD2      LEU  29 -10.515   7.149  -0.202
  148    HA   PRO  30           HA       PRO  30  -4.286   6.367   3.645
  149    HB3  PRO  30           2HB      PRO  30  -4.635   8.413   4.631
  150    HG3  PRO  30           2HG      PRO  30  -6.556   9.646   4.188
  151    HD3  PRO  30           2HD      PRO  30  -5.891   9.161   2.036