*HEADER    TRANSPORT PROTEIN                       17-JUL-15   2N5I              
*TITLE     PLTL-PYRROLYL                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PEPTIDYL CARRIER PROTEIN PLTL;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PROTEGENS PF-5;                     
*SOURCE   3 ORGANISM_TAXID: 220664;                                              
*SOURCE   4 STRAIN: PF-5 / ATCC BAA-477;                                         
*SOURCE   5 GENE: PFL_2786, PLTL;                                                
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET22B                                     
*KEYWDS    PEPTIDYL CARRIER PROTEIN, PYOLUTEORIN, PLTL, PYRROLE, TRANSPORT       
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    M.J.JAREMKO, D.J.LEE, M.D.BURKART                                     
*REVDAT   1   16-SEP-15 2N5I    0                                                


 85 ALA  H      85 ALA  QB      2.96            #peak 1548 #SUP 1.00
 89 LEU  H      89 LEU  HB3     3.05            #peak 1608 #SUP 0.94 #QF 0.93
 72 ASP  H      75 ALA  QB      2.99            #peak 1233 #SUP 0.92 #QF 0.92
 10 ILE  HB     11 ARG  H       3.03            #peak 124 #SUP 0.74 #QF 0.74
 84 LYS  H      84 LYS  HB2     3.04            #peak 1518 #SUP 0.97 #QF 0.97
 43 MET  QE     44 ASN  H       4.39            #peak 1445 #SUP 1.00 #QF 0.28
 23 ALA  HA     24 LYS  H       3.05            #peak 305 #SUP 0.92 #QF 0.92
  5 GLU  H       5 GLU  QB      3.05            #peak 49 #SUP 0.87 #QF 0.87
 12 ARG  H      12 ARG  HB2     3.05            #peak 143 #SUP 0.97 #QF 0.97
 10 ILE  H      10 ILE  HB      3.08            #peak 113 #SUP 0.96 #QF 0.96
 78 ARG  H      78 ARG  QB      3.09            #peak 1406 #SUP 0.98 #QF 0.98
 82 GLN  H      82 GLN  HB3     3.69            #peak 1464 #SUP 0.94 #QF 0.94
 17 ASP  H      17 ASP  QB      3.10            #peak 229 #SUP 0.88 #QF 0.88
 83 LEU  H      83 LEU  HG      3.12            #peak 1508 #SUP 0.99 #QF 0.99
 77 SER  H      77 SER  HB2     3.60            #peak 1381 #SUP 1.00
 58 VAL  HA     59 SER  H       3.12            #peak 1034 #SUP 0.85 #QF 0.85
 84 LYS  H      84 LYS  HB3     3.71            #peak 1519 #SUP 1.00
 75 ALA  H      75 ALA  QB      3.13            #peak 1327 #SUP 1.00
 12 ARG  H      12 ARG  HB3     3.74            #peak 142 #SUP 1.00
 86 GLU  H      86 GLU  HB2     3.71            #peak 1557 #SUP 0.97 #QF 0.97
 13 TYR  H      13 TYR  HB3     3.16            #peak 164 #SUP 0.94 #QF 0.94
 15 MET  H      15 MET  QB      3.16            #peak 193 #SUP 0.98 #QF 0.98
 87 SER  H      87 SER  QB      3.17            #peak 1577 #SUP 0.86 #QF 0.86
 28 LEU  HA     29 ASP  H       3.19            #peak 378 #SUP 0.91 #QF 0.91
 88 ALA  H      88 ALA  QB      3.19            #peak 1592 #SUP 0.99 #QF 0.99
  8 GLU  H       8 GLU  HB2     3.70            #peak 84 #SUP 0.89 #QF 0.89
  6 VAL  H       6 VAL  HB      3.79            #peak 57 #SUP 1.00
 15 MET  QE     27 GLU  H       4.22            #peak 349 #SUP 1.00 #QF 0.35
 27 GLU  H      27 GLU  HB3     3.84            #peak 350 #SUP 0.93 #QF 0.93
  9 LYS  H       9 LYS  HB2     3.60            #peak 100 #SUP 0.98 #QF 0.98
 36 GLU  H      36 GLU  HB2     4.02            #peak 915 #SUP 0.98 #QF 0.80
 80 VAL  H      80 VAL  QG1     3.23            #peak 1441 #SUP 1.00
 80 VAL  H      80 VAL  HB      3.23            #peak 1440 #SUP 0.96 #QF 0.96
 30 ASP  H      30 ASP  HB3     3.82            #peak 397 #SUP 0.96 #QF 0.28
  4 GLU  H       4 GLU  HB2     3.65            #peak 31 #SUP 0.94 #QF 0.94
 90 GLU  H      90 GLU  QB      3.24            #peak 1615 #SUP 0.99 #QF 0.99
  4 GLU  H       4 GLU  HB3     3.65            #peak 32 #SUP 0.99 #QF 0.99
  7 LYS  H       7 LYS  HB2     3.25            #peak 66 #SUP 0.97 #QF 0.97
 15 MET  QB     16 GLU  H       3.25            #peak 219 #SUP 0.58 #QF 0.58
 59 SER  HA     60 ILE  H       3.25            #peak 1063 #SUP 0.87 #QF 0.87
 29 ASP  HA     30 ASP  H       3.26            #peak 402 #SUP 0.95 #QF 0.95
 53 ARG  H      53 ARG  HB2     3.35            #peak 916 #SUP 0.98 #QF 0.65
  7 LYS  H       7 LYS  HB3     3.68            #peak 67 #SUP 1.00
  8 GLU  H       8 GLU  HB3     3.70            #peak 85 #SUP 0.98 #QF 0.98
 85 ALA  H      86 GLU  H       3.29            #peak 1568 #SUP 0.67 #QF 0.67
 18 LEU  HB3    19 ILE  H       3.65            #peak 260 #SUP 0.99 #QF 0.73
 19 ILE  H      19 ILE  HB      3.82            #peak 260 #SUP 0.99 #QF 0.73
 31 GLN  H      32 THR  H       3.29            #peak 451 #SUP 0.97 #QF 0.97
 13 TYR  H      13 TYR  HB2     3.30            #peak 165 #SUP 0.97 #QF 0.97
 69 TYR  H      69 TYR  QD      3.78            #peak 1185 #SUP 0.89 #QF 0.48
 26 ASP  H      26 ASP  QB      3.31            #peak 331 #SUP 0.97 #QF 0.97
 32 THR  H      32 THR  HB      3.89            #peak 457 #SUP 1.00 #QF 0.99
 49 MET  H      49 MET  HG2     3.73            #peak 837 #SUP 0.96 #QF 0.96
 71 LYS  H      72 ASP  H       3.83            #peak 1210 #SUP 1.00 #QF 0.97
 19 ILE  HB     20 GLY  H       3.32            #peak 276 #SUP 0.87 #QF 0.87
  7 LYS  H       8 GLU  H       3.66            #peak 75 #SUP 0.98 #QF 0.91
 23 ALA  H      23 ALA  QB      3.33            #peak 292 #SUP 0.98 #QF 0.98
 77 SER  H      77 SER  HB3     3.60            #peak 1380 #SUP 0.76 #QF 0.76
 24 LYS  HA     25 GLU  H       3.34            #peak 323 #SUP 0.92 #QF 0.92
 76 ILE  H      76 ILE  HG13    3.35            #peak 1367 #SUP 1.00
 29 ASP  HB3    30 ASP  H       3.35            #peak 395 #SUP 0.84 #QF 0.84
 16 GLU  H      16 GLU  HB3     3.71            #peak 218 #SUP 0.98 #QF 0.98
  9 LYS  H       9 LYS  HB3     3.60            #peak 101 #SUP 0.76 #QF 0.76
 85 ALA  QB     86 GLU  H       3.37            #peak 1555 #SUP 0.93 #QF 0.93
 81 GLU  H      81 GLU  HG2     3.79            #peak 1448 #SUP 0.99 #QF 0.99
 54 ASP  H      54 ASP  HB2     3.38            #peak 923 #SUP 0.93 #QF 0.93
 76 ILE  H      76 ILE  QD1     3.79            #peak 1368 #SUP 1.00
 14 ILE  H      14 ILE  QG2     3.79            #peak 184 #SUP 1.00
 14 ILE  H      14 ILE  QD1     3.58            #peak 185 #SUP 0.99 #QF 0.99
 53 ARG  HA     58 VAL  H       3.49            #peak 1016 #SUP 1.00 #QF 0.83
 54 ASP  H      54 ASP  HB3     3.38            #peak 924 #SUP 0.90 #QF 0.90
 33 PRO  HA     34 LEU  H       3.38            #peak 480 #SUP 0.88 #QF 0.88
 82 GLN  H      83 LEU  H       3.38            #peak 1487 #SUP 0.95 #QF 0.95
 51 TYR  H      51 TYR  HB2     3.39            #peak 876 #SUP 0.96 #QF 0.96
 88 ALA  QB     89 LEU  H       3.39            #peak 1610 #SUP 0.92 #QF 0.92
 30 ASP  H      30 ASP  HB2     3.82            #peak 396 #SUP 0.98 #QF 0.98
 82 GLN  HA     85 ALA  H       3.61            #peak 1539 #SUP 0.93 #QF 0.93
 83 LEU  HA     87 SER  H       3.83            #peak 1578 #SUP 0.44 #QF 0.44
 84 LYS  HB2    85 ALA  H       3.41            #peak 1547 #SUP 0.95 #QF 0.95
 39 ILE  H      40 LEU  H       3.41            #peak 609 #SUP 0.98 #QF 0.98
 74 ASN  H      74 ASN  HB3     3.68            #peak 1281 #SUP 0.94 #QF 0.94
 39 ILE  H      39 ILE  HB      3.42            #peak 594 #SUP 0.99 #QF 0.99
 35 LEU  H      36 GLU  H       3.70            #peak 7 #SUP 0.96 #QF 0.64
 60 ILE  H      60 ILE  HB      3.43            #peak 1053 #SUP 0.95 #QF 0.95
 70 PHE  H      71 LYS  H       3.43            #peak 1202 #SUP 0.83 #QF 0.83
 84 LYS  H      85 ALA  H       3.43            #peak 1534 #SUP 0.98 #QF 0.98
 56 MET  H      57 GLY  H       3.43            #peak 989 #SUP 0.92 #QF 0.92
 89 LEU  H      89 LEU  HB2     3.64            #peak 1609 #SUP 0.99 #QF 0.99
 31 GLN  H      31 GLN  HB3     3.86            #peak 423 #SUP 0.99 #QF 0.99
 17 ASP  H      18 LEU  H       3.44            #peak 4 #SUP 0.90 #QF 0.90
 23 ALA  QB     24 LYS  H       3.44            #peak 310 #SUP 0.98 #QF 0.98
 65 ILE  HA     66 THR  H       3.46            #peak 1128 #SUP 0.97 #QF 0.97
 18 LEU  H      19 ILE  H       3.46            #peak 254 #SUP 0.92 #QF 0.92
  6 VAL  HB      7 LYS  H       4.12            #peak 65 #SUP 0.51 #QF 0.51
 51 TYR  H      51 TYR  HB3     3.47            #peak 877 #SUP 0.97 #QF 0.97
 81 GLU  H      83 LEU  H       4.34            #peak 1486 #SUP 0.77 #QF 0.77
 11 ARG  H      73 LEU  QQD     3.48            #peak 120 #SUP 0.96 #QF 0.96
 14 ILE  H      14 ILE  HB      3.48            #peak 181 #SUP 0.99 #QF 0.99
 45 ILE  H      45 ILE  HB      3.48            #peak 757 #SUP 0.98 #QF 0.98
 80 VAL  H      82 GLN  H       4.35            #peak 1454 #SUP 0.78 #QF 0.78
 19 ILE  H      19 ILE  QD1     3.49            #peak 264 #SUP 0.99 #QF 0.99
 49 MET  H      49 MET  QB      3.49            #peak 838 #SUP 1.00
 14 ILE  H      14 ILE  HG13    3.99            #peak 180 #SUP 0.99 #QF 0.99
 16 GLU  H      16 GLU  HB2     3.71            #peak 217 #SUP 1.00
 69 TYR  H      70 PHE  H       3.50            #peak 1201 #SUP 0.81 #QF 0.81
 55 GLU  H      55 GLU  HB2     3.55            #peak 962 #SUP 0.98 #QF 0.98
 52 ILE  H      52 ILE  HB      3.50            #peak 889 #SUP 0.97 #QF 0.97
 18 LEU  H      18 LEU  HB2     3.50            #peak 247 #SUP 0.99 #QF 0.99
 14 ILE  HB     15 MET  H       3.51            #peak 192 #SUP 0.58 #QF 0.58
 37 TRP  H      37 TRP  HB2     3.52            #peak 536 #SUP 0.98 #QF 0.98
 12 ARG  HB3    13 TYR  H       3.52            #peak 167 #SUP 0.90 #QF 0.90
 16 GLU  H      17 ASP  H       3.52            #peak 223 #SUP 0.99 #QF 0.99
 25 GLU  H      25 GLU  HB2     4.16            #peak 326 #SUP 0.94 #QF 0.94
 31 GLN  H      31 GLN  HB2     3.86            #peak 424 #SUP 0.98 #QF 0.98
 24 LYS  H      24 LYS  HB2     4.17            #peak 308 #SUP 0.98 #QF 0.98
 19 ILE  H      19 ILE  QG2     3.97            #peak 265 #SUP 0.99 #QF 0.99
 14 ILE  H      14 ILE  HG12    3.99            #peak 186 #SUP 1.00
 27 GLU  H      28 LEU  H       3.55            #peak 370 #SUP 0.97 #QF 0.97
 26 ASP  H      27 GLU  H       3.55            #peak 5 #SUP 0.60 #QF 0.60
 55 GLU  H      55 GLU  HB3     3.55            #peak 963 #SUP 0.98 #QF 0.98
 18 LEU  H      18 LEU  QD1     4.31            #peak 250 #SUP 0.99 #QF 0.99
 34 LEU  H      34 LEU  QD1     3.92            #peak 468 #SUP 1.00
 35 LEU  H      35 LEU  HB3     4.11            #peak 501 #SUP 0.99 #QF 0.76
 28 LEU  H      28 LEU  HB2     3.59            #peak 357 #SUP 0.99 #QF 0.99
  6 VAL  H       6 VAL  QG2     3.80            #peak 58 #SUP 0.99 #QF 0.99
 15 MET  HA     19 ILE  H       4.08            #peak 256 #SUP 0.98 #QF 0.58
 52 ILE  H      52 ILE  QG2     4.17            #peak 886 #SUP 1.00
 52 ILE  H      52 ILE  HG12    4.39            #peak 886 #SUP 1.00
 15 MET  H      19 ILE  QD1     3.58            #peak 188 #SUP 0.50 #QF 0.50
 74 ASN  H      75 ALA  H       3.58            #peak 1291 #SUP 0.87 #QF 0.87
 43 MET  H      43 MET  QE      3.66            #peak 683 #SUP 1.00 #QF 0.86
 76 ILE  H      76 ILE  HG12    3.58            #peak 1363 #SUP 0.95 #QF 0.95
 37 TRP  H      38 GLY  H       3.58            #peak 569 #SUP 0.81 #QF 0.81
 82 GLN  H      82 GLN  HG2     4.02            #peak 1463 #SUP 0.97 #QF 0.97
  7 LYS  HB3     8 GLU  H       3.59            #peak 90 #SUP 0.95 #QF 0.95
 31 GLN  H      31 GLN  QG      3.59            #peak 428 #SUP 0.98 #QF 0.98
 71 LYS  H      71 LYS  HB2     3.70            #peak 1223 #SUP 1.00
 28 LEU  H      28 LEU  HB3     3.59            #peak 359 #SUP 0.99 #QF 0.99
 55 GLU  H      56 MET  H       3.60            #peak 947 #SUP 0.94 #QF 0.94
 59 SER  H      59 SER  HB2     3.72            #peak 1036 #SUP 0.94 #QF 0.94
 83 LEU  H      83 LEU  QD1     3.80            #peak 1511 #SUP 0.99 #QF 0.98
  7 LYS  HB2     8 GLU  H       3.61            #peak 86 #SUP 0.96 #QF 0.96
 58 VAL  QG2    59 SER  H       4.46            #peak 1046 #SUP 0.93 #QF 0.93
 19 ILE  QG2    20 GLY  H       3.62            #peak 280 #SUP 0.67 #QF 0.67
 40 LEU  H      40 LEU  QD2     4.23            #peak 627 #SUP 1.00
 18 LEU  H      18 LEU  QD2     4.31            #peak 249 #SUP 0.99 #QF 0.99
  8 GLU  H       8 GLU  HG2     4.29            #peak 83 #SUP 0.89 #QF 0.85
  8 GLU  H       8 GLU  HG3     4.29            #peak 83 #SUP 0.89 #QF 0.85
  8 GLU  H       9 LYS  H       3.64            #peak 93 #SUP 0.50 #QF 0.50
 27 GLU  H      27 GLU  QG      3.64            #peak 348 #SUP 0.97 #QF 0.97
  4 GLU  H       4 GLU  HG2     3.73            #peak 33 #SUP 0.99 #QF 0.99
 76 ILE  HB     77 SER  H       3.64            #peak 1372 #SUP 0.95 #QF 0.95
 84 LYS  H      84 LYS  HG3     3.87            #peak 1517 #SUP 1.00
 58 VAL  H      58 VAL  QG1     4.28            #peak 1006 #SUP 0.96 #QF 0.96
 16 GLU  HB3    17 ASP  H       4.33            #peak 333 #SUP 0.47 #QF 0.47
 65 ILE  H      65 ILE  HB      3.67            #peak 13 #SUP 0.92 #QF 0.92
 18 LEU  H      18 LEU  HB3     3.67            #peak 245 #SUP 0.96 #QF 0.96
 74 ASN  H      74 ASN  HB2     3.68            #peak 1280 #SUP 0.98 #QF 0.98
 71 LYS  H      75 ALA  QB      3.68            #peak 1225 #SUP 0.67 #QF 0.67
 76 ILE  H      76 ILE  HB      3.68            #peak 1364 #SUP 1.00
 17 ASP  QB     18 LEU  H       3.69            #peak 246 #SUP 0.85 #QF 0.85
 39 ILE  HB     40 LEU  H       3.69            #peak 622 #SUP 0.84 #QF 0.84
 76 ILE  QG2    77 SER  H       3.69            #peak 1369 #SUP 0.99 #QF 0.99
 83 LEU  H      85 ALA  H       4.15            #peak 1535 #SUP 0.81 #QF 0.81
 86 GLU  H      86 GLU  HG3     4.01            #peak 1560 #SUP 1.00
 49 MET  QB     50 VAL  H       3.80            #peak 851 #SUP 1.00 #QF 0.85
 15 MET  H      15 MET  HG2     3.73            #peak 194 #SUP 0.99 #QF 0.99
 15 MET  QE     28 LEU  H       3.84            #peak 360 #SUP 0.90 #QF 0.82
 27 GLU  HB2    28 LEU  H       4.52            #peak 360 #SUP 0.90 #QF 0.82
 52 ILE  H      52 ILE  HG13    4.39            #peak 890 #SUP 0.98 #QF 0.98
 71 LYS  H      71 LYS  HB3     3.70            #peak 1222 #SUP 1.00
 37 TRP  H      37 TRP  HB3     3.71            #peak 535 #SUP 0.88 #QF 0.88
 36 GLU  H      37 TRP  H       3.72            #peak 526 #SUP 0.77 #QF 0.77
 59 SER  H      59 SER  HB3     3.72            #peak 1035 #SUP 0.97 #QF 0.97
 79 THR  H      79 THR  HB      3.72            #peak 1421 #SUP 0.93 #QF 0.93
 15 MET  H      15 MET  HG3     3.73            #peak 195 #SUP 0.99 #QF 0.99
 40 LEU  H      40 LEU  HG      3.73            #peak 623 #SUP 1.00
 49 MET  H      49 MET  HG3     3.73            #peak 836 #SUP 0.99 #QF 0.99
  4 GLU  H       4 GLU  HG3     3.73            #peak 34 #SUP 0.80 #QF 0.80
 13 TYR  HB3    14 ILE  H       3.73            #peak 179 #SUP 0.87 #QF 0.87
 53 ARG  H      54 ASP  H       3.73            #peak 521 #SUP 0.88 #QF 0.88
 57 GLY  H      58 VAL  H       3.73            #peak 991 #SUP 0.77 #QF 0.77
 40 LEU  H      40 LEU  HB3     3.74            #peak 624 #SUP 1.00
 48 LEU  H      49 MET  H       3.74            #peak 822 #SUP 0.95 #QF 0.95
 77 SER  HA     80 VAL  H       4.21            #peak 1433 #SUP 0.97 #QF 0.97
 78 ARG  QB     79 THR  H       3.75            #peak 1417 #SUP 0.74 #QF 0.74
 14 ILE  H      15 MET  H       3.76            #peak 172 #SUP 0.68 #QF 0.68
 89 LEU  H      90 GLU  H       3.76            #peak 1626 #SUP 0.74 #QF 0.74
 12 ARG  H      13 TYR  H       3.77            #peak 158 #SUP 0.88 #QF 0.88
 34 LEU  HA     39 ILE  H       4.00            #peak 600 #SUP 0.98 #QF 0.98
 66 THR  H      70 PHE  QD      3.78            #peak 1124 #SUP 0.66 #QF 0.66
 39 ILE  H      39 ILE  HG13    4.22            #peak 593 #SUP 0.99 #QF 0.99
 53 ARG  HB3    54 ASP  H       3.78            #peak 922 #SUP 0.90 #QF 0.90
 58 VAL  H      58 VAL  HB      3.78            #peak 1009 #SUP 0.95 #QF 0.95
 54 ASP  HB2    55 GLU  H       4.32            #peak 958 #SUP 0.89 #QF 0.89
 12 ARG  H      12 ARG  HG3     4.50            #peak 144 #SUP 1.00
 52 ILE  H      53 ARG  H       3.79            #peak 6 #SUP 0.63 #QF 0.63
 30 ASP  H      31 GLN  H       3.79            #peak 406 #SUP 0.84 #QF 0.84
 81 GLU  H      81 GLU  HG3     3.79            #peak 1447 #SUP 1.00
 10 ILE  H      11 ARG  H       3.80            #peak 118 #SUP 0.95 #QF 0.95
 18 LEU  HB2    19 ILE  H       3.80            #peak 263 #SUP 0.90 #QF 0.90
 51 TYR  HB2    52 ILE  H       3.80            #peak 891 #SUP 0.99 #QF 0.99
 48 LEU  H      48 LEU  HB2     3.84            #peak 802 #SUP 1.00 #QF 0.85
 28 LEU  QD2    29 ASP  H       4.29            #peak 390 #SUP 0.96 #QF 0.96
 47 LYS  H      47 LYS  HB2     3.82            #peak 791 #SUP 0.99 #QF 0.99
 75 ALA  H      76 ILE  H       3.82            #peak 1340 #SUP 0.97 #QF 0.97
 15 MET  H      16 GLU  H       3.82            #peak 206 #SUP 0.89 #QF 0.89
 78 ARG  H      78 ARG  HG3     3.93            #peak 1407 #SUP 1.00
 25 GLU  H      25 GLU  QG      3.82            #peak 325 #SUP 0.90 #QF 0.90
 65 ILE  H      65 ILE  HG13    4.12            #peak 12 #SUP 0.97 #QF 0.97
 13 TYR  H      14 ILE  H       3.83            #peak 157 #SUP 0.98 #QF 0.98
 54 ASP  HB3    55 GLU  H       4.32            #peak 959 #SUP 0.99 #QF 0.99
  5 GLU  H       7 LYS  H       4.33            #peak 41 #SUP 0.72 #QF 0.72
 65 ILE  H      65 ILE  QD1     3.84            #peak 1108 #SUP 0.97 #QF 0.97
  5 GLU  H       5 GLU  QG      4.09            #peak 48 #SUP 0.95 #QF 0.95
 72 ASP  H      76 ILE  HG13    4.57            #peak 1230 #SUP 0.95 #QF 0.37
 51 TYR  HB3    52 ILE  H       3.86            #peak 892 #SUP 0.99 #QF 0.99
 74 ASN  HB3    75 ALA  H       4.02            #peak 1332 #SUP 0.98 #QF 0.98
 52 ILE  QG2    53 ARG  H       3.87            #peak 510 #SUP 0.86 #QF 0.86
 40 LEU  H      40 LEU  HB2     3.87            #peak 625 #SUP 1.00
 52 ILE  H      52 ILE  QD1     3.87            #peak 885 #SUP 1.00
 84 LYS  H      84 LYS  HG2     3.87            #peak 1515 #SUP 1.00
 10 ILE  H      10 ILE  HG12    3.87            #peak 108 #SUP 1.00
 65 ILE  H      65 ILE  QG2     3.87            #peak 1107 #SUP 0.98 #QF 0.98
 65 ILE  H      65 ILE  HG12    4.12            #peak 1109 #SUP 0.94 #QF 0.94
 25 GLU  H      26 ASP  H       3.88            #peak 338 #SUP 0.95 #QF 0.95
 19 ILE  H      19 ILE  HG12    4.14            #peak 266 #SUP 0.94 #QF 0.94
 32 THR  H      32 THR  QG2     3.91            #peak 3 #SUP 0.89 #QF 0.89
 60 ILE  H      60 ILE  QG2     3.91            #peak 1049 #SUP 1.00
 60 ILE  H      60 ILE  HG13    4.01            #peak 1052 #SUP 1.00
 33 PRO  HB2    37 TRP  H       3.92            #peak 540 #SUP 0.64 #QF 0.64
 51 TYR  H      52 ILE  H       3.92            #peak 864 #SUP 0.57 #QF 0.57
 35 LEU  H      35 LEU  HG      4.17            #peak 502 #SUP 0.95 #QF 0.95
 49 MET  QB     51 TYR  H       4.42            #peak 878 #SUP 0.40 #QF 0.40
 78 ARG  H      78 ARG  HG2     3.93            #peak 1408 #SUP 0.95 #QF 0.95
 46 VAL  QG1    50 VAL  H       4.27            #peak 846 #SUP 1.00 #QF 0.21
 11 ARG  H      12 ARG  H       3.96            #peak 154 #SUP 0.86 #QF 0.86
 47 LYS  H      47 LYS  HD3     3.96            #peak 793 #SUP 1.00
 50 VAL  QG2    51 TYR  H       3.96            #peak 883 #SUP 0.98 #QF 0.98
 39 ILE  H      39 ILE  HG12    4.22            #peak 592 #SUP 1.00
 87 SER  QB     88 ALA  H       3.97            #peak 1598 #SUP 0.89 #QF 0.89
 26 ASP  QB     27 GLU  H       3.97            #peak 347 #SUP 0.76 #QF 0.76
 66 THR  QG2    69 TYR  H       3.99            #peak 1182 #SUP 0.85 #QF 0.60
 13 TYR  H      13 TYR  QD      4.23            #peak 159 #SUP 1.00
 12 ARG  H      12 ARG  HG2     4.50            #peak 145 #SUP 1.00
 47 LYS  H      47 LYS  HD2     4.04            #peak 794 #SUP 1.00 #QF 0.99
 50 VAL  H      51 TYR  H       4.00            #peak 865 #SUP 0.96 #QF 0.96
 53 ARG  HB2    54 ASP  H       4.25            #peak 921 #SUP 0.99 #QF 0.99
 60 ILE  H      60 ILE  HG12    4.01            #peak 1050 #SUP 1.00
 49 MET  H      50 VAL  QG1     4.01            #peak 842 #SUP 0.59 #QF 0.59
 50 VAL  QG1    51 TYR  H       4.01            #peak 882 #SUP 0.99 #QF 0.99
 70 PHE  H      70 PHE  HB2     4.01            #peak 1192 #SUP 0.99 #QF 0.99
 74 ASN  HB2    75 ALA  H       4.02            #peak 1331 #SUP 0.99 #QF 0.99
 11 ARG  H      11 ARG  HG3     4.05            #peak 123 #SUP 0.90 #QF 0.90
 11 ARG  H      11 ARG  HG2     4.05            #peak 122 #SUP 0.95 #QF 0.95
 28 LEU  H      28 LEU  QD2     4.30            #peak 354 #SUP 0.99 #QF 0.99
 28 LEU  H      28 LEU  QD1     4.30            #peak 355 #SUP 0.94 #QF 0.94
 35 LEU  H      35 LEU  QD1     4.19            #peak 508 #SUP 0.97 #QF 0.94
 34 LEU  H      72 ASP  HA      4.06            #peak 479 #SUP 0.99 #QF 0.99
 33 PRO  HG3    37 TRP  HE1     4.06            #peak 548 #SUP 0.93 #QF 0.93
 22 SER  H      23 ALA  H       4.06            #peak 302 #SUP 0.87 #QF 0.87
 35 LEU  H      35 LEU  HB2     4.11            #peak 500 #SUP 1.00
 46 VAL  HA     49 MET  H       4.07            #peak 833 #SUP 0.89 #QF 0.89
 55 GLU  H      55 GLU  HG3     4.76            #peak 960 #SUP 1.00
 50 VAL  HA     53 ARG  H       4.08            #peak 8 #SUP 0.79 #QF 0.79
 35 LEU  H      35 LEU  QD2     4.19            #peak 507 #SUP 1.00
 73 LEU  HA     76 ILE  H       4.10            #peak 1355 #SUP 0.97 #QF 0.97
 83 LEU  HB2    84 LYS  H       4.64            #peak 1516 #SUP 0.93 #QF 0.93
 89 LEU  H      89 LEU  QD1     4.10            #peak 1612 #SUP 0.99 #QF 0.99
 89 LEU  H      89 LEU  QD2     4.10            #peak 1613 #SUP 1.00
 90 GLU  H      90 GLU  HG3     4.17            #peak 1619 #SUP 0.88 #QF 0.88
  9 LYS  HA     12 ARG  H       4.12            #peak 151 #SUP 0.64 #QF 0.64
 52 ILE  QG2    58 VAL  H       4.12            #peak 1007 #SUP 0.97 #QF 0.97
  8 GLU  HA     11 ARG  H       4.13            #peak 132 #SUP 0.85 #QF 0.85
 82 GLN  HA     84 LYS  H       4.64            #peak 1527 #SUP 0.91 #QF 0.91
 84 LYS  HA     86 GLU  H       4.64            #peak 1564 #SUP 0.83 #QF 0.83
 10 ILE  HA     13 TYR  H       4.13            #peak 161 #SUP 0.80 #QF 0.80
 47 LYS  H      48 LEU  H       4.13            #peak 784 #SUP 0.79 #QF 0.79
 72 ASP  H      75 ALA  H       4.14            #peak 1251 #SUP 1.00
  7 LYS  H       7 LYS  QG      4.14            #peak 68 #SUP 0.99 #QF 0.99
 72 ASP  HB3    73 LEU  H       4.15            #peak 1266 #SUP 0.96 #QF 0.96
 72 ASP  HB2    73 LEU  H       4.15            #peak 1267 #SUP 0.93 #QF 0.93
 14 ILE  HA     18 LEU  H       4.16            #peak 241 #SUP 0.88 #QF 0.88
 73 LEU  H      74 ASN  H       4.16            #peak 1292 #SUP 0.96 #QF 0.96
 24 LYS  H      24 LYS  HB3     4.17            #peak 309 #SUP 1.00
 47 LYS  H      47 LYS  HB3     4.17            #peak 790 #SUP 1.00
 48 LEU  H      48 LEU  HB3     4.17            #peak 800 #SUP 1.00
 53 ARG  H      53 ARG  HG2     4.69            #peak 512 #SUP 0.99 #QF 0.99
 25 GLU  QG     26 ASP  H       4.43            #peak 332 #SUP 0.97 #QF 0.97
 31 GLN  QG     74 ASN  HD21    4.43            #peak 1305 #SUP 0.80 #QF 0.80
  2 ASP  QB      3 GLY  H       4.17            #peak 16 #SUP 0.89 #QF 0.89
 90 GLU  H      90 GLU  HG2     4.17            #peak 1618 #SUP 0.81 #QF 0.81
 71 LYS  H      76 ILE  HG13    4.44            #peak 1227 #SUP 0.73 #QF 0.73
 73 LEU  H      73 LEU  QQD     4.19            #peak 1274 #SUP 0.99 #QF 0.99
 45 ILE  H      45 ILE  HG12    4.79            #peak 762 #SUP 1.00
 40 LEU  HA     44 ASN  HD22    4.49            #peak 735 #SUP 0.66 #QF 0.66
 59 SER  HB3    60 ILE  H       4.39            #peak 1059 #SUP 0.98 #QF 0.98
 45 ILE  H      46 VAL  H       4.21            #peak 745 #SUP 0.98 #QF 0.98
 31 GLN  HB2    32 THR  H       4.41            #peak 464 #SUP 0.99 #QF 0.99
 40 LEU  HB3    45 ILE  H       5.20            #peak 758 #SUP 1.00 #QF 0.21
 40 LEU  H      40 LEU  QD1     4.23            #peak 626 #SUP 1.00
 13 TYR  QD     14 ILE  H       4.25            #peak 175 #SUP 0.95 #QF 0.95
 82 GLN  H      83 LEU  HG      4.78            #peak 1466 #SUP 0.89 #QF 0.89
 51 TYR  QD     52 ILE  H       4.26            #peak 901 #SUP 0.80 #QF 0.80
 56 MET  H      56 MET  QE      4.37            #peak 969 #SUP 1.00 #QF 0.99
 34 LEU  H      37 TRP  H       4.79            #peak 484 #SUP 0.82 #QF 0.82
 48 LEU  HB3    49 MET  H       4.27            #peak 840 #SUP 0.98 #QF 0.98
 33 PRO  HG2    37 TRP  HE1     4.27            #peak 549 #SUP 0.87 #QF 0.87
 19 ILE  QG2    23 ALA  H       4.28            #peak 291 #SUP 0.84 #QF 0.84
 29 ASP  H      32 THR  H       4.29            #peak 376 #SUP 0.88 #QF 0.88
 35 LEU  H      72 ASP  HA      5.36            #peak 494 #SUP 0.84 #QF 0.84
 49 MET  H      52 ILE  QD1     4.82            #peak 843 #SUP 0.95 #QF 0.95
 20 GLY  H      23 ALA  QB      4.30            #peak 278 #SUP 0.65 #QF 0.65
 62 SER  HA     65 ILE  H       4.31            #peak 1115 #SUP 0.82 #QF 0.82
  6 VAL  HA      9 LYS  H       4.36            #peak 97 #SUP 0.90 #QF 0.90
 44 ASN  H      45 ILE  HB      4.38            #peak 707 #SUP 0.39 #QF 0.39
 19 ILE  QG2    24 LYS  H       4.38            #peak 314 #SUP 0.80 #QF 0.80
 47 LYS  HB2    48 LEU  H       4.39            #peak 803 #SUP 0.99 #QF 0.99
 59 SER  HB2    60 ILE  H       4.39            #peak 1060 #SUP 1.00
 70 PHE  H      76 ILE  HG13    5.50            #peak 1187 #SUP 0.87 #QF 0.87
 49 MET  H      50 VAL  H       4.40            #peak 862 #SUP 0.78 #QF 0.78
 29 ASP  H      32 THR  HB      4.40            #peak 380 #SUP 0.85 #QF 0.85
 50 VAL  QG2    54 ASP  H       4.40            #peak 918 #SUP 0.81 #QF 0.81
 31 GLN  HB3    32 THR  H       4.41            #peak 463 #SUP 0.84 #QF 0.84
 72 ASP  H      76 ILE  H       4.41            #peak 1250 #SUP 0.88 #QF 0.88
 24 LYS  H      25 GLU  H       4.41            #peak 303 #SUP 0.68 #QF 0.68
 49 MET  HA     52 ILE  H       4.42            #peak 896 #SUP 0.72 #QF 0.72
 73 LEU  QQD    74 ASN  H       4.42            #peak 1277 #SUP 0.97 #QF 0.97
 31 GLN  QG     74 ASN  HD22    4.43            #peak 1312 #SUP 0.95 #QF 0.95
 74 ASN  HA     77 SER  H       4.43            #peak 1383 #SUP 0.52 #QF 0.52
 17 ASP  H      18 LEU  HB2     4.71            #peak 231 #SUP 0.97 #QF 0.97
 77 SER  H      80 VAL  QG1     4.44            #peak 1370 #SUP 0.92 #QF 0.92
 58 VAL  HB     59 SER  H       4.45            #peak 1043 #SUP 1.00
 55 GLU  H      57 GLY  H       4.45            #peak 948 #SUP 0.99 #QF 0.99
 29 ASP  HB3    31 GLN  H       4.45            #peak 421 #SUP 0.81 #QF 0.81
 31 GLN  H      32 THR  HA      5.20            #peak 418 #SUP 0.72 #QF 0.37
 31 GLN  H      32 THR  HB      5.49            #peak 418 #SUP 0.72 #QF 0.37
 46 VAL  H      47 LYS  HB2     4.75            #peak 771 #SUP 0.76 #QF 0.76
 32 THR  QG2    37 TRP  H       5.50            #peak 544 #SUP 0.95 #QF 0.87
 29 ASP  HB2    32 THR  H       4.48            #peak 462 #SUP 0.29 #QF 0.29
 66 THR  QG2    68 LYS  H       4.89            #peak 1146 #SUP 1.00 #QF 0.68
 51 TYR  H      51 TYR  QD      4.48            #peak 868 #SUP 0.96 #QF 0.96
 35 LEU  HA     40 LEU  H       4.48            #peak 613 #SUP 0.77 #QF 0.77
 40 LEU  HA     44 ASN  HD21    4.49            #peak 718 #SUP 0.86 #QF 0.86
 46 VAL  H      47 LYS  H       4.49            #peak 779 #SUP 0.94 #QF 0.94
 11 ARG  HA     14 ILE  H       4.51            #peak 177 #SUP 0.42 #QF 0.42
 29 ASP  HA     31 GLN  H       4.79            #peak 415 #SUP 0.94 #QF 0.94
 36 GLU  HG2    37 TRP  H       5.50            #peak 538 #SUP 0.98 #QF 0.89
 36 GLU  HG3    37 TRP  H       5.50            #peak 538 #SUP 0.98 #QF 0.89
  7 LYS  HA     11 ARG  H       5.08            #peak 130 #SUP 0.98 #QF 0.98
 68 LYS  HB3    69 TYR  H       4.65            #peak 1181 #SUP 0.80 #QF 0.80
 73 LEU  H      75 ALA  QB      5.50            #peak 1272 #SUP 0.86 #QF 0.29
 23 ALA  QB     25 GLU  H       4.53            #peak 328 #SUP 0.94 #QF 0.94
 56 MET  QE     57 GLY  H       5.50            #peak 998 #SUP 0.90 #QF 0.24
 37 TRP  HB3    38 GLY  H       4.54            #peak 578 #SUP 0.97 #QF 0.97
 32 THR  H      33 PRO  HD3     4.83            #peak 458 #SUP 0.99 #QF 0.99
 74 ASN  H      76 ILE  H       4.55            #peak 1290 #SUP 0.85 #QF 0.85
 30 ASP  H      31 GLN  QG      4.55            #peak 394 #SUP 0.56 #QF 0.56
 30 ASP  H      73 LEU  QQD     4.83            #peak 391 #SUP 0.99 #QF 0.99
 55 GLU  HA     57 GLY  H       4.83            #peak 994 #SUP 0.99 #QF 0.99
 70 PHE  HA     76 ILE  H       4.55            #peak 1353 #SUP 0.97 #QF 0.97
 37 TRP  HB2    38 GLY  H       4.57            #peak 579 #SUP 0.92 #QF 0.92
 37 TRP  HA     37 TRP  HE1     5.14            #peak 560 #SUP 0.83 #QF 0.83
 64 HIS  H      65 ILE  H       4.57            #peak 1091 #SUP 0.70 #QF 0.70
 76 ILE  HA     79 THR  H       4.59            #peak 1420 #SUP 0.90 #QF 0.90
 76 ILE  HA     80 VAL  H       4.59            #peak 1435 #SUP 0.72 #QF 0.72
 32 THR  QG2    37 TRP  HE1     4.59            #peak 546 #SUP 0.97 #QF 0.97
 16 GLU  H      19 ILE  QD1     5.50            #peak 222 #SUP 0.87 #QF 0.70
 89 LEU  QD1    90 GLU  H       4.85            #peak 1614 #SUP 0.54 #QF 0.54
 50 VAL  HA     54 ASP  H       4.63            #peak 927 #SUP 0.92 #QF 0.92
 68 LYS  HG3    69 TYR  H       4.78            #peak 1183 #SUP 0.98 #QF 0.98
 38 GLY  H      39 ILE  HB      5.50            #peak 583 #SUP 0.84 #QF 0.74
 56 MET  H      57 GLY  QA      4.66            #peak 975 #SUP 0.99 #QF 0.99
 11 ARG  HA     15 MET  H       5.26            #peak 196 #SUP 0.41 #QF 0.41
 30 ASP  H      31 GLN  HA      5.50            #peak 401 #SUP 0.85 #QF 0.85
  2 ASP  QB      4 GLU  H       4.70            #peak 35 #SUP 0.72 #QF 0.72
 53 ARG  HB3    58 VAL  H       5.50            #peak 1010 #SUP 0.91 #QF 0.91
 68 LYS  HA     70 PHE  H       5.01            #peak 1197 #SUP 0.94 #QF 0.78
 70 PHE  H      71 LYS  HA      5.42            #peak 1197 #SUP 0.94 #QF 0.78
 60 ILE  QG2    66 THR  H       4.71            #peak 1140 #SUP 0.42 #QF 0.42
 45 ILE  H      45 ILE  QD1     4.71            #peak 763 #SUP 0.97 #QF 0.97
 46 VAL  HA     48 LEU  H       4.72            #peak 806 #SUP 0.86 #QF 0.86
 33 PRO  HG2    37 TRP  H       4.72            #peak 541 #SUP 0.79 #QF 0.79
 37 TRP  HB2    39 ILE  H       4.73            #peak 597 #SUP 0.99 #QF 0.99
 45 ILE  H      46 VAL  QG2     4.73            #peak 759 #SUP 0.98 #QF 0.98
 15 MET  H      18 LEU  HB2     5.31            #peak 190 #SUP 0.91 #QF 0.76
 15 MET  H      23 ALA  QB      5.50            #peak 190 #SUP 0.91 #QF 0.76
 11 ARG  H      11 ARG  HD2     5.23            #peak 129 #SUP 0.96 #QF 0.95
 11 ARG  H      12 ARG  QD      5.50            #peak 129 #SUP 0.96 #QF 0.95
 11 ARG  H      11 ARG  HD3     5.23            #peak 128 #SUP 1.00
  4 GLU  H       7 LYS  H       5.44            #peak 72 #SUP 0.88 #QF 0.54
 61 PRO  HG2    63 THR  H       4.74            #peak 1084 #SUP 0.87 #QF 0.87
 17 ASP  QB     20 GLY  H       5.50            #peak 277 #SUP 0.61 #QF 0.61
 47 LYS  HD3    48 LEU  H       5.42            #peak 801 #SUP 0.99 #QF 0.91
 33 PRO  HD3    37 TRP  HE1     4.78            #peak 556 #SUP 0.91 #QF 0.91
  3 GLY  H       4 GLU  H       4.78            #peak 40 #SUP 0.56 #QF 0.56
 18 LEU  H      20 GLY  H       5.08            #peak 268 #SUP 0.86 #QF 0.86
 68 LYS  HG2    69 TYR  H       4.78            #peak 1184 #SUP 0.63 #QF 0.63
 14 ILE  HA     19 ILE  H       4.80            #peak 258 #SUP 0.74 #QF 0.74
 42 SER  HA     45 ILE  H       4.80            #peak 750 #SUP 0.96 #QF 0.96
 16 GLU  H      18 LEU  H       4.81            #peak 234 #SUP 0.57 #QF 0.57
 82 GLN  H      85 ALA  QB      4.82            #peak 1467 #SUP 0.92 #QF 0.92
 36 GLU  H      37 TRP  HB2     5.50            #peak 914 #SUP 1.00 #QF 0.44
 61 PRO  HA     63 THR  H       4.82            #peak 1076 #SUP 0.78 #QF 0.78
 72 ASP  H      75 ALA  HA      4.83            #peak 1242 #SUP 0.87 #QF 0.87
 80 VAL  HA     84 LYS  H       4.83            #peak 1523 #SUP 1.00
 34 LEU  H      72 ASP  H       5.50            #peak 1248 #SUP 0.92 #QF 0.92
 76 ILE  QG2    78 ARG  H       5.13            #peak 1411 #SUP 0.99 #QF 0.99
 10 ILE  QG2    10 ILE  QD1     2.44            #peak 1126 #SUP 0.75 #QF 0.75
 52 ILE  QG2    56 MET  QE      2.80            #peak 3469 #SUP 0.86 #QF 0.79
 76 ILE  QG2    80 VAL  QG1     3.03            #peak 4444 #SUP 0.51 #QF 0.51
 24 LYS  HG3    24 LYS  QD      2.98            #peak 1857 #SUP 1.00
 24 LYS  QD     24 LYS  QE      2.97            #peak 1866 #SUP 1.00 #QF 0.99
 73 LEU  HB3    73 LEU  QQD     3.57            #peak 4181 #SUP 1.00
 45 ILE  QG2    45 ILE  QD1     2.91            #peak 2828 #SUP 0.89 #QF 0.89
  5 GLU  HA      5 GLU  QB      2.91            #peak 775 #SUP 0.99 #QF 0.99
 11 ARG  HG3    73 LEU  QQD     3.40            #peak 1705 #SUP 1.00
 84 LYS  QD     84 LYS  QE      2.94            #peak 938 #SUP 1.00
 82 GLN  HA     85 ALA  QB      2.94            #peak 4682 #SUP 0.84 #QF 0.84
 10 ILE  HB     10 ILE  QD1     3.33            #peak 1130 #SUP 1.00
 49 MET  QE     65 ILE  QD1     2.96            #peak 3086 #SUP 0.53 #QF 0.53
  9 LYS  QD      9 LYS  QE      3.00            #peak 1863 #SUP 0.70 #QF 0.60
 15 MET  HA     15 MET  QB      2.98            #peak 1285 #SUP 1.00
 24 LYS  HG2    24 LYS  QD      2.98            #peak 1878 #SUP 0.98 #QF 0.98
 26 ASP  HA     26 ASP  QB      2.99            #peak 3 #SUP 1.00
 10 ILE  QD1    56 MET  QE      3.02            #peak 3470 #SUP 0.45 #QF 0.45
 83 LEU  HB3    83 LEU  QD2     3.63            #peak 4617 #SUP 1.00 #QF 0.98
 10 ILE  QG2    10 ILE  HG12    3.28            #peak 1188 #SUP 0.99 #QF 0.99
 34 LEU  HB3    34 LEU  QD2     3.74            #peak 2248 #SUP 0.98 #QF 0.96
 18 LEU  HB2    18 LEU  QD1     3.52            #peak 1614 #SUP 1.00 #QF 0.98
 73 LEU  HB2    73 LEU  QQD     3.57            #peak 4182 #SUP 0.99 #QF 0.61
 89 LEU  HB3    89 LEU  QD2     3.58            #peak 4755 #SUP 1.00 #QF 0.97
 43 MET  HG2    43 MET  QE      3.68            #peak 2725 #SUP 0.99 #QF 0.94
 12 ARG  HB2    12 ARG  QD      3.45            #peak 1307 #SUP 0.90 #QF 0.72
 78 ARG  QB     78 ARG  QD      3.60            #peak 1307 #SUP 0.90 #QF 0.72
 84 LYS  HG3    84 LYS  QE      3.94            #peak 4658 #SUP 1.00
 19 ILE  QG2    19 ILE  HG13    3.47            #peak 1704 #SUP 0.98 #QF 0.98
 12 ARG  HB3    12 ARG  QD      3.31            #peak 1308 #SUP 0.94 #QF 0.94
 15 MET  HA     15 MET  QE      3.50            #peak 1442 #SUP 0.94 #QF 0.94
 11 ARG  HG2    73 LEU  QQD     3.40            #peak 4183 #SUP 0.89 #QF 0.89
 46 VAL  QG1    49 MET  QE      3.70            #peak 3087 #SUP 0.74 #QF 0.74
 89 LEU  HA     89 LEU  QD2     4.01            #peak 4753 #SUP 0.99 #QF 0.99
 19 ILE  QG2    23 ALA  QB      3.13            #peak 1810 #SUP 0.74 #QF 0.74
 18 LEU  HA     18 LEU  QD1     3.75            #peak 1565 #SUP 0.96 #QF 0.96
 83 LEU  HA     83 LEU  QD2     3.14            #peak 4626 #SUP 0.98 #QF 0.98
 49 MET  HG2    49 MET  QE      3.60            #peak 3091 #SUP 0.73 #QF 0.73
 52 ILE  HB     52 ILE  QD1     3.15            #peak 3249 #SUP 0.96 #QF 0.96
 15 MET  HA     19 ILE  HB      3.20            #peak 3297 #SUP 1.00 #QF 0.39
 19 ILE  HA     19 ILE  QG2     3.16            #peak 168 #SUP 1.00
 18 LEU  HA     18 LEU  QD2     3.75            #peak 1566 #SUP 1.00
 15 MET  QE     23 ALA  QB      3.16            #peak 1460 #SUP 0.68 #QF 0.68
 65 ILE  QG2    65 ILE  HG12    3.46            #peak 3826 #SUP 0.99 #QF 0.99
 52 ILE  QG2    58 VAL  QG1     3.64            #peak 3525 #SUP 0.96 #QF 0.96
 79 THR  QG2    83 LEU  QD1     3.19            #peak 4416 #SUP 0.54 #QF 0.54
 28 LEU  HB2    28 LEU  QD2     3.60            #peak 1999 #SUP 1.00
 40 LEU  HB3    40 LEU  QD2     3.41            #peak 2606 #SUP 0.99 #QF 0.99
 18 LEU  HB3    19 ILE  QD1     3.80            #peak 1682 #SUP 1.00 #QF 0.36
 34 LEU  HA     34 LEU  QD2     4.04            #peak 1623 #SUP 1.00
 34 LEU  HB2    40 LEU  QD2     4.31            #peak 2607 #SUP 1.00 #QF 0.70
 40 LEU  HB2    40 LEU  QD2     3.91            #peak 2607 #SUP 1.00 #QF 0.70
 35 LEU  HA     35 LEU  QD2     4.16            #peak 2341 #SUP 0.98 #QF 0.98
 14 ILE  HB     14 ILE  QD1     3.22            #peak 1387 #SUP 0.98 #QF 0.98
 63 THR  HA     63 THR  QG2     3.22            #peak 3706 #SUP 1.00
 19 ILE  HB     23 ALA  QB      3.75            #peak 1812 #SUP 0.84 #QF 0.44
 52 ILE  QG2    58 VAL  QG2     3.64            #peak 3541 #SUP 0.89 #QF 0.89
 40 LEU  HB3    45 ILE  QD1     3.72            #peak 2827 #SUP 0.99 #QF 0.76
 89 LEU  HB2    89 LEU  QD1     3.32            #peak 4744 #SUP 0.99 #QF 0.99
 71 LYS  HG2    71 LYS  QE      3.94            #peak 4094 #SUP 0.98 #QF 0.98
 60 ILE  HB     60 ILE  QD1     3.26            #peak 3580 #SUP 0.99 #QF 0.99
 80 VAL  QG1    81 GLU  H       3.26            #peak 4464 #SUP 0.91 #QF 0.91
 65 ILE  HA     65 ILE  QG2     3.26            #peak 2879 #SUP 0.99 #QF 0.99
 28 LEU  HB3    28 LEU  QD1     3.60            #peak 1986 #SUP 0.81 #QF 0.81
 10 ILE  QG2    10 ILE  HG13    3.28            #peak 1184 #SUP 0.99 #QF 0.99
 14 ILE  HA     18 LEU  QD2     4.51            #peak 1384 #SUP 1.00
 34 LEU  HB3    34 LEU  QD1     3.74            #peak 2239 #SUP 0.94 #QF 0.94
 40 LEU  HA     40 LEU  QD2     4.42            #peak 2244 #SUP 0.94 #QF 0.94
  4 GLU  HA      4 GLU  HG2     3.54            #peak 752 #SUP 0.97 #QF 0.97
 18 LEU  HB3    18 LEU  QD2     3.79            #peak 1630 #SUP 0.99 #QF 0.99
 45 ILE  QG2    46 VAL  QG2     3.29            #peak 2887 #SUP 0.98 #QF 0.98
  6 VAL  H       6 VAL  QG1     3.80            #peak 36 #SUP 0.95 #QF 0.95
 15 MET  HA     19 ILE  QD1     3.51            #peak 163 #SUP 0.95 #QF 0.49
 50 VAL  H      50 VAL  QG1     3.31            #peak 37 #SUP 0.89 #QF 0.89
 50 VAL  HA     50 VAL  QG2     3.31            #peak 3167 #SUP 1.00
 24 LYS  HG3    24 LYS  QE      3.36            #peak 1864 #SUP 0.99 #QF 0.99
 52 ILE  QD1    56 MET  QE      4.14            #peak 3248 #SUP 0.64 #QF 0.64
 52 ILE  HA     52 ILE  QG2     3.36            #peak 3210 #SUP 1.00
 28 LEU  HB2    28 LEU  QD1     3.60            #peak 1988 #SUP 0.82 #QF 0.82
 89 LEU  HB2    89 LEU  QD2     3.32            #peak 4745 #SUP 0.99 #QF 0.99
 31 GLN  HA     31 GLN  QG      3.33            #peak 2068 #SUP 0.99 #QF 0.99
 34 LEU  HB2    34 LEU  QD2     3.74            #peak 2249 #SUP 0.98 #QF 0.98
 39 ILE  HB     39 ILE  QD1     3.38            #peak 2511 #SUP 0.99 #QF 0.79
  7 LYS  HB2     7 LYS  HE3     3.85            #peak 933 #SUP 0.93 #QF 0.87
 84 LYS  HB2    84 LYS  QE      3.85            #peak 933 #SUP 0.93 #QF 0.87
 20 GLY  HA3    21 PRO  HD2     3.36            #peak 1729 #SUP 0.84 #QF 0.84
 80 VAL  HA     80 VAL  QG1     3.34            #peak 4434 #SUP 1.00
 27 GLU  HA     28 LEU  H       3.55            #peak 208 #SUP 0.99 #QF 0.99
 80 VAL  HB     81 GLU  H       3.97            #peak 4437 #SUP 0.98 #QF 0.98
 14 ILE  HA     14 ILE  HG12    4.07            #peak 1383 #SUP 0.98 #QF 0.98
 39 ILE  QG2    39 ILE  HG12    3.46            #peak 2557 #SUP 1.00
 47 LYS  HG2    47 LYS  QE      4.11            #peak 2979 #SUP 1.00 #QF 0.75
 65 ILE  HB     65 ILE  QD1     3.36            #peak 3772 #SUP 0.96 #QF 0.96
 50 VAL  H      50 VAL  HB      3.65            #peak 429 #SUP 0.99 #QF 0.94
 19 ILE  HA     19 ILE  QD1     3.36            #peak 1656 #SUP 0.89 #QF 0.89
 20 GLY  HA2    21 PRO  HD2     3.36            #peak 1717 #SUP 0.97 #QF 0.97
 24 LYS  HG2    24 LYS  QE      3.36            #peak 1865 #SUP 0.98 #QF 0.98
 39 ILE  HA     39 ILE  QG2     3.36            #peak 2545 #SUP 1.00
 48 LEU  HA     48 LEU  QD2     4.23            #peak 3046 #SUP 0.95 #QF 0.95
 73 LEU  HA     73 LEU  QQD     3.36            #peak 4153 #SUP 0.96 #QF 0.96
 34 LEU  HA     39 ILE  QD1     3.37            #peak 2504 #SUP 0.99 #QF 0.99
 46 VAL  HA     46 VAL  QG2     3.37            #peak 2914 #SUP 1.00
 62 SER  HA     65 ILE  QD1     3.37            #peak 3791 #SUP 0.90 #QF 0.90
 58 VAL  HA     58 VAL  QG2     3.44            #peak 3488 #SUP 1.00 #QF 0.99
 60 ILE  QG2    64 HIS  HB3     3.74            #peak 3617 #SUP 0.86 #QF 0.39
 89 LEU  HA     89 LEU  QD1     4.01            #peak 4734 #SUP 0.99 #QF 0.99
 45 ILE  QG2    46 VAL  QG1     4.23            #peak 2922 #SUP 0.90 #QF 0.90
 34 LEU  HB2    40 LEU  QD1     4.31            #peak 2585 #SUP 0.99 #QF 0.72
 40 LEU  HB2    40 LEU  QD1     3.91            #peak 2585 #SUP 0.99 #QF 0.72
 27 GLU  HA     27 GLU  QG      3.39            #peak 209 #SUP 0.99 #QF 0.99
 56 MET  HA     56 MET  HG2     3.83            #peak 477 #SUP 0.91 #QF 0.91
  6 VAL  HA      6 VAL  QG1     3.41            #peak 824 #SUP 0.69 #QF 0.69
 34 LEU  HA     34 LEU  QD1     4.04            #peak 2183 #SUP 0.98 #QF 0.98
  7 LYS  QG      7 LYS  HE3     3.74            #peak 4659 #SUP 1.00 #QF 0.98
 84 LYS  HG2    84 LYS  QE      3.94            #peak 4659 #SUP 1.00 #QF 0.98
 30 ASP  HA     73 LEU  HB3     3.78            #peak 1929 #SUP 0.87 #QF 0.87
 50 VAL  HA     50 VAL  QG1     3.41            #peak 3161 #SUP 0.82 #QF 0.82
 76 ILE  HA     76 ILE  HG13    3.41            #peak 4287 #SUP 0.98 #QF 0.98
  6 VAL  HA      6 VAL  QG2     3.41            #peak 834 #SUP 0.99 #QF 0.99
  9 LYS  HB3     9 LYS  QD      3.59            #peak 1065 #SUP 1.00 #QF 0.99
 46 VAL  HB     47 LYS  HD2     3.96            #peak 1065 #SUP 1.00 #QF 0.99
 25 GLU  HA     25 GLU  QG      3.41            #peak 1886 #SUP 0.81 #QF 0.81
 40 LEU  HB3    40 LEU  QD1     3.41            #peak 2587 #SUP 0.99 #QF 0.99
 46 VAL  HA     46 VAL  QG1     3.42            #peak 2924 #SUP 1.00
 81 GLU  HA     81 GLU  HG2     3.85            #peak 4479 #SUP 0.94 #QF 0.94
 15 MET  HG2    15 MET  QE      3.56            #peak 1459 #SUP 1.00
  7 LYS  HB3     7 LYS  HE3     4.35            #peak 4657 #SUP 0.99 #QF 0.62
 84 LYS  HB3    84 LYS  QE      4.70            #peak 4657 #SUP 0.99 #QF 0.62
 58 VAL  HA     58 VAL  QG1     3.44            #peak 3513 #SUP 1.00
 80 VAL  HA     80 VAL  QG2     3.45            #peak 4435 #SUP 1.00
  5 GLU  HA      5 GLU  QG      3.45            #peak 23 #SUP 1.00
 15 MET  QE     28 LEU  HG      4.31            #peak 2007 #SUP 0.99 #QF 0.99
 46 VAL  H      46 VAL  QG2     3.45            #peak 394 #SUP 0.95 #QF 0.95
 18 LEU  HA     18 LEU  HG      3.98            #peak 1564 #SUP 1.00
 39 ILE  QG2    39 ILE  HG13    3.46            #peak 2555 #SUP 1.00
 79 THR  HA     79 THR  QG2     3.46            #peak 4404 #SUP 1.00
 66 THR  HA     66 THR  QG2     3.46            #peak 3857 #SUP 0.98 #QF 0.98
 48 LEU  HB2    48 LEU  QD1     3.49            #peak 3036 #SUP 1.00 #QF 0.58
 19 ILE  HB     19 ILE  QD1     3.46            #peak 1668 #SUP 0.97 #QF 0.97
 65 ILE  QG2    65 ILE  HG13    3.46            #peak 3814 #SUP 0.94 #QF 0.94
 11 ARG  HB2    11 ARG  HD2     4.19            #peak 1240 #SUP 0.90 #QF 0.86
 35 LEU  HB2    35 LEU  QD2     3.70            #peak 2354 #SUP 1.00 #QF 0.99
 19 ILE  QG2    19 ILE  HG12    3.47            #peak 1693 #SUP 1.00
  9 LYS  HB2     9 LYS  QD      3.59            #peak 1066 #SUP 0.99 #QF 0.99
 39 ILE  QG2    40 LEU  HG      3.69            #peak 2556 #SUP 0.75 #QF 0.75
 60 ILE  HA     60 ILE  QG2     3.48            #peak 3613 #SUP 1.00
 48 LEU  HB2    48 LEU  QD2     3.49            #peak 3053 #SUP 0.97 #QF 0.97
 46 VAL  HA     49 MET  QE      3.49            #peak 3098 #SUP 0.99 #QF 0.99
 86 GLU  H      86 GLU  HB3     3.71            #peak 4695 #SUP 1.00
 76 ILE  HB     76 ILE  QD1     3.49            #peak 4836 #SUP 1.00
 35 LEU  QD1    67 GLY  HA3     4.50            #peak 292 #SUP 0.97 #QF 0.60
 12 ARG  HA     12 ARG  HG3     3.76            #peak 1286 #SUP 0.90 #QF 0.90
 18 LEU  HB3    18 LEU  QD1     3.79            #peak 1612 #SUP 0.95 #QF 0.93
 18 LEU  QD1    47 LYS  HB2     4.20            #peak 1612 #SUP 0.95 #QF 0.93
 32 THR  HA     32 THR  QG2     3.50            #peak 2093 #SUP 0.67 #QF 0.67
 10 ILE  HA     10 ILE  QG2     3.50            #peak 1179 #SUP 0.99 #QF 0.99
 76 ILE  HA     76 ILE  QG2     3.50            #peak 4289 #SUP 1.00
 45 ILE  QD1    65 ILE  QG2     3.50            #peak 3827 #SUP 0.40 #QF 0.40
 70 PHE  HA     76 ILE  HG13    3.50            #peak 4010 #SUP 0.87 #QF 0.87
 55 GLU  HA     55 GLU  HG3     3.90            #peak 3374 #SUP 0.98 #QF 0.98
 52 ILE  QG2    58 VAL  HB      4.38            #peak 3490 #SUP 0.93 #QF 0.93
 80 VAL  QG2    84 LYS  QD      3.95            #peak 4474 #SUP 0.75 #QF 0.75
  9 LYS  HA     12 ARG  HB2     4.06            #peak 1023 #SUP 1.00
 45 ILE  HB     45 ILE  QD1     3.51            #peak 2826 #SUP 0.95 #QF 0.95
 45 ILE  H      45 ILE  QG2     3.52            #peak 2870 #SUP 0.99 #QF 0.99
 77 SER  HA     80 VAL  QG1     3.52            #peak 635 #SUP 0.97 #QF 0.97
 18 LEU  HB2    18 LEU  QD2     3.52            #peak 1577 #SUP 0.91 #QF 0.91
 28 LEU  HA     28 LEU  QD1     3.75            #peak 221 #SUP 0.93 #QF 0.93
 45 ILE  QG2    45 ILE  HG13    3.55            #peak 2869 #SUP 0.96 #QF 0.96
 73 LEU  HA     76 ILE  HG13    5.08            #peak 4154 #SUP 0.99 #QF 0.91
 50 VAL  H      50 VAL  QG2     3.97            #peak 3165 #SUP 1.00
 28 LEU  HA     28 LEU  QD2     3.75            #peak 1948 #SUP 0.98 #QF 0.98
 58 VAL  QG1    84 LYS  HA      4.89            #peak 3514 #SUP 0.92 #QF 0.84
  4 GLU  HA      4 GLU  HG3     3.54            #peak 729 #SUP 0.99 #QF 0.99
 12 ARG  HA     12 ARG  HG2     3.76            #peak 1287 #SUP 1.00
 34 LEU  HA     39 ILE  QG2     3.99            #peak 2546 #SUP 0.99 #QF 0.99
 11 ARG  HB3    11 ARG  HD2     4.19            #peak 1238 #SUP 0.97 #QF 0.97
 45 ILE  QG2    45 ILE  HG12    3.55            #peak 2830 #SUP 0.99 #QF 0.99
  9 LYS  HB3     9 LYS  QE      4.08            #peak 1074 #SUP 0.97 #QF 0.97
 65 ILE  HA     65 ILE  QD1     3.55            #peak 3768 #SUP 0.99 #QF 0.99
 48 LEU  HB3    48 LEU  QD2     3.88            #peak 3056 #SUP 1.00
 14 ILE  HA     14 ILE  QG2     3.55            #peak 1385 #SUP 0.98 #QF 0.98
  5 GLU  QB      6 VAL  HA      4.22            #peak 799 #SUP 0.38 #QF 0.38
 15 MET  HA     19 ILE  HG13    4.04            #peak 4636 #SUP 1.00 #QF 0.69
 26 ASP  HA     27 GLU  H       3.56            #peak 1899 #SUP 0.96 #QF 0.96
 47 LYS  HB2    47 LYS  QE      4.22            #peak 2976 #SUP 1.00
 16 GLU  HA     16 GLU  HG3     3.68            #peak 1517 #SUP 0.86 #QF 0.86
 34 LEU  HA     34 LEU  HG      3.78            #peak 2178 #SUP 0.98 #QF 0.98
 15 MET  HG3    15 MET  QE      3.56            #peak 1458 #SUP 1.00
 30 ASP  HA     73 LEU  HB2     3.78            #peak 2039 #SUP 0.91 #QF 0.91
 83 LEU  HB2    83 LEU  QD1     4.17            #peak 4585 #SUP 1.00 #QF 0.88
 60 ILE  HA     83 LEU  QD1     3.56            #peak 4601 #SUP 0.86 #QF 0.86
 39 ILE  HA     39 ILE  QD1     4.01            #peak 2503 #SUP 1.00
 32 THR  HA     33 PRO  HD3     3.57            #peak 270 #SUP 0.99 #QF 0.99
  9 LYS  HA      9 LYS  HG2     3.81            #peak 1091 #SUP 0.97 #QF 0.97
 30 ASP  HA     73 LEU  QQD     3.57            #peak 1930 #SUP 0.98 #QF 0.98
 89 LEU  HB3    89 LEU  QD1     3.58            #peak 4742 #SUP 0.99 #QF 0.99
 81 GLU  HA     84 LYS  HB2     3.87            #peak 4642 #SUP 1.00 #QF 0.52
 10 ILE  H      10 ILE  QD1     3.59            #peak 1144 #SUP 1.00
 19 ILE  HA     19 ILE  HG12    3.84            #peak 1654 #SUP 0.95 #QF 0.95
 15 MET  QE     25 GLU  HA      3.60            #peak 4838 #SUP 0.52 #QF 0.52
 28 LEU  HB3    28 LEU  QD2     3.60            #peak 1997 #SUP 0.99 #QF 0.99
 49 MET  HG3    49 MET  QE      3.60            #peak 3094 #SUP 1.00
 35 LEU  HB3    35 LEU  QD2     3.70            #peak 2351 #SUP 1.00
 15 MET  QB     16 GLU  HA      4.05            #peak 1498 #SUP 0.72 #QF 0.72
 35 LEU  HB3    35 LEU  QD1     3.70            #peak 2328 #SUP 0.99 #QF 0.36
 10 ILE  HA     10 ILE  HG13    3.83            #peak 1119 #SUP 1.00
 83 LEU  HA     83 LEU  QD1     4.06            #peak 4600 #SUP 1.00
 84 LYS  HB3    84 LYS  QD      3.61            #peak 4647 #SUP 0.99 #QF 0.99
 78 ARG  HA     78 ARG  HG3     3.76            #peak 641 #SUP 0.95 #QF 0.95
 32 THR  QG2    33 PRO  HD2     3.62            #peak 2118 #SUP 0.90 #QF 0.90
 76 ILE  QG2    77 SER  HA      3.62            #peak 1431 #SUP 0.62 #QF 0.62
  7 LYS  HB3     8 GLU  HA      4.30            #peak 973 #SUP 0.73 #QF 0.73
 81 GLU  HA     81 GLU  HG3     3.85            #peak 1518 #SUP 0.80 #QF 0.80
 48 LEU  QD2    51 TYR  HB2     5.23            #peak 3052 #SUP 0.87 #QF 0.87
 60 ILE  HA     61 PRO  HD3     3.67            #peak 3667 #SUP 0.99 #QF 0.99
 11 ARG  HA     73 LEU  QQD     4.31            #peak 616 #SUP 0.92 #QF 0.92
 83 LEU  HB2    83 LEU  QD2     3.63            #peak 4614 #SUP 1.00
 10 ILE  HA     10 ILE  QD1     3.63            #peak 1136 #SUP 1.00
 10 ILE  H      10 ILE  HG13    3.87            #peak 1160 #SUP 1.00
 34 LEU  HB3    40 LEU  QD2     4.31            #peak 2217 #SUP 1.00
 53 ARG  H      53 ARG  HB3     3.64            #peak 211 #SUP 0.76 #QF 0.76
 83 LEU  HB3    83 LEU  QD1     4.17            #peak 4587 #SUP 1.00 #QF 0.94
  7 LYS  QG     73 LEU  QQD     3.87            #peak 964 #SUP 0.86 #QF 0.56
 52 ILE  HA     56 MET  QE      3.65            #peak 3206 #SUP 0.85 #QF 0.85
 45 ILE  HA     45 ILE  QG2     3.65            #peak 2882 #SUP 1.00
 75 ALA  QB     76 ILE  H       3.66            #peak 4252 #SUP 1.00
 76 ILE  QG2    76 ILE  HG12    3.66            #peak 4316 #SUP 1.00
 15 MET  HA     15 MET  HG2     4.05            #peak 129 #SUP 0.99 #QF 0.99
 14 ILE  QG2    14 ILE  HG13    3.90            #peak 1435 #SUP 0.99 #QF 0.99
 45 ILE  HA     45 ILE  HG12    4.22            #peak 2807 #SUP 0.94 #QF 0.94
  9 LYS  HB2     9 LYS  QE      4.08            #peak 4093 #SUP 1.00 #QF 0.71
 47 LYS  HA     47 LYS  HG2     4.08            #peak 2987 #SUP 0.99 #QF 0.99
 84 LYS  HB2    84 LYS  QD      3.67            #peak 4645 #SUP 1.00
 49 MET  HA     49 MET  HG2     4.24            #peak 3073 #SUP 0.98 #QF 0.98
 60 ILE  HA     61 PRO  HD2     3.67            #peak 3656 #SUP 0.99 #QF 0.99
 28 LEU  HA     29 ASP  HA      4.58            #peak 2013 #SUP 0.23 #QF 0.23
 76 ILE  QG2    80 VAL  H       3.90            #peak 631 #SUP 0.60 #QF 0.60
 58 VAL  QG2    84 LYS  HA      4.89            #peak 3533 #SUP 0.72 #QF 0.72
 18 LEU  HB2    19 ILE  QD1     4.79            #peak 1685 #SUP 0.97 #QF 0.80
 19 ILE  QD1    23 ALA  QB      5.50            #peak 1685 #SUP 0.97 #QF 0.80
 55 GLU  HA     55 GLU  HG2     3.90            #peak 3373 #SUP 1.00
 23 ALA  QB     24 LYS  HA      4.50            #peak 1828 #SUP 0.94 #QF 0.48
 43 MET  HG3    43 MET  QE      3.68            #peak 2706 #SUP 1.00
 15 MET  QE     23 ALA  HA      3.68            #peak 4839 #SUP 0.93 #QF 0.93
 16 GLU  HA     16 GLU  HG2     3.68            #peak 1497 #SUP 0.98 #QF 0.98
 35 LEU  HB2    35 LEU  QD1     3.70            #peak 2313 #SUP 0.98 #QF 0.97
 75 ALA  QB     78 ARG  QB      4.61            #peak 4268 #SUP 0.48 #QF 0.48
 46 VAL  HA     49 MET  QB      4.29            #peak 2894 #SUP 1.00
 63 THR  H      63 THR  QG2     3.69            #peak 3716 #SUP 0.89 #QF 0.89
 82 GLN  H      82 GLN  HB2     3.69            #peak 646 #SUP 0.98 #QF 0.98
 45 ILE  QG2    46 VAL  H       3.69            #peak 2872 #SUP 0.96 #QF 0.96
 77 SER  HA     81 GLU  H       4.63            #peak 4325 #SUP 0.96 #QF 0.96
 66 THR  QG2    69 TYR  QD      3.71            #peak 3862 #SUP 0.86 #QF 0.86
 35 LEU  QD2    45 ILE  QD1     4.81            #peak 2333 #SUP 0.62 #QF 0.62
 47 LYS  HB3    47 LYS  HD3     3.72            #peak 2958 #SUP 1.00
 82 GLN  HA     82 GLN  HG2     3.99            #peak 4541 #SUP 1.00
 13 TYR  QE     18 LEU  QD2     4.65            #peak 153 #SUP 0.99 #QF 0.99
 45 ILE  QG2    46 VAL  HA      3.72            #peak 2880 #SUP 0.98 #QF 0.98
 70 PHE  HA     76 ILE  QD1     3.72            #peak 4826 #SUP 1.00
  7 LYS  HA      7 LYS  QG      3.73            #peak 848 #SUP 1.00
 73 LEU  HA     73 LEU  HG      3.74            #peak 4185 #SUP 0.96 #QF 0.96
 60 ILE  QG2    64 HIS  HB2     3.74            #peak 3618 #SUP 0.52 #QF 0.52
 46 VAL  H      46 VAL  HB      3.74            #peak 393 #SUP 0.99 #QF 0.99
 34 LEU  QD1    72 ASP  HA      4.46            #peak 4129 #SUP 0.64 #QF 0.64
  7 LYS  QG      7 LYS  HE2     3.74            #peak 4776 #SUP 1.00
 34 LEU  HB2    34 LEU  QD1     3.74            #peak 2203 #SUP 0.99 #QF 0.99
 82 GLN  HA     82 GLN  HG3     3.99            #peak 4542 #SUP 0.95 #QF 0.95
 34 LEU  QD2    72 ASP  HA      4.46            #peak 4130 #SUP 0.62 #QF 0.62
 60 ILE  QG2    61 PRO  HD3     3.89            #peak 3614 #SUP 0.89 #QF 0.89
 83 LEU  HA     83 LEU  HG      3.76            #peak 4631 #SUP 0.97 #QF 0.97
 78 ARG  HA     78 ARG  HG2     3.76            #peak 640 #SUP 0.95 #QF 0.95
  6 VAL  HB      9 LYS  QE      3.76            #peak 2975 #SUP 0.37 #QF 0.37
 32 THR  QG2    33 PRO  HD3     3.76            #peak 2114 #SUP 0.98 #QF 0.98
 39 ILE  H      39 ILE  QD1     3.76            #peak 319 #SUP 1.00
 14 ILE  HA     18 LEU  HB2     3.78            #peak 1381 #SUP 0.99 #QF 0.98
 34 LEU  HB3    40 LEU  QD1     4.31            #peak 2589 #SUP 0.99 #QF 0.99
 47 LYS  HB2    47 LYS  HD3     3.77            #peak 2947 #SUP 1.00
 76 ILE  H      76 ILE  QG2     3.77            #peak 4319 #SUP 1.00
 11 ARG  HA     11 ARG  HG2     3.83            #peak 1203 #SUP 1.00
 43 MET  H      43 MET  HB3     3.90            #peak 367 #SUP 0.99 #QF 0.99
 73 LEU  HA     76 ILE  QD1     3.77            #peak 4829 #SUP 0.73 #QF 0.73
 37 TRP  HE3    39 ILE  QD1     3.77            #peak 2497 #SUP 0.82 #QF 0.82
 10 ILE  HA     10 ILE  HG12    3.83            #peak 1123 #SUP 1.00
 81 GLU  HA     84 LYS  QE      3.78            #peak 4656 #SUP 0.65 #QF 0.65
 68 LYS  HG2    68 LYS  QE      3.84            #peak 3942 #SUP 1.00
 75 ALA  HA     78 ARG  QB      3.78            #peak 4248 #SUP 0.84 #QF 0.84
 78 ARG  HA     78 ARG  QD      3.78            #peak 639 #SUP 0.82 #QF 0.82
 15 MET  HA     23 ALA  QB      3.78            #peak 1817 #SUP 0.84 #QF 0.84
 60 ILE  QD1    70 PHE  HZ      4.02            #peak 3591 #SUP 1.00
 49 MET  HA     52 ILE  QD1     3.78            #peak 3241 #SUP 0.96 #QF 0.96
 79 THR  QG2    83 LEU  HG      3.78            #peak 4414 #SUP 0.99 #QF 0.99
 19 ILE  QG2    23 ALA  HA      3.78            #peak 1178 #SUP 0.99 #QF 0.99
 11 ARG  HB2    11 ARG  HD3     4.19            #peak 1239 #SUP 0.97 #QF 0.97
 14 ILE  HA     18 LEU  QD1     4.51            #peak 1606 #SUP 0.75 #QF 0.75
 47 LYS  HB3    47 LYS  HD2     4.02            #peak 2969 #SUP 0.92 #QF 0.92
 60 ILE  HA     60 ILE  QD1     3.78            #peak 3585 #SUP 0.99 #QF 0.99
 14 ILE  HA     18 LEU  HB3     3.79            #peak 1377 #SUP 0.98 #QF 0.98
 39 ILE  HA     39 ILE  HG12    3.91            #peak 2481 #SUP 1.00
 32 THR  QG2    33 PRO  HG2     3.79            #peak 2168 #SUP 1.00
 80 VAL  QG2    84 LYS  QE      3.80            #peak 942 #SUP 0.84 #QF 0.84
 66 THR  H      66 THR  QG2     3.81            #peak 3863 #SUP 0.98 #QF 0.98
  9 LYS  HA      9 LYS  HG3     3.81            #peak 1024 #SUP 1.00
 70 PHE  HA     76 ILE  HG12    3.81            #peak 4006 #SUP 0.68 #QF 0.68
 53 ARG  HA     53 ARG  HG2     3.98            #peak 3299 #SUP 0.93 #QF 0.93
 15 MET  HG2    28 LEU  QD2     4.78            #peak 1476 #SUP 0.92 #QF 0.92
 80 VAL  QG2    81 GLU  H       4.06            #peak 4466 #SUP 0.72 #QF 0.72
 13 TYR  HA     13 TYR  QD      3.82            #peak 529 #SUP 0.95 #QF 0.95
  4 GLU  HA      7 LYS  HB2     3.82            #peak 725 #SUP 0.97 #QF 0.97
 12 ARG  HB3    13 TYR  HA      4.30            #peak 1340 #SUP 0.27 #QF 0.27
 80 VAL  H      80 VAL  QG2     3.82            #peak 4465 #SUP 1.00
 39 ILE  HB     40 LEU  HG      3.83            #peak 2611 #SUP 0.84 #QF 0.84
 65 ILE  H      66 THR  QG2     4.30            #peak 3861 #SUP 0.77 #QF 0.77
 56 MET  HA     56 MET  HG3     3.83            #peak 3426 #SUP 0.91 #QF 0.91
 11 ARG  HA     11 ARG  HG3     3.83            #peak 1202 #SUP 1.00
 12 ARG  HA     12 ARG  QD      3.83            #peak 112 #SUP 0.97 #QF 0.97
 47 LYS  HA     47 LYS  HD3     3.83            #peak 2935 #SUP 1.00
 68 LYS  HG3    68 LYS  QE      3.84            #peak 3941 #SUP 0.87 #QF 0.87
 39 ILE  H      39 ILE  QG2     3.84            #peak 322 #SUP 1.00
 19 ILE  HA     19 ILE  HG13    3.84            #peak 1652 #SUP 0.96 #QF 0.96
 24 LYS  HA     24 LYS  HG3     4.06            #peak 1829 #SUP 0.98 #QF 0.98
 65 ILE  QD1    70 PHE  QE      4.43            #peak 549 #SUP 0.99 #QF 0.95
 43 MET  HA     43 MET  HG2     4.25            #peak 2741 #SUP 0.99 #QF 0.99
 77 SER  HA     80 VAL  QG2     4.80            #peak 4468 #SUP 0.69 #QF 0.69
 58 VAL  QG2    80 VAL  HA      4.29            #peak 3535 #SUP 0.93 #QF 0.93
 27 GLU  H      27 GLU  HB2     3.84            #peak 210 #SUP 0.92 #QF 0.92
 46 VAL  QG2    49 MET  QE      3.84            #peak 2918 #SUP 0.74 #QF 0.74
  7 LYS  HA     73 LEU  QQD     3.84            #peak 845 #SUP 0.54 #QF 0.54
  4 GLU  HA      7 LYS  HB3     4.57            #peak 726 #SUP 1.00
 49 MET  QE     62 SER  HA      4.33            #peak 3100 #SUP 0.78 #QF 0.78
  9 LYS  QE     56 MET  QE      4.81            #peak 3465 #SUP 0.77 #QF 0.77
  7 LYS  HB2     7 LYS  HE2     3.85            #peak 935 #SUP 0.99 #QF 0.99
 10 ILE  HA     13 TYR  HB3     3.95            #peak 1117 #SUP 0.75 #QF 0.57
 34 LEU  HB2    40 LEU  HG      4.39            #peak 2612 #SUP 0.99 #QF 0.66
  7 LYS  HA     10 ILE  QG2     4.60            #peak 846 #SUP 0.89 #QF 0.89
 15 MET  HG3    28 LEU  QD2     4.78            #peak 1478 #SUP 0.94 #QF 0.26
 48 LEU  HB3    48 LEU  QD1     3.88            #peak 3012 #SUP 0.99 #QF 0.99
 34 LEU  HA     39 ILE  HG13    4.71            #peak 2527 #SUP 0.94 #QF 0.94
 58 VAL  HB     83 LEU  QD1     5.05            #peak 4610 #SUP 0.72 #QF 0.53
 61 PRO  HG2    83 LEU  QD1     5.50            #peak 4610 #SUP 0.72 #QF 0.53
  7 LYS  HB3     7 LYS  HE2     4.35            #peak 934 #SUP 0.98 #QF 0.98
 77 SER  HA     80 VAL  HB      4.13            #peak 4333 #SUP 0.94 #QF 0.94
 32 THR  HA     33 PRO  HG2     4.38            #peak 2161 #SUP 0.98 #QF 0.98
 60 ILE  QG2    61 PRO  HD2     3.89            #peak 3642 #SUP 0.95 #QF 0.95
 43 MET  H      43 MET  HB2     3.90            #peak 368 #SUP 0.94 #QF 0.94
 75 ALA  QB     76 ILE  QD1     4.63            #peak 4271 #SUP 0.96 #QF 0.96
 45 ILE  HA     45 ILE  QD1     3.90            #peak 2818 #SUP 0.98 #QF 0.98
 14 ILE  QG2    14 ILE  HG12    3.90            #peak 1415 #SUP 0.97 #QF 0.97
 71 LYS  QE     75 ALA  QB      4.39            #peak 4264 #SUP 0.74 #QF 0.74
 10 ILE  H      10 ILE  QG2     3.91            #peak 1172 #SUP 0.84 #QF 0.84
 51 TYR  QD     56 MET  QE      3.91            #peak 3460 #SUP 0.86 #QF 0.86
 39 ILE  HA     39 ILE  HG13    3.91            #peak 2528 #SUP 0.97 #QF 0.97
 34 LEU  HG     72 ASP  HA      4.15            #peak 4125 #SUP 0.70 #QF 0.70
 61 PRO  HG3    83 LEU  QD2     4.15            #peak 3680 #SUP 0.82 #QF 0.82
 37 TRP  HB2    39 ILE  QD1     3.91            #peak 2506 #SUP 1.00
 79 THR  HA     81 GLU  H       4.40            #peak 4368 #SUP 0.79 #QF 0.79
 52 ILE  HA     52 ILE  QD1     3.92            #peak 444 #SUP 1.00
 37 TRP  HB3    39 ILE  QD1     3.92            #peak 2505 #SUP 0.97 #QF 0.97
 34 LEU  H      34 LEU  QD2     3.92            #peak 279 #SUP 0.99 #QF 0.99
 28 LEU  HA     28 LEU  HG      3.92            #peak 1945 #SUP 0.93 #QF 0.93
 47 LYS  HA     47 LYS  HG3     4.08            #peak 2936 #SUP 1.00 #QF 0.98
 83 LEU  H      83 LEU  QD2     3.93            #peak 656 #SUP 1.00
 71 LYS  HG3    71 LYS  QE      3.94            #peak 605 #SUP 1.00
 13 TYR  HB2    51 TYR  QE      3.94            #peak 1353 #SUP 0.93 #QF 0.93
 79 THR  H      79 THR  QG2     3.94            #peak 4393 #SUP 0.94 #QF 0.94
 35 LEU  QD1    67 GLY  HA2     4.50            #peak 564 #SUP 0.93 #QF 0.93
 48 LEU  HB3    52 ILE  QD1     3.95            #peak 3250 #SUP 0.35 #QF 0.35
 60 ILE  HA     60 ILE  HG13    4.20            #peak 3601 #SUP 0.97 #QF 0.97
 81 GLU  HA     84 LYS  QD      4.49            #peak 4079 #SUP 0.95 #QF 0.78
 84 LYS  HA     84 LYS  QD      4.86            #peak 4079 #SUP 0.95 #QF 0.78
  6 VAL  HA     10 ILE  QD1     4.47            #peak 1137 #SUP 0.55 #QF 0.55
 60 ILE  QG2    70 PHE  QE      4.00            #peak 3606 #SUP 0.99 #QF 0.79
 11 ARG  HD2    73 LEU  QQD     4.03            #peak 4175 #SUP 0.95 #QF 0.95
 39 ILE  QG2    40 LEU  H       3.98            #peak 2539 #SUP 1.00
 51 TYR  HA     51 TYR  QE      4.73            #peak 3170 #SUP 0.44 #QF 0.44
 53 ARG  HA     53 ARG  HG3     3.98            #peak 3338 #SUP 0.93 #QF 0.93
 13 TYR  QE     48 LEU  HA      3.98            #peak 403 #SUP 0.95 #QF 0.95
 45 ILE  HA     48 LEU  HB2     3.98            #peak 2801 #SUP 0.96 #QF 0.96
 60 ILE  QG2    65 ILE  HA      4.19            #peak 3767 #SUP 0.97 #QF 0.46
 42 SER  HA     45 ILE  QG2     3.99            #peak 355 #SUP 0.82 #QF 0.82
 43 MET  H      43 MET  HG3     4.10            #peak 372 #SUP 0.89 #QF 0.89
 52 ILE  QG2    53 ARG  HA      3.99            #peak 3278 #SUP 0.84 #QF 0.84
 70 PHE  H      70 PHE  HB3     4.01            #peak 4028 #SUP 0.99 #QF 0.99
 84 LYS  HB2    85 ALA  QB      4.25            #peak 4688 #SUP 0.92 #QF 0.92
 40 LEU  QD2    45 ILE  QD1     4.20            #peak 332 #SUP 0.84 #QF 0.84
 58 VAL  QG2    84 LYS  H       4.34            #peak 498 #SUP 0.99 #QF 0.99
 72 ASP  H      76 ILE  QD1     4.25            #peak 4822 #SUP 0.74 #QF 0.74
 43 MET  H      43 MET  HG2     4.10            #peak 371 #SUP 0.91 #QF 0.86
 43 MET  HA     43 MET  HG3     4.25            #peak 2686 #SUP 1.00
 60 ILE  H      60 ILE  QD1     4.01            #peak 507 #SUP 0.99 #QF 0.99
 32 THR  QG2    37 TRP  HE3     4.37            #peak 254 #SUP 0.78 #QF 0.51
 32 THR  QG2    37 TRP  HZ2     4.63            #peak 254 #SUP 0.78 #QF 0.51
 78 ARG  HA     81 GLU  H       4.01            #peak 4800 #SUP 0.95 #QF 0.95
 24 LYS  HA     24 LYS  QD      4.01            #peak 891 #SUP 0.99 #QF 0.99
 29 ASP  HA     32 THR  HB      4.77            #peak 2014 #SUP 0.57 #QF 0.57
 86 GLU  H      86 GLU  HG2     4.01            #peak 4702 #SUP 0.99 #QF 0.99
 36 GLU  H      36 GLU  HB3     4.02            #peak 1417 #SUP 0.96 #QF 0.96
 71 LYS  HA     75 ALA  QB      4.27            #peak 4260 #SUP 0.96 #QF 0.96
 82 GLN  H      82 GLN  HG3     4.02            #peak 649 #SUP 0.98 #QF 0.98
 45 ILE  QG2    46 VAL  HB      4.52            #peak 2883 #SUP 0.55 #QF 0.55
 64 HIS  HD2    79 THR  QG2     4.02            #peak 4402 #SUP 0.98 #QF 0.98
 71 LYS  HA     71 LYS  HG2     4.05            #peak 4054 #SUP 0.96 #QF 0.96
 76 ILE  HA     76 ILE  QD1     4.02            #peak 4830 #SUP 1.00
 14 ILE  HA     14 ILE  QD1     4.03            #peak 125 #SUP 0.88 #QF 0.88
 25 GLU  HA     28 LEU  QD1     5.50            #peak 771 #SUP 0.60 #QF 0.22
 25 GLU  HA     28 LEU  QD2     5.50            #peak 771 #SUP 0.60 #QF 0.22
  6 VAL  HB     10 ILE  QD1     4.78            #peak 815 #SUP 0.60 #QF 0.60
 11 ARG  HD3    73 LEU  QQD     4.03            #peak 1246 #SUP 0.91 #QF 0.91
 89 LEU  H      89 LEU  HG      4.03            #peak 680 #SUP 0.97 #QF 0.97
 60 ILE  HA     61 PRO  HG3     4.54            #peak 3674 #SUP 0.96 #QF 0.96
 84 LYS  HB3    85 ALA  H       4.77            #peak 4638 #SUP 0.96 #QF 0.59
 15 MET  HA     19 ILE  HG12    4.04            #peak 1443 #SUP 0.85 #QF 0.85
 40 LEU  HB3    45 ILE  HA      4.64            #peak 2805 #SUP 0.95 #QF 0.22
 79 THR  H      80 VAL  QG1     4.05            #peak 4462 #SUP 0.97 #QF 0.97
 19 ILE  QD1    20 GLY  H       4.56            #peak 1670 #SUP 1.00
 35 LEU  QD2    67 GLY  HA3     4.50            #peak 2343 #SUP 0.92 #QF 0.92
 34 LEU  HA     39 ILE  HB      4.05            #peak 2488 #SUP 0.67 #QF 0.67
 71 LYS  HA     71 LYS  HG3     4.05            #peak 4053 #SUP 0.99 #QF 0.99
 46 VAL  H      46 VAL  QG1     4.06            #peak 43 #SUP 0.99 #QF 0.99
 42 SER  HA     45 ILE  QD1     4.06            #peak 2817 #SUP 0.90 #QF 0.90
 80 VAL  HA     83 LEU  HG      4.06            #peak 4431 #SUP 0.87 #QF 0.87
  9 LYS  HA      9 LYS  QD      4.06            #peak 82 #SUP 0.99 #QF 0.99
 24 LYS  HA     24 LYS  HG2     4.06            #peak 196 #SUP 0.88 #QF 0.88
 32 THR  QG2    33 PRO  HB3     5.08            #peak 2119 #SUP 0.98 #QF 0.98
 79 THR  QG2    80 VAL  H       4.07            #peak 4394 #SUP 0.90 #QF 0.90
 14 ILE  HA     14 ILE  HG13    4.07            #peak 1376 #SUP 1.00
 13 TYR  HB3    51 TYR  QE      4.32            #peak 1350 #SUP 0.93 #QF 0.93
 35 LEU  QD1    70 PHE  HB2     4.23            #peak 2326 #SUP 0.99 #QF 0.99
 79 THR  HB     80 VAL  HB      4.33            #peak 4386 #SUP 0.86 #QF 0.86
 61 PRO  HD2    83 LEU  QD1     4.08            #peak 4604 #SUP 0.84 #QF 0.84
 45 ILE  QD1    70 PHE  QD      4.08            #peak 2811 #SUP 0.49 #QF 0.49
 69 TYR  QD     79 THR  QG2     4.08            #peak 4396 #SUP 0.70 #QF 0.70
 61 PRO  HD3    83 LEU  QD1     4.08            #peak 4602 #SUP 0.89 #QF 0.89
 28 LEU  QD1    29 ASP  H       4.29            #peak 678 #SUP 0.96 #QF 0.96
 58 VAL  QG1    84 LYS  H       4.34            #peak 3507 #SUP 1.00
 46 VAL  HB     47 LYS  H       4.09            #peak 2901 #SUP 0.62 #QF 0.62
  7 LYS  HA     10 ILE  H       4.09            #peak 861 #SUP 0.74 #QF 0.74
 61 PRO  HG2    83 LEU  QD2     4.35            #peak 3679 #SUP 0.96 #QF 0.96
 44 ASN  HA     47 LYS  HD3     4.10            #peak 2757 #SUP 0.89 #QF 0.89
 65 ILE  HA     66 THR  QG2     4.11            #peak 561 #SUP 0.81 #QF 0.81
 47 LYS  HG3    47 LYS  QE      4.11            #peak 2988 #SUP 1.00
 90 GLU  HA     90 GLU  HG2     4.21            #peak 4763 #SUP 0.99 #QF 0.99
 40 LEU  HB3    45 ILE  HB      4.66            #peak 4793 #SUP 0.99 #QF 0.42
 29 ASP  HB2    30 ASP  H       4.12            #peak 2031 #SUP 1.00
 45 ILE  HA     48 LEU  QD1     5.11            #peak 2806 #SUP 0.65 #QF 0.65
 47 LYS  HA     47 LYS  HD2     4.12            #peak 2965 #SUP 0.95 #QF 0.95
 69 TYR  HA     75 ALA  QB      4.13            #peak 773 #SUP 0.38 #QF 0.38
 10 ILE  HA     51 TYR  QE      4.13            #peak 1112 #SUP 0.98 #QF 0.98
 53 ARG  HA     53 ARG  HD3     4.76            #peak 3295 #SUP 0.97 #QF 0.97
 19 ILE  H      19 ILE  HG13    4.14            #peak 166 #SUP 0.95 #QF 0.95
 76 ILE  HB     80 VAL  QG1     5.17            #peak 4447 #SUP 0.95 #QF 0.57
 80 VAL  QG1    84 LYS  QD      5.42            #peak 4447 #SUP 0.95 #QF 0.57
 41 ASN  H      45 ILE  QD1     4.66            #peak 2809 #SUP 1.00 #QF 0.65
 88 ALA  QB     90 GLU  H       4.15            #peak 4253 #SUP 0.49 #QF 0.49
 84 LYS  H      85 ALA  QB      4.41            #peak 4678 #SUP 0.94 #QF 0.94
 48 LEU  H      48 LEU  QD2     4.42            #peak 415 #SUP 0.74 #QF 0.74
 73 LEU  HA     76 ILE  HB      4.15            #peak 4297 #SUP 0.86 #QF 0.86
 19 ILE  QG2    21 PRO  HD2     4.93            #peak 1709 #SUP 0.65 #QF 0.65
 35 LEU  HA     35 LEU  QD1     4.16            #peak 2319 #SUP 0.97 #QF 0.97
 62 SER  QB     65 ILE  QD1     4.68            #peak 3692 #SUP 0.94 #QF 0.94
 76 ILE  HA     76 ILE  HG12    4.16            #peak 4282 #SUP 0.99 #QF 0.99
 25 GLU  H      25 GLU  HB3     4.16            #peak 1889 #SUP 1.00
 82 GLN  HB2    83 LEU  H       4.29            #peak 4500 #SUP 0.86 #QF 0.86
 65 ILE  QD1    66 THR  QG2     4.95            #peak 3801 #SUP 0.99 #QF 0.99
 74 ASN  HA     77 SER  HB2     4.43            #peak 4194 #SUP 0.86 #QF 0.86
142 PYA  Q31    65 ILE  HB      4.18            #peak 3774 #SUP 0.32 #QF 0.32
 65 ILE  QG2    66 THR  H       4.18            #peak 553 #SUP 0.99 #QF 0.99
 79 THR  QG2    83 LEU  QD2     4.18            #peak 4613 #SUP 0.88 #QF 0.88
 61 PRO  HD3    83 LEU  QD2     4.20            #peak 4625 #SUP 0.63 #QF 0.63
 14 ILE  HB     15 MET  QB      4.71            #peak 1395 #SUP 0.75 #QF 0.75
 15 MET  QE     26 ASP  H       4.97            #peak 1450 #SUP 0.95 #QF 0.95
 49 MET  HA     52 ILE  HB      4.37            #peak 3220 #SUP 0.97 #QF 0.80
 52 ILE  HB     53 ARG  HA      4.87            #peak 3220 #SUP 0.97 #QF 0.80
 68 LYS  HA     71 LYS  QE      5.18            #peak 1860 #SUP 0.97 #QF 0.55
 71 LYS  HA     71 LYS  QE      5.45            #peak 1860 #SUP 0.97 #QF 0.55
 39 ILE  QD1    40 LEU  H       4.97            #peak 2498 #SUP 0.99 #QF 0.99
 15 MET  H      15 MET  QE      4.71            #peak 134 #SUP 0.96 #QF 0.96
 11 ARG  HB3    11 ARG  HD3     4.19            #peak 1213 #SUP 1.00
 32 THR  HB     33 PRO  HD2     4.45            #peak 2103 #SUP 0.82 #QF 0.82
 49 MET  QE     70 PHE  QE      4.71            #peak 3105 #SUP 0.70 #QF 0.70
 70 PHE  QE     76 ILE  QD1     4.19            #peak 4824 #SUP 0.97 #QF 0.97
 11 ARG  HA     28 LEU  QD2     4.46            #peak 1993 #SUP 0.73 #QF 0.73
 34 LEU  HA     39 ILE  HG12    4.71            #peak 2526 #SUP 0.99 #QF 0.99
 62 SER  HA     65 ILE  HG12    4.26            #peak 3682 #SUP 0.95 #QF 0.95
 70 PHE  HA     70 PHE  QD      4.19            #peak 4002 #SUP 0.93 #QF 0.93
 80 VAL  QG1    81 GLU  HA      4.19            #peak 4457 #SUP 0.90 #QF 0.90
 40 LEU  QD1    45 ILE  QD1     4.20            #peak 331 #SUP 0.92 #QF 0.92
 74 ASN  HA     77 SER  HB3     4.43            #peak 4193 #SUP 0.79 #QF 0.79
 61 PRO  HD2    83 LEU  QD2     4.20            #peak 4622 #SUP 0.95 #QF 0.95
 58 VAL  QG1    84 LYS  HB2     5.50            #peak 880 #SUP 0.99 #QF 0.99
 58 VAL  QG2    84 LYS  HB2     5.50            #peak 880 #SUP 0.99 #QF 0.99
 58 VAL  QG1    59 SER  H       4.46            #peak 3506 #SUP 1.00
 60 ILE  HA     60 ILE  HG12    4.20            #peak 3593 #SUP 1.00
 18 LEU  QD2    47 LYS  HB2     4.20            #peak 1061 #SUP 0.53 #QF 0.53
 10 ILE  QD1    51 TYR  QE      4.21            #peak 1138 #SUP 0.92 #QF 0.92
 90 GLU  HA     90 GLU  HG3     4.21            #peak 4762 #SUP 0.98 #QF 0.98
 78 ARG  HA     82 GLN  H       4.74            #peak 4801 #SUP 0.89 #QF 0.89
 10 ILE  HA     13 TYR  QD      4.21            #peak 1113 #SUP 0.92 #QF 0.92
 35 LEU  HA     35 LEU  HG      4.22            #peak 2272 #SUP 1.00
 65 ILE  QG2    66 THR  QG2     4.74            #peak 3825 #SUP 0.88 #QF 0.88
 69 TYR  HB3    70 PHE  QD      4.26            #peak 3996 #SUP 0.79 #QF 0.79
 45 ILE  HA     45 ILE  HG13    4.22            #peak 2860 #SUP 0.99 #QF 0.99
 70 PHE  QD     76 ILE  QG2     4.75            #peak 1425 #SUP 0.98 #QF 0.98
 25 GLU  HB3    26 ASP  HA      5.50            #peak 1905 #SUP 0.50 #QF 0.50
 48 LEU  HA     48 LEU  QD1     4.23            #peak 3031 #SUP 0.98 #QF 0.98
 52 ILE  QG2    56 MET  HB3     4.26            #peak 482 #SUP 0.98 #QF 0.98
  4 GLU  HA      7 LYS  H       4.23            #peak 733 #SUP 0.75 #QF 0.75
 12 ARG  H      12 ARG  QD      4.23            #peak 1302 #SUP 0.98 #QF 0.98
 45 ILE  QD1    49 MET  QE      4.76            #peak 3085 #SUP 0.72 #QF 0.72
  4 GLU  HA      7 LYS  QG      4.23            #peak 950 #SUP 0.98 #QF 0.98
 60 ILE  HA     61 PRO  HG2     4.23            #peak 3673 #SUP 0.89 #QF 0.89
 47 LYS  HA     47 LYS  QE      4.77            #peak 2974 #SUP 1.00
 49 MET  H      49 MET  QE      4.24            #peak 422 #SUP 0.94 #QF 0.94
 76 ILE  HA     78 ARG  QB      5.30            #peak 1164 #SUP 0.56 #QF 0.56
 49 MET  HA     49 MET  HG3     4.24            #peak 3071 #SUP 0.96 #QF 0.96
 85 ALA  QB     86 GLU  HG3     4.72            #peak 4685 #SUP 0.95 #QF 0.95
 15 MET  HG2    19 ILE  QD1     5.50            #peak 1681 #SUP 0.82 #QF 0.82
 58 VAL  QG2    83 LEU  H       5.50            #peak 499 #SUP 0.66 #QF 0.66
 26 ASP  QB     27 GLU  HA      4.26            #peak 1926 #SUP 0.87 #QF 0.87
 69 TYR  HB2    70 PHE  QD      4.26            #peak 3995 #SUP 0.86 #QF 0.86
 45 ILE  H      45 ILE  HG13    4.79            #peak 2850 #SUP 0.99 #QF 0.99
 62 SER  HA     65 ILE  HG13    4.26            #peak 530 #SUP 0.99 #QF 0.99
 42 SER  HA    142 PYA  Q30     5.06            #peak 2666 #SUP 0.56 #QF 0.56
 49 MET  QB     49 MET  QE      4.26            #peak 3081 #SUP 0.96 #QF 0.96
 17 ASP  QB     18 LEU  HA      4.27            #peak 1562 #SUP 0.71 #QF 0.71
 43 MET  HA     46 VAL  QG2     4.27            #peak 2911 #SUP 0.90 #QF 0.90
 42 SER  HA     43 MET  HA      5.15            #peak 2685 #SUP 0.67 #QF 0.52
 15 MET  HG3    28 LEU  QD1     4.78            #peak 1983 #SUP 0.92 #QF 0.85
 50 VAL  HA     53 ARG  HB2     4.28            #peak 3148 #SUP 0.68 #QF 0.68
  7 LYS  QG     77 SER  HA      4.28            #peak 4334 #SUP 0.82 #QF 0.82
 68 LYS  HA     71 LYS  HG3     4.74            #peak 604 #SUP 1.00 #QF 0.50
 15 MET  HG2    23 ALA  QB      5.08            #peak 1813 #SUP 0.82 #QF 0.82
 58 VAL  H      58 VAL  QG2     4.28            #peak 3528 #SUP 0.99 #QF 0.99
 10 ILE  QG2    13 TYR  HB3     4.28            #peak 1182 #SUP 0.78 #QF 0.78
 20 GLY  HA2    21 PRO  QG      4.86            #peak 1720 #SUP 0.99 #QF 0.99
 47 LYS  H      47 LYS  HG3     4.36            #peak 401 #SUP 0.93 #QF 0.93
 32 THR  HB     33 PRO  HD3     5.36            #peak 2099 #SUP 0.99 #QF 0.99
 82 GLN  HB3    83 LEU  H       4.29            #peak 4501 #SUP 0.91 #QF 0.91
 58 VAL  QG1    84 LYS  HB3     5.50            #peak 881 #SUP 0.98 #QF 0.97
 58 VAL  QG2    84 LYS  HB3     5.50            #peak 881 #SUP 0.98 #QF 0.97
 58 VAL  QG1    80 VAL  HA      4.29            #peak 3516 #SUP 0.95 #QF 0.95
 78 ARG  H      78 ARG  QD      4.29            #peak 4349 #SUP 1.00
 50 VAL  HB     51 TYR  H       4.30            #peak 428 #SUP 0.83 #QF 0.83
 46 VAL  QG2    47 LYS  HD2     4.57            #peak 2919 #SUP 0.81 #QF 0.81
 70 PHE  HA     76 ILE  QG2     4.57            #peak 630 #SUP 0.53 #QF 0.53
 45 ILE  HA     48 LEU  QD2     5.11            #peak 3049 #SUP 0.59 #QF 0.59
 80 VAL  HA     83 LEU  QD1     4.31            #peak 4603 #SUP 1.00
 29 ASP  HA     73 LEU  QQD     5.39            #peak 4172 #SUP 0.46 #QF 0.46
  2 ASP  QB      5 GLU  QB      4.31            #peak 694 #SUP 0.63 #QF 0.63
 28 LEU  H      28 LEU  HG      4.59            #peak 1695 #SUP 0.96 #QF 0.96
 20 GLY  HA3    21 PRO  QG      4.86            #peak 1726 #SUP 0.82 #QF 0.82
 83 LEU  QD1    84 LYS  H       4.59            #peak 654 #SUP 0.98 #QF 0.98
 16 GLU  HB2    17 ASP  H       4.33            #peak 453 #SUP 0.78 #QF 0.78
 83 LEU  HG     84 LYS  H       5.50            #peak 1315 #SUP 0.93 #QF 0.49
 45 ILE  HA     48 LEU  HB3     5.41            #peak 2804 #SUP 0.94 #QF 0.94
 45 ILE  QD1    65 ILE  QD1     4.33            #peak 3803 #SUP 0.63 #QF 0.63
 12 ARG  HA     16 GLU  H       4.96            #peak 1277 #SUP 0.78 #QF 0.25
 65 ILE  HA     69 TYR  QD      5.42            #peak 3760 #SUP 0.32 #QF 0.32
 15 MET  HG2    28 LEU  QD1     4.78            #peak 1984 #SUP 0.99 #QF 0.99
 51 TYR  HB2    52 ILE  QD1     4.88            #peak 3245 #SUP 0.83 #QF 0.83
 50 VAL  QG2    51 TYR  HA      4.34            #peak 2665 #SUP 0.59 #QF 0.59
 61 PRO  HG2    63 THR  QG2     4.34            #peak 3726 #SUP 0.64 #QF 0.64
 70 PHE  HA     75 ALA  QB      4.35            #peak 4258 #SUP 0.87 #QF 0.87
 36 GLU  H      36 GLU  HG2     5.14            #peak 29 #SUP 0.91 #QF 0.25
 36 GLU  H      36 GLU  HG3     5.14            #peak 29 #SUP 0.91 #QF 0.25
 18 LEU  HB2    19 ILE  HA      5.44            #peak 1653 #SUP 0.94 #QF 0.83
 19 ILE  HA     23 ALA  QB      5.50            #peak 1653 #SUP 0.94 #QF 0.83
  6 VAL  H       7 LYS  QG      4.93            #peak 4661 #SUP 1.00 #QF 0.37
 10 ILE  QG2    11 ARG  H       4.36            #peak 99 #SUP 0.99 #QF 0.99
 47 LYS  H      47 LYS  HG2     4.36            #peak 2980 #SUP 1.00
 69 TYR  HA     79 THR  QG2     4.36            #peak 4405 #SUP 0.96 #QF 0.96
 14 ILE  QG2    19 ILE  H       4.36            #peak 1423 #SUP 0.56 #QF 0.56
 28 LEU  HA     32 THR  QG2     4.36            #peak 2112 #SUP 0.70 #QF 0.70
 46 VAL  H      49 MET  QE      4.36            #peak 3106 #SUP 0.98 #QF 0.98
 15 MET  HG3    23 ALA  QB      5.08            #peak 1814 #SUP 1.00
 84 LYS  HB3    85 ALA  HA      5.42            #peak 863 #SUP 0.94 #QF 0.90
  9 LYS  QE     10 ILE  QD1     4.37            #peak 1079 #SUP 0.46 #QF 0.46
 30 ASP  HB2    31 GLN  QG      4.72            #peak 2085 #SUP 0.71 #QF 0.71
 68 LYS  HA     71 LYS  HG2     4.74            #peak 4110 #SUP 1.00 #QF 0.38
 51 TYR  HB2    52 ILE  HA      5.50            #peak 3203 #SUP 1.00 #QF 0.85
 56 MET  HA     56 MET  QE      4.38            #peak 3461 #SUP 0.83 #QF 0.83
 69 TYR  HA     71 LYS  H       4.38            #peak 3960 #SUP 0.65 #QF 0.65
 49 MET  QE     62 SER  QB      5.15            #peak 3693 #SUP 0.62 #QF 0.24
 62 SER  QB     65 ILE  HB      5.41            #peak 3693 #SUP 0.62 #QF 0.24
 15 MET  HA     23 ALA  HA      4.93            #peak 1280 #SUP 0.91 #QF 0.91
 15 MET  QE     25 GLU  H       4.39            #peak 1449 #SUP 0.90 #QF 0.90
 32 THR  QG2    33 PRO  HG3     4.66            #peak 2122 #SUP 0.79 #QF 0.79
  7 LYS  HA      7 LYS  HD3     4.94            #peak 850 #SUP 1.00
 34 LEU  HB3    40 LEU  HG      4.39            #peak 2214 #SUP 0.98 #QF 0.98
 61 PRO  HB2    63 THR  QG2     4.74            #peak 3725 #SUP 0.91 #QF 0.91
 53 ARG  H      53 ARG  HG3     4.69            #peak 464 #SUP 0.97 #QF 0.97
  4 GLU  HA      7 LYS  HE3     4.46            #peak 924 #SUP 0.92 #QF 0.92
 14 ILE  QG2    18 LEU  H       4.68            #peak 1427 #SUP 0.80 #QF 0.80
 80 VAL  HA     83 LEU  H       4.41            #peak 4422 #SUP 0.97 #QF 0.97
  7 LYS  QG      8 GLU  H       4.41            #peak 55 #SUP 1.00
 51 TYR  HB3    52 ILE  QG2     5.24            #peak 3282 #SUP 0.98 #QF 0.98
 48 LEU  H      48 LEU  QD1     4.42            #peak 410 #SUP 0.97 #QF 0.97
 55 GLU  HA     56 MET  HA      4.69            #peak 2041 #SUP 0.51 #QF 0.51
 13 TYR  QE     51 TYR  HA      5.25            #peak 3171 #SUP 0.96 #QF 0.96
 76 ILE  QD1    77 SER  H       4.97            #peak 4818 #SUP 0.88 #QF 0.88
 40 LEU  HA     40 LEU  QD1     4.42            #peak 2562 #SUP 0.90 #QF 0.90
 12 ARG  HB2    13 TYR  H       4.43            #peak 107 #SUP 0.78 #QF 0.78
 71 LYS  HG3    72 ASP  H       5.50            #peak 599 #SUP 0.96 #QF 0.48
 10 ILE  QG2    13 TYR  QD      4.67            #peak 1175 #SUP 0.88 #QF 0.59
 10 ILE  QG2    51 TYR  QE      5.13            #peak 1175 #SUP 0.88 #QF 0.59
 14 ILE  HA     18 LEU  HG      4.43            #peak 1637 #SUP 0.89 #QF 0.89
  9 LYS  HA      9 LYS  QE      4.71            #peak 1072 #SUP 1.00
 85 ALA  QB     86 GLU  HG2     4.72            #peak 4710 #SUP 0.78 #QF 0.78
 76 ILE  HA     79 THR  HA      5.50            #peak 642 #SUP 0.99 #QF 0.99
 79 THR  HA     82 GLN  H       4.45            #peak 4370 #SUP 0.82 #QF 0.82
 79 THR  HA     80 VAL  QG1     5.28            #peak 4459 #SUP 0.99 #QF 0.99
 76 ILE  HA     79 THR  QG2     4.45            #peak 4286 #SUP 0.88 #QF 0.88
 35 LEU  HA     40 LEU  HB2     5.14            #peak 2274 #SUP 0.91 #QF 0.67
 45 ILE  HB     46 VAL  QG2     4.73            #peak 4794 #SUP 0.93 #QF 0.93
 18 LEU  H      18 LEU  HG      4.46            #peak 155 #SUP 0.94 #QF 0.94
  4 GLU  HA      7 LYS  HE2     4.46            #peak 731 #SUP 0.94 #QF 0.94
 11 ARG  HA     28 LEU  QD1     4.46            #peak 1981 #SUP 0.90 #QF 0.90
 26 ASP  HA     27 GLU  HA      5.02            #peak 1902 #SUP 0.71 #QF 0.71
 32 THR  HA     33 PRO  HG3     4.46            #peak 2092 #SUP 0.52 #QF 0.52
 80 VAL  HB     83 LEU  QD1     4.46            #peak 4607 #SUP 0.72 #QF 0.72
 34 LEU  H      34 LEU  HG      4.46            #peak 281 #SUP 0.98 #QF 0.98
 72 ASP  HA     75 ALA  QB      4.47            #peak 4127 #SUP 0.91 #QF 0.91
 30 ASP  HA     32 THR  H       4.47            #peak 2043 #SUP 0.81 #QF 0.81
 43 MET  HA     43 MET  QE      4.48            #peak 2710 #SUP 0.89 #QF 0.89
 18 LEU  QD1    47 LYS  HA      5.50            #peak 2939 #SUP 0.74 #QF 0.38
 18 LEU  QD2    47 LYS  HA      5.50            #peak 2939 #SUP 0.74 #QF 0.38
 51 TYR  HB3    52 ILE  HA      4.48            #peak 3202 #SUP 0.97 #QF 0.97
  7 LYS  HA      7 LYS  HD2     4.94            #peak 849 #SUP 1.00
 53 ARG  HB3    54 ASP  HA      4.77            #peak 3357 #SUP 0.75 #QF 0.75
 76 ILE  HA     80 VAL  QG1     4.49            #peak 4455 #SUP 0.99 #QF 0.99
 24 LYS  HA     25 GLU  HA      4.77            #peak 1883 #SUP 0.93 #QF 0.93
 24 LYS  HA     24 LYS  QE      4.77            #peak 194 #SUP 0.99 #QF 0.99
 61 PRO  HG2    64 HIS  HA      5.19            #peak 1089 #SUP 0.89 #QF 0.85
 55 GLU  HA     56 MET  QE      5.06            #peak 3462 #SUP 0.89 #QF 0.89
  7 LYS  HB3    73 LEU  QQD     4.50            #peak 882 #SUP 0.82 #QF 0.82
 51 TYR  QD     52 ILE  QD1     4.50            #peak 3237 #SUP 0.89 #QF 0.89
 35 LEU  QD2    67 GLY  HA2     4.50            #peak 2344 #SUP 0.86 #QF 0.86
 46 VAL  HB     47 LYS  HD3     4.51            #peak 2904 #SUP 0.49 #QF 0.49
 46 VAL  QG2    47 LYS  QE      5.50            #peak 1080 #SUP 0.90 #QF 0.34
 40 LEU  HB3    70 PHE  QD      5.32            #peak 328 #SUP 1.00
 82 GLN  HG3    83 LEU  HG      5.50            #peak 4555 #SUP 0.90 #QF 0.90
 11 ARG  HA     12 ARG  QD      5.50            #peak 1229 #SUP 0.93 #QF 0.93
 56 MET  HA     57 GLY  QA      4.52            #peak 1535 #SUP 0.35 #QF 0.35
 52 ILE  QD1    53 ARG  H       4.52            #peak 3232 #SUP 0.80 #QF 0.80
 79 THR  QG2    83 LEU  H       4.52            #peak 4395 #SUP 0.87 #QF 0.87
 27 GLU  HB3    28 LEU  H       4.52            #peak 213 #SUP 0.97 #QF 0.97
 45 ILE  H      46 VAL  HB      5.37            #peak 2900 #SUP 0.56 #QF 0.56
 75 ALA  QB     76 ILE  HA      4.52            #peak 4261 #SUP 0.94 #QF 0.94
 44 ASN  HA     46 VAL  H       4.52            #peak 4811 #SUP 0.81 #QF 0.81
 75 ALA  HA     79 THR  H       4.53            #peak 4237 #SUP 0.62 #QF 0.62
 53 ARG  HA     58 VAL  HA      4.76            #peak 3483 #SUP 0.96 #QF 0.78
 57 GLY  QA     58 VAL  HA      5.26            #peak 3483 #SUP 0.96 #QF 0.78
 60 ILE  QD1    64 HIS  HA      5.50            #peak 3588 #SUP 0.59 #QF 0.59
 10 ILE  QD1    51 TYR  QD      4.54            #peak 1140 #SUP 0.98 #QF 0.98
 45 ILE  QD1    48 LEU  HB2     5.50            #peak 2824 #SUP 0.83 #QF 0.83
 15 MET  QB     23 ALA  QB      4.54            #peak 1447 #SUP 0.93 #QF 0.93
 14 ILE  HA     48 LEU  QD2     5.24            #peak 3050 #SUP 0.97 #QF 0.97
  4 GLU  HA      7 LYS  HD2     4.65            #peak 727 #SUP 0.95 #QF 0.95
 42 SER  HA     45 ILE  HB      4.54            #peak 4786 #SUP 0.76 #QF 0.76
 11 ARG  HA     11 ARG  HD3     5.12            #peak 1197 #SUP 1.00
 41 ASN  HA     42 SER  HA      5.12            #peak 2619 #SUP 0.31 #QF 0.31
 83 LEU  QD2    84 LYS  H       4.84            #peak 657 #SUP 1.00
 12 ARG  QD     28 LEU  QD2     4.94            #peak 1312 #SUP 0.86 #QF 0.86
 49 MET  QE     70 PHE  HZ      4.56            #peak 3104 #SUP 0.89 #QF 0.89
 70 PHE  HA     76 ILE  HB      4.84            #peak 4007 #SUP 0.74 #QF 0.74
 24 LYS  H      25 GLU  QG      5.50            #peak 1893 #SUP 0.74 #QF 0.74
 10 ILE  QG2    14 ILE  H       5.14            #peak 1171 #SUP 0.55 #QF 0.55
 44 ASN  HA     47 LYS  H       4.57            #peak 4812 #SUP 0.92 #QF 0.92
 71 LYS  HG2    72 ASP  H       5.50            #peak 600 #SUP 0.77 #QF 0.77
  7 LYS  HB2     8 GLU  HA      4.97            #peak 864 #SUP 0.84 #QF 0.74
 70 PHE  HB3    76 ILE  QD1     4.72            #peak 4831 #SUP 0.99 #QF 0.99
 25 GLU  HB2    26 ASP  HA      5.50            #peak 1163 #SUP 0.60 #QF 0.60
 45 ILE  QG2    49 MET  H       5.16            #peak 2871 #SUP 0.76 #QF 0.76
 15 MET  QE     28 LEU  HA      4.60            #peak 1454 #SUP 0.88 #QF 0.88
 26 ASP  H      27 GLU  HA      5.46            #peak 1921 #SUP 0.82 #QF 0.82
 52 ILE  H      56 MET  QE      4.88            #peak 3455 #SUP 0.73 #QF 0.73
  2 ASP  QB      5 GLU  H       5.33            #peak 6 #SUP 0.98 #QF 0.86
 10 ILE  QD1    11 ARG  H       4.60            #peak 95 #SUP 0.96 #QF 0.96
 82 GLN  HG2    83 LEU  HG      5.50            #peak 4553 #SUP 0.92 #QF 0.51
  6 VAL  H       9 LYS  QE      5.17            #peak 83 #SUP 0.84 #QF 0.63
142 PYA  H50    45 ILE  QG2     4.60            #peak 2873 #SUP 0.88 #QF 0.88
 65 ILE  HB     66 THR  QG2     5.47            #peak 3847 #SUP 1.00
 15 MET  HG3    19 ILE  QD1     5.50            #peak 1680 #SUP 0.92 #QF 0.92
 26 ASP  HA     27 GLU  QG      5.48            #peak 203 #SUP 0.51 #QF 0.51
 37 TRP  H      39 ILE  QD1     4.62            #peak 2495 #SUP 1.00
 45 ILE  HA     48 LEU  H       4.62            #peak 2791 #SUP 0.74 #QF 0.74
  9 LYS  H       9 LYS  QE      4.62            #peak 1069 #SUP 0.98 #QF 0.98
 13 TYR  HB2    14 ILE  H       4.62            #peak 1348 #SUP 0.95 #QF 0.95
 52 ILE  HB     53 ARG  H       4.62            #peak 3214 #SUP 0.90 #QF 0.90
 55 GLU  HB3    56 MET  H       4.68            #peak 3380 #SUP 1.00
 69 TYR  HB3    70 PHE  QE      4.72            #peak 3997 #SUP 0.99 #QF 0.99
 14 ILE  QG2    18 LEU  HA      5.21            #peak 1430 #SUP 0.77 #QF 0.77
 24 LYS  HA     25 GLU  QG      5.22            #peak 1824 #SUP 0.60 #QF 0.60
 26 ASP  QB     27 GLU  QG      4.72            #peak 1911 #SUP 0.59 #QF 0.28
 13 TYR  QE     51 TYR  HB3     4.64            #peak 3182 #SUP 0.94 #QF 0.94
 79 THR  QG2    80 VAL  HA      4.64            #peak 4408 #SUP 0.98 #QF 0.98
 83 LEU  HB3    84 LYS  H       4.64            #peak 653 #SUP 0.86 #QF 0.86
 13 TYR  QD     14 ILE  QD1     4.93            #peak 1139 #SUP 0.91 #QF 0.91
 20 GLY  H      21 PRO  HD2     4.93            #peak 1759 #SUP 0.99 #QF 0.99
  4 GLU  HA      7 LYS  HD3     4.65            #peak 728 #SUP 1.00
 65 ILE  QD1    66 THR  HA      5.50            #peak 3832 #SUP 0.32 #QF 0.32
  9 LYS  HA     10 ILE  QD1     5.23            #peak 1027 #SUP 0.51 #QF 0.51
 50 VAL  QG1    51 TYR  HB2     4.65            #peak 1363 #SUP 0.49 #QF 0.49
 12 ARG  QD     28 LEU  QD1     4.94            #peak 1982 #SUP 0.83 #QF 0.83
 48 LEU  QD1    51 TYR  HB2     5.23            #peak 3035 #SUP 0.81 #QF 0.81
 68 LYS  HB2    69 TYR  H       4.65            #peak 3897 #SUP 0.98 #QF 0.98
 73 LEU  QQD    74 ASN  HA      4.65            #peak 4202 #SUP 0.64 #QF 0.64
 76 ILE  HG12   80 VAL  HB      5.50            #peak 4315 #SUP 0.90 #QF 0.90
 11 ARG  HA     14 ILE  HB      4.66            #peak 1396 #SUP 0.62 #QF 0.62
 19 ILE  HB     23 ALA  HA      5.50            #peak 1804 #SUP 0.91 #QF 0.69
 47 LYS  H      47 LYS  QE      4.66            #peak 400 #SUP 0.96 #QF 0.96
 45 ILE  HB     46 VAL  H       4.66            #peak 4779 #SUP 0.94 #QF 0.94
 43 MET  HA     46 VAL  HB      5.50            #peak 392 #SUP 0.90 #QF 0.90
 21 PRO  QG     22 SER  HA      4.67            #peak 1776 #SUP 0.39 #QF 0.39
 76 ILE  HA     79 THR  HB      4.67            #peak 4277 #SUP 0.61 #QF 0.61
 14 ILE  HA     48 LEU  QD1     5.24            #peak 1382 #SUP 0.78 #QF 0.27
 84 LYS  H      84 LYS  QE      4.68            #peak 51 #SUP 0.94 #QF 0.94
 73 LEU  H      73 LEU  HG      4.68            #peak 617 #SUP 1.00
 52 ILE  HA     56 MET  H       4.68            #peak 3193 #SUP 0.80 #QF 0.80
 81 GLU  H      84 LYS  QE      4.68            #peak 4655 #SUP 0.70 #QF 0.70
 44 ASN  HA     47 LYS  HD2     4.68            #peak 2964 #SUP 0.90 #QF 0.90
 55 GLU  HB2    56 MET  H       4.68            #peak 3381 #SUP 0.99 #QF 0.99
 66 THR  QG2    68 LYS  QE      4.68            #peak 3850 #SUP 0.67 #QF 0.67
 36 GLU  HB2    37 TRP  HD1     4.77            #peak 300 #SUP 0.86 #QF 0.86
 11 ARG  HE     73 LEU  QQD     4.69            #peak 615 #SUP 0.99 #QF 0.99
 10 ILE  HA     51 TYR  QD      4.69            #peak 1111 #SUP 0.95 #QF 0.95
 32 THR  QG2    37 TRP  HB2     4.94            #peak 2399 #SUP 0.92 #QF 0.85
 47 LYS  HB3    48 LEU  H       4.69            #peak 2951 #SUP 0.67 #QF 0.67
 49 MET  HG3    65 ILE  QD1     4.74            #peak 3795 #SUP 0.79 #QF 0.79
 84 LYS  HB2    85 ALA  HA      4.69            #peak 4675 #SUP 0.58 #QF 0.58
 12 ARG  HB3    13 TYR  HB2     5.50            #peak 1359 #SUP 0.80 #QF 0.80
 19 ILE  QD1    23 ALA  HA      5.28            #peak 1675 #SUP 0.96 #QF 0.96
142 PYA  H50    65 ILE  QG2     4.70            #peak 4806 #SUP 0.66 #QF 0.66
 58 VAL  QG1    83 LEU  H       5.50            #peak 3508 #SUP 0.83 #QF 0.83
 16 GLU  H      17 ASP  HA      5.50            #peak 1531 #SUP 0.52 #QF 0.52
 48 LEU  HB2    49 MET  H       4.71            #peak 3027 #SUP 0.96 #QF 0.96
 84 LYS  HA     85 ALA  HA      5.00            #peak 4670 #SUP 0.98 #QF 0.98
 42 SER  HA     44 ASN  H       5.29            #peak 4808 #SUP 0.95 #QF 0.95
 41 ASN  HA     45 ILE  QD1     4.71            #peak 2815 #SUP 0.55 #QF 0.55
  9 LYS  H       9 LYS  QD      4.72            #peak 80 #SUP 0.77 #QF 0.77
 30 ASP  HB3    31 GLN  H       4.75            #peak 2045 #SUP 0.95 #QF 0.95
 69 TYR  HB2    70 PHE  QE      4.72            #peak 3998 #SUP 0.99 #QF 0.99
 83 LEU  H      84 LYS  QE      5.50            #peak 52 #SUP 0.90 #QF 0.24
 12 ARG  QD     13 TYR  H       4.72            #peak 1305 #SUP 0.88 #QF 0.88
 30 ASP  HB3    31 GLN  QG      4.72            #peak 2056 #SUP 0.46 #QF 0.46
 34 LEU  HA     37 TRP  HB3     4.72            #peak 2418 #SUP 0.83 #QF 0.83
 39 ILE  QG2    40 LEU  HA      4.72            #peak 2540 #SUP 0.99 #QF 0.99
 43 MET  QE     45 ILE  QD1     5.50            #peak 2825 #SUP 0.22 #QF 0.22
 66 THR  HA     67 GLY  HA2     4.77            #peak 3830 #SUP 0.62 #QF 0.62
 70 PHE  HB2    76 ILE  QD1     4.72            #peak 4833 #SUP 1.00
 75 ALA  HA     78 ARG  H       4.73            #peak 4238 #SUP 0.86 #QF 0.86
 11 ARG  HA     11 ARG  HD2     5.12            #peak 1196 #SUP 1.00
 32 THR  QG2    37 TRP  HB3     5.23            #peak 2409 #SUP 0.95 #QF 0.92
 71 LYS  QE     72 ASP  H       5.03            #peak 2972 #SUP 0.62 #QF 0.62
 52 ILE  HA     56 MET  HB2     5.50            #peak 3443 #SUP 0.82 #QF 0.82
 34 LEU  HA     37 TRP  H       5.46            #peak 275 #SUP 1.00
 45 ILE  QD1    46 VAL  QG2     5.33            #peak 816 #SUP 0.99 #QF 0.99
 10 ILE  HB     13 TYR  HB3     5.50            #peak 1360 #SUP 0.96 #QF 0.59
 12 ARG  HB3    13 TYR  HB3     5.50            #peak 1360 #SUP 0.96 #QF 0.59
 13 TYR  HB3    14 ILE  HB      5.50            #peak 1360 #SUP 0.96 #QF 0.59
 29 ASP  HB3    30 ASP  HA      4.74            #peak 1924 #SUP 0.95 #QF 0.95
 61 PRO  HB3    63 THR  QG2     4.74            #peak 3724 #SUP 0.83 #QF 0.83
 49 MET  HG2    65 ILE  QD1     4.74            #peak 3798 #SUP 0.87 #QF 0.87
 19 ILE  QG2    24 LYS  HA      5.50            #peak 1830 #SUP 0.70 #QF 0.70
 30 ASP  HB2    31 GLN  H       4.75            #peak 2044 #SUP 0.94 #QF 0.94
 34 LEU  HA     37 TRP  HB2     4.75            #peak 2404 #SUP 0.96 #QF 0.96
 34 LEU  H      39 ILE  QG2     5.50            #peak 2536 #SUP 0.40 #QF 0.40
 44 ASN  HA     47 LYS  HB2     4.76            #peak 2944 #SUP 0.83 #QF 0.83
 53 ARG  HA     53 ARG  HD2     4.76            #peak 3294 #SUP 0.99 #QF 0.99
 88 ALA  HA     89 LEU  HB3     4.76            #peak 4726 #SUP 0.83 #QF 0.83
 10 ILE  HA     13 TYR  HB2     4.76            #peak 120 #SUP 0.86 #QF 0.86
 55 GLU  H      55 GLU  HG2     4.76            #peak 473 #SUP 1.00
 71 LYS  H      71 LYS  QE      5.06            #peak 597 #SUP 1.00
 24 LYS  H      24 LYS  QD      4.76            #peak 1855 #SUP 0.92 #QF 0.92
 48 LEU  QD1    49 MET  H       4.84            #peak 412 #SUP 0.64 #QF 0.64
 66 THR  HA     67 GLY  HA3     4.77            #peak 3831 #SUP 0.29 #QF 0.29
 80 VAL  HA     82 GLN  H       4.77            #peak 4421 #SUP 0.94 #QF 0.94
 36 GLU  HB3    37 TRP  HD1     4.77            #peak 299 #SUP 0.59 #QF 0.59
 46 VAL  HA     65 ILE  QD1     5.07            #peak 3793 #SUP 0.65 #QF 0.65
 82 GLN  HG3    83 LEU  H       4.81            #peak 4535 #SUP 0.73 #QF 0.73
 79 THR  HB     80 VAL  HA      4.78            #peak 4426 #SUP 0.97 #QF 0.97
 78 ARG  QD     79 THR  H       5.08            #peak 1303 #SUP 0.99 #QF 0.99
 79 THR  QG2    83 LEU  HA      5.50            #peak 4570 #SUP 0.43 #QF 0.43
 20 GLY  H      21 PRO  HD3     5.09            #peak 1760 #SUP 0.98 #QF 0.98
 34 LEU  HA     35 LEU  HA      5.09            #peak 2292 #SUP 0.44 #QF 0.44
 37 TRP  HB3    39 ILE  H       5.50            #peak 2430 #SUP 1.00 #QF 0.99
 76 ILE  HA     80 VAL  QG2     5.50            #peak 4469 #SUP 0.96 #QF 0.96
 39 ILE  HB     40 LEU  HB2     5.40            #peak 2576 #SUP 0.90 #QF 0.90
 24 LYS  H      24 LYS  QE      5.50            #peak 193 #SUP 0.87 #QF 0.81
 44 ASN  H      47 LYS  QE      5.50            #peak 193 #SUP 0.87 #QF 0.81
 35 LEU  QD1    45 ILE  QD1     4.81            #peak 2332 #SUP 0.91 #QF 0.91
 53 ARG  HB2    58 VAL  HA      5.50            #peak 3485 #SUP 0.89 #QF 0.89
 82 GLN  HG2    83 LEU  H       4.81            #peak 4536 #SUP 0.93 #QF 0.93
 29 ASP  H      32 THR  QG2     4.81            #peak 256 #SUP 0.96 #QF 0.96
  6 VAL  HA      9 LYS  QE      4.81            #peak 1861 #SUP 0.96 #QF 0.96
 48 LEU  QD2    70 PHE  QE      4.81            #peak 3043 #SUP 0.56 #QF 0.56
 51 TYR  QE     55 GLU  HB3     4.83            #peak 3384 #SUP 0.95 #QF 0.95
 89 LEU  QD2    90 GLU  H       4.85            #peak 4752 #SUP 0.91 #QF 0.41
  6 VAL  HA      9 LYS  QD      4.82            #peak 895 #SUP 0.71 #QF 0.71
 51 TYR  QE     52 ILE  HA      5.42            #peak 3196 #SUP 0.97 #QF 0.97
 76 ILE  QD1    80 VAL  HB      5.50            #peak 4834 #SUP 0.71 #QF 0.71
 48 LEU  H      48 LEU  HG      4.83            #peak 3066 #SUP 0.97 #QF 0.97
 79 THR  HB     83 LEU  QD1     4.83            #peak 4381 #SUP 0.91 #QF 0.91
 72 ASP  HA     76 ILE  QD1     4.83            #peak 4827 #SUP 0.97 #QF 0.97
 84 LYS  QE     85 ALA  H       5.50            #peak 919 #SUP 0.86 #QF 0.71
 49 MET  QB     60 ILE  QD1     5.50            #peak 3084 #SUP 0.53 #QF 0.53
 51 TYR  QE     55 GLU  HB2     4.83            #peak 3386 #SUP 0.94 #QF 0.94
 34 LEU  H      39 ILE  QD1     4.84            #peak 2496 #SUP 0.73 #QF 0.73
 37 TRP  HA     39 ILE  QD1     5.14            #peak 2499 #SUP 0.60 #QF 0.60
 48 LEU  QD2    49 MET  H       4.84            #peak 3042 #SUP 0.82 #QF 0.82
 52 ILE  HA     56 MET  HB3     5.50            #peak 484 #SUP 0.80 #QF 0.80
 47 LYS  HB3    48 LEU  HA      4.85            #peak 808 #SUP 0.72 #QF 0.72
 52 ILE  QG2    58 VAL  HA      4.85            #peak 3277 #SUP 0.72 #QF 0.72
  9 LYS  QE     51 TYR  QE      4.85            #peak 85 #SUP 0.70 #QF 0.70
 73 LEU  QQD    77 SER  H       4.48            #peak 5990 #SUP 0.43 #QF 0.43
 35 LEU  QD2    70 PHE  HB3     4.23            #peak 6001
 35 LEU  QD2    70 PHE  HB2     4.23            #peak 6002
 39 ILE  QG2    39 ILE  QD1     2.52            #peak 6003
 61 PRO  HA     65 ILE  QD1     4.62            #peak 6004
142 PYA  H51    45 ILE  HB      5.50            #peak 6005
142 PYA  H51    45 ILE  HG12    5.50            #peak 6006
142 PYA  H51    45 ILE  HG13    5.50            #peak 6007
142 PYA  H51    45 ILE  QD1     5.45            #peak 6008
142 PYA  H51    45 ILE  QG2     4.91            #peak 6009
142 PYA  H51    65 ILE  QG2     5.04            #peak 6010
142 PYA  H51    46 VAL  QG2     5.50            #peak 6014
 15 MET  HA     15 MET  HG3     4.05            #peak 6016
 60 ILE  QG2    61 PRO  HA      4.81            #peak 6018
 60 ILE  QG2    64 HIS  HA      4.66            #peak 6019
 52 ILE  QG2    56 MET  HB2     4.26            #peak 6021
 37 TRP  HA     37 TRP  HD1     3.39            #peak 31 #SUP 0.83 #QF 0.83
 60 ILE  QD1    70 PHE  QE      3.68            #peak 131 #SUP 0.96 #QF 0.96
 70 PHE  QD     76 ILE  QD1     3.47            #peak 125 #SUP 0.59 #QF 0.59
 13 TYR  QE     18 LEU  QD1     4.65            #peak 16 #SUP 0.73 #QF 0.73
 69 TYR  HA     69 TYR  QD      3.52            #peak 4 #SUP 0.95 #QF 0.95
 60 ILE  QG2    70 PHE  HZ      3.71            #peak 149 #SUP 0.96 #QF 0.96
 48 LEU  QD1    70 PHE  QE      4.81            #peak 130 #SUP 0.75 #QF 0.57
 64 HIS  HA     69 TYR  QD      4.03            #peak 96 #SUP 0.96 #QF 0.96
 51 TYR  QE     56 MET  QE      4.04            #peak 80 #SUP 0.93 #QF 0.93
 51 TYR  HA     51 TYR  QD      3.81            #peak 68 #SUP 1.00
 66 THR  QG2    69 TYR  QE      3.83            #peak 105 #SUP 0.80 #QF 0.80
 64 HIS  HA     69 TYR  QE      3.95            #peak 111 #SUP 0.90 #QF 0.90
 50 VAL  QG1    51 TYR  QD      4.22            #peak 74 #SUP 0.49 #QF 0.49
 65 ILE  QD1    70 PHE  HZ      4.71            #peak 147 #SUP 0.84 #QF 0.68
 70 PHE  HZ     76 ILE  QD1     5.23            #peak 147 #SUP 0.84 #QF 0.68
 13 TYR  QE     51 TYR  HB2     4.01            #peak 23 #SUP 0.92 #QF 0.92
 13 TYR  QE     17 ASP  QB      4.28            #peak 25 #SUP 0.58 #QF 0.58
 37 TRP  HB3    37 TRP  HE3     4.09            #peak 36 #SUP 0.93 #QF 0.93
 37 TRP  H      37 TRP  HD1     4.17            #peak 32 #SUP 1.00
 65 ILE  HA     70 PHE  QE      4.20            #peak 136 #SUP 0.57 #QF 0.57
 32 THR  QG2    37 TRP  HZ3     4.82            #peak 64 #SUP 0.86 #QF 0.86
 13 TYR  QD     17 ASP  QB      4.82            #peak 12 #SUP 0.92 #QF 0.92
 68 LYS  QE     69 TYR  QE      4.37            #peak 107 #SUP 0.70 #QF 0.70
 65 ILE  HA     70 PHE  QD      5.23            #peak 117 #SUP 0.85 #QF 0.68
 69 TYR  HA     70 PHE  QD      5.50            #peak 117 #SUP 0.85 #QF 0.68
 64 HIS  HD2    83 LEU  QD1     5.20            #peak 85 #SUP 0.69 #QF 0.50
 64 HIS  HD2    83 LEU  QD2     5.35            #peak 85 #SUP 0.69 #QF 0.50
 60 ILE  HB     70 PHE  QE      4.52            #peak 132 #SUP 0.80 #QF 0.80
 60 ILE  HB     70 PHE  HZ      4.55            #peak 143 #SUP 0.62 #QF 0.62
 33 PRO  HG3    37 TRP  HD1     4.55            #peak 27 #SUP 0.84 #QF 0.84
142 PYA  H49    66 THR  HA      5.01            #peak 6000
142 PYA  Q38   142 PYA  H41     3.22            #peak 1 #SUP 0.97 #QF 0.97
142 PYA  H36   142 PYA  Q38     3.81            #peak 2 #SUP 0.96 #QF 0.96
142 PYA  H41   142 PYA  Q43     3.86            #peak 3 #SUP 0.98 #QF 0.98
142 PYA  Q42   142 PYA  H44     3.95            #peak 6 #SUP 0.98 #QF 0.98
142 PYA  H283  142 PYA  H36     5.50            #peak 8 #SUP 0.98 #QF 0.98
142 PYA  H32   142 PYA  H36     3.65            #peak 9 #SUP 0.92 #QF 0.44
142 PYA  Q31   142 PYA  H41     5.50            #peak 11 #SUP 0.71 #QF 0.32
142 PYA  Q30   142 PYA  H44     5.44            #peak 12 #SUP 0.98 #QF 0.88
142 PYA  Q30   142 PYA  H36     4.66            #peak 14 #SUP 0.95 #QF 0.64
142 PYA  H44   142 PYA  H49     3.22            #peak 19 #SUP 0.95 #QF 0.95
142 PYA  H372  142 PYA  H41     5.50            #peak 20 #SUP 0.93 #QF 0.35
142 PYA  H373  142 PYA  H41     5.50            #peak 20 #SUP 0.93 #QF 0.35
142 PYA  H283  142 PYA  Q31     3.67            #peak 22 #SUP 0.97 #QF 0.97
142 PYA  H283  142 PYA  Q30     3.88            #peak 23 #SUP 0.99 #QF 0.99
142 PYA  H282  142 PYA  Q31     3.67            #peak 26 #SUP 0.93 #QF 0.93
 35 LEU  QD1    70 PHE  HB3     4.23            #peak 27 #SUP 0.97 #QF 0.54
142 PYA  H282  142 PYA  Q30     3.88            #peak 27 #SUP 0.97 #QF 0.54
142 PYA  H282  142 PYA  H36     5.50            #peak 28 #SUP 0.91 #QF 0.91
142 PYA  Q31   142 PYA  H32     3.44            #peak 29 #SUP 0.97 #QF 0.97
142 PYA  Q30   142 PYA  H32     3.29            #peak 30 #SUP 0.97 #QF 0.97
142 PYA  Q31   142 PYA  H49     4.93            #peak 31 #SUP 0.89 #QF 0.89
142 PYA  Q30   142 PYA  H49     4.87            #peak 32 #SUP 0.87 #QF 0.87
142 PYA  Q31   142 PYA  H50     5.45            #peak 33 #SUP 0.85 #QF 0.85
142 PYA  Q30   142 PYA  H50     5.50            #peak 34 #SUP 0.99 #QF 0.33
142 PYA  Q31   142 PYA  H51     5.47            #peak 35 #SUP 0.96 #QF 0.96
142 PYA  Q30   142 PYA  H51     5.38            #peak 36 #SUP 0.94 #QF 0.94
142 PYA  Q30   142 PYA  H372    5.50            #peak 37 #SUP 0.94 #QF 0.40
142 PYA  Q30   142 PYA  H373    5.50            #peak 37 #SUP 0.94 #QF 0.40
142 PYA  Q30   142 PYA  Q42     4.49            #peak 39 #SUP 0.98 #QF 0.97
142 PYA  Q42   142 PYA  Q43     2.89            #peak 52 #SUP 0.97 #QF 0.97
  3 GLY  QA      4 GLU  HA      4.38            #peak 714
  3 GLY  QA      5 GLU  H       4.70            #peak 709
  3 GLY  QA      6 VAL  HB      5.34            #peak 700
  3 GLY  QA      6 VAL  QQG     4.58            #peak 698
  4 GLU  H       4 GLU  QB      3.03            #peak 31
  4 GLU  HA      4 GLU  QG      3.03            #peak 752
  4 GLU  HA      7 LYS  QD      4.09            #peak 727
  4 GLU  QB      4 GLU  QG      2.36            #peak 762
  4 GLU  QB      7 LYS  QE      4.72            #peak 931
  4 GLU  QG      7 LYS  QD      3.96            #peak 765
  4 GLU  QG      7 LYS  QE      4.32            #peak 759
  5 GLU  HA      6 VAL  QQG     5.05            #peak 826
  5 GLU  QB      6 VAL  QQG     4.91            #peak 745
  6 VAL  H       6 VAL  QQG     3.11            #peak 36
  6 VAL  H       7 LYS  QE      5.34            #peak 52
  6 VAL  HA      9 LYS  QB      3.47            #peak 800
  6 VAL  HA      9 LYS  QG      4.56            #peak 798
  6 VAL  HB     55 GLU  QG      5.19            #peak 3414
  6 VAL  QQG     7 LYS  HA      4.62            #peak 847
  6 VAL  QQG     7 LYS  QE      5.09            #peak 39
  6 VAL  QQG    10 ILE  QG1     4.18            #peak 1154
  6 VAL  QQG    10 ILE  QD1     4.10            #peak 817
  6 VAL  QQG    55 GLU  QG      4.02            #peak 844
  7 LYS  H       7 LYS  QD      4.92            #peak 884
  7 LYS  H       7 LYS  QE      4.70            #peak 918
  7 LYS  H      10 ILE  QG1     4.46            #peak 70
  7 LYS  HA      7 LYS  QD      4.32            #peak 849
  7 LYS  HB2     7 LYS  QE      3.30            #peak 933
  7 LYS  HB2     8 GLU  QG      5.33            #peak 999
  7 LYS  HB3     7 LYS  QE      3.63            #peak 934
  7 LYS  HB3    77 SER  QB      4.59            #peak 1793
  7 LYS  QG     10 ILE  QG1     4.61            #peak 966
  7 LYS  QG     77 SER  QB      3.84            #peak 4664
  7 LYS  QD     77 SER  QB      4.37            #peak 1794
  7 LYS  QE      8 GLU  H       5.34            #peak 919
  7 LYS  QE     73 LEU  QQD     4.21            #peak 4177
  8 GLU  H       8 GLU  QB      3.01            #peak 84
  8 GLU  H       8 GLU  QG      3.53            #peak 83
  8 GLU  HA     11 ARG  QB      3.83            #peak 974
  8 GLU  QG      9 LYS  H       4.75            #peak 1004
  8 GLU  QG      9 LYS  HA      4.59            #peak 1021
  9 LYS  H       9 LYS  QB      3.09            #peak 101
  9 LYS  H       9 LYS  QG      3.42            #peak 102
  9 LYS  HA      9 LYS  QG      3.28            #peak 1091
  9 LYS  HA     10 ILE  QG1     5.34            #peak 1028
  9 LYS  QB      9 LYS  QD      3.14            #peak 1066
  9 LYS  QB      9 LYS  QE      3.34            #peak 1074
  9 LYS  QB     10 ILE  H       3.98            #peak 109
  9 LYS  QB     10 ILE  HA      4.23            #peak 1118
  9 LYS  QB     10 ILE  QG1     3.99            #peak 1063
  9 LYS  QG      9 LYS  QE      3.06            #peak 2977
  9 LYS  QE     10 ILE  QG1     5.34            #peak 1080
 10 ILE  H      10 ILE  QG1     3.33            #peak 1160
 10 ILE  HB     11 ARG  QG      4.51            #peak 1269
 10 ILE  QG2    14 ILE  QG1     4.42            #peak 1183
 10 ILE  QG1    11 ARG  H       4.58            #peak 121
 10 ILE  QG1    51 TYR  QE      4.52            #peak 83
 11 ARG  H      11 ARG  QB      2.99            #peak 125
 11 ARG  H      11 ARG  QD      4.40            #peak 128
 11 ARG  HA     11 ARG  QD      4.36            #peak 1196
 11 ARG  HA     28 LEU  QQD     3.84            #peak 1993
 11 ARG  QB     11 ARG  QD      3.05            #peak 1240
 11 ARG  QB     28 LEU  QQD     3.55            #peak 1985
 11 ARG  QG     12 ARG  H       4.43            #peak 141
 11 ARG  QG     73 LEU  H       5.34            #peak 1272
 11 ARG  QG     73 LEU  QQD     2.88            #peak 4183
 11 ARG  QD     73 LEU  QB      4.20            #peak 1242
 12 ARG  HA     12 ARG  QG      3.22            #peak 1286
 12 ARG  QG     13 TYR  H       5.34            #peak 168
 12 ARG  QG     16 GLU  QG      4.51            #peak 1101
 12 ARG  QD     15 MET  QG      4.58            #peak 1235
 12 ARG  QD     16 GLU  QG      5.34            #peak 1235
 13 TYR  HB2    14 ILE  QG1     5.15            #peak 1358
 13 TYR  HB3    18 LEU  QQD     5.10            #peak 1364
 13 TYR  QD     18 LEU  QQD     3.68            #peak 15
 13 TYR  QD     48 LEU  QQD     3.50            #peak 3044
 13 TYR  QE     14 ILE  QG1     5.34            #peak 24
 13 TYR  QE     18 LEU  QQD     3.40            #peak 16
 13 TYR  QE     48 LEU  QQD     3.78            #peak 3044
 14 ILE  H      14 ILE  QG1     3.28            #peak 180
 14 ILE  H      18 LEU  QQD     4.61            #peak 1593
 14 ILE  HA     14 ILE  QG1     3.20            #peak 1383
 14 ILE  HA     18 LEU  QQD     3.60            #peak 1606
 14 ILE  HA     48 LEU  QQD     4.28            #peak 3050
 14 ILE  HB     28 LEU  QQD     3.99            #peak 1388
 14 ILE  QG2    14 ILE  QG1     3.36            #peak 1435
 14 ILE  QG1    18 LEU  HB2     4.99            #peak 990
 14 ILE  QG1    18 LEU  HG      5.34            #peak 990
 14 ILE  QG1    48 LEU  QQD     4.49            #peak 1414
 14 ILE  QD1    48 LEU  QQD     2.85            #peak 3058
 15 MET  HA     15 MET  QG      3.53            #peak 129
 15 MET  HA     19 ILE  QG1     3.50            #peak 4636
 15 MET  QG     15 MET  QE      3.10            #peak 1459
 15 MET  QG     19 ILE  QD1     4.67            #peak 1681
 15 MET  QG     23 ALA  QB      4.45            #peak 1814
 15 MET  QG     28 LEU  QB      3.75            #peak 1474
 15 MET  QG     28 LEU  HG      4.98            #peak 1700
 15 MET  QG     28 LEU  QQD     3.26            #peak 1476
 15 MET  QE     19 ILE  QG1     4.29            #peak 1271
 15 MET  QE     24 LYS  QB      3.68            #peak 1461
 15 MET  QE     28 LEU  QQD     3.52            #peak 1464
 16 GLU  H      16 GLU  QB      3.12            #peak 218
 16 GLU  H      16 GLU  QG      3.44            #peak 216
 16 GLU  H      18 LEU  QQD     5.44            #peak 222
 16 GLU  HA     16 GLU  QG      3.22            #peak 1517
 16 GLU  QB     17 ASP  H       3.48            #peak 333
 16 GLU  QG     17 ASP  H       4.87            #peak 1515
 17 ASP  H      18 LEU  QQD     4.37            #peak 232
 17 ASP  HA     18 LEU  QQD     5.39            #peak 1538
 18 LEU  H      18 LEU  QQD     3.40            #peak 250
 18 LEU  HA     18 LEU  QQD     2.98            #peak 1565
 18 LEU  HB2    18 LEU  QQD     3.05            #peak 1614
 18 LEU  HB3    18 LEU  QQD     3.10            #peak 1630
 18 LEU  HG     48 LEU  QQD     4.77            #peak 1642
 18 LEU  QQD    44 ASN  HA      3.94            #peak 1619
 18 LEU  QQD    44 ASN  QB      3.27            #peak 1626
 18 LEU  QQD    44 ASN  QD2     4.55            #peak 710
 18 LEU  QQD    45 ILE  H       5.08            #peak 760
 18 LEU  QQD    47 LYS  HA      4.83            #peak 2939
 18 LEU  QQD    47 LYS  HB2     3.66            #peak 1612
 18 LEU  QQD    47 LYS  HD3     3.57            #peak 1632
 18 LEU  QQD    47 LYS  QE      4.92            #peak 1078
 18 LEU  QQD    48 LEU  H       4.47            #peak 797
 18 LEU  QQD    48 LEU  HA      4.89            #peak 1604
 18 LEU  QQD    48 LEU  QQD     3.59            #peak 1615
 18 LEU  QQD    51 TYR  QE      5.44            #peak 84
 19 ILE  H      19 ILE  QG1     3.56            #peak 266
 19 ILE  HA     19 ILE  QG1     3.30            #peak 1654
 19 ILE  QG2    19 ILE  QG1     2.90            #peak 1704
 19 ILE  QG2    20 GLY  QA      4.39            #peak 1708
 19 ILE  QG2    22 SER  QB      4.52            #peak 1798
 19 ILE  QG1    20 GLY  H       5.34            #peak 1250
 20 GLY  QA     21 PRO  QG      4.02            #peak 1720
 20 GLY  QA     21 PRO  HD3     3.39            #peak 1756
 20 GLY  QA     22 SER  H       4.34            #peak 285
 21 PRO  QB     22 SER  H       3.91            #peak 283
 22 SER  H      22 SER  QB      3.58            #peak 286
 23 ALA  HA     24 LYS  QB      4.46            #peak 1803
 24 LYS  H      24 LYS  QB      3.35            #peak 308
 24 LYS  H      24 LYS  QG      3.50            #peak 311
 24 LYS  HA     24 LYS  QG      3.51            #peak 1829
 24 LYS  HA     25 GLU  QB      4.95            #peak 1297
 24 LYS  QB     24 LYS  QD      3.21            #peak 1859
 24 LYS  QB     24 LYS  QE      3.75            #peak 1862
 24 LYS  QB     27 GLU  H       4.37            #peak 351
 25 GLU  H      25 GLU  QB      3.34            #peak 326
 25 GLU  QB     26 ASP  H       4.08            #peak 1159
 25 GLU  QB     26 ASP  HA      4.65            #peak 1905
 25 GLU  QB     28 LEU  QB      4.49            #peak 743
 26 ASP  H      28 LEU  QB      5.34            #peak 330
 26 ASP  QB     27 GLU  QB      4.73            #peak 1912
 27 GLU  H      27 GLU  QB      3.05            #peak 350
 27 GLU  H      28 LEU  QB      4.84            #peak 352
 27 GLU  QB     28 LEU  H       3.95            #peak 360
 27 GLU  QB     28 LEU  QQD     5.28            #peak 1940
 28 LEU  H      28 LEU  QQD     3.71            #peak 354
 28 LEU  HA     28 LEU  QQD     3.23            #peak 221
 28 LEU  QB     28 LEU  QQD     2.64            #peak 1999
 28 LEU  QB     29 ASP  H       4.31            #peak 389
 28 LEU  QB     32 THR  QG2     5.34            #peak 2121
 28 LEU  QQD    29 ASP  H       3.72            #peak 678
 28 LEU  QQD    29 ASP  HB2     5.20            #peak 1983
 28 LEU  QQD    32 THR  HB      4.53            #peak 222
 30 ASP  HA     73 LEU  QB      3.17            #peak 1929
 30 ASP  QB     31 GLN  QG      4.03            #peak 2085
 30 ASP  QB     32 THR  H       5.34            #peak 461
 30 ASP  QB     73 LEU  QB      4.39            #peak 2058
 31 GLN  H      31 GLN  QB      3.26            #peak 424
 31 GLN  HA     72 ASP  QB      4.35            #peak 4137
 31 GLN  QB     31 GLN  QE2     3.75            #peak 437
 31 GLN  QB     32 THR  H       3.83            #peak 464
 31 GLN  QB     32 THR  HA      4.56            #peak 4815
 31 GLN  QG     74 ASN  QD2     3.82            #peak 1305
 32 THR  H      72 ASP  QB      5.14            #peak 460
 34 LEU  H      34 LEU  QB      3.42            #peak 474
 34 LEU  H      34 LEU  QQD     3.31            #peak 468
 34 LEU  H      35 LEU  QQD     4.85            #peak 469
 34 LEU  H      40 LEU  QQD     5.24            #peak 470
 34 LEU  HA     34 LEU  QQD     3.09            #peak 1623
 34 LEU  HA     39 ILE  QG1     3.88            #peak 2527
 34 LEU  HA     40 LEU  QQD     5.18            #peak 2595
 34 LEU  QB     34 LEU  QQD     2.64            #peak 2248
 34 LEU  QB     35 LEU  H       3.64            #peak 501
 34 LEU  QB     35 LEU  HA      4.74            #peak 2274
 34 LEU  QB     35 LEU  QQD     4.07            #peak 2202
 34 LEU  QB     39 ILE  QD1     4.30            #peak 2201
 34 LEU  QB     40 LEU  QQD     2.96            #peak 2607
 34 LEU  QB     72 ASP  HA      4.70            #peak 4128
 34 LEU  QQD    35 LEU  H       4.97            #peak 2243
 34 LEU  QQD    37 TRP  H       5.44            #peak 2243
 34 LEU  QQD    37 TRP  HB2     5.37            #peak 2399
 34 LEU  QQD    37 TRP  HB3     5.44            #peak 2409
 34 LEU  QQD    39 ILE  HB      3.12            #peak 1631
 34 LEU  QQD    40 LEU  HG      4.74            #peak 2240
 34 LEU  QQD    40 LEU  QQD     3.70            #peak 2242
 34 LEU  QQD    72 ASP  H       4.41            #peak 1230
 34 LEU  QQD    72 ASP  HA      3.56            #peak 4129
 34 LEU  QQD    73 LEU  H       4.17            #peak 1275
 34 LEU  QQD    73 LEU  HA      4.52            #peak 2230
 34 LEU  QQD    74 ASN  H       5.44            #peak 1276
 35 LEU  H      35 LEU  QQD     3.68            #peak 507
 35 LEU  H      40 LEU  QQD     4.75            #peak 508
 35 LEU  HA     35 LEU  QQD     3.11            #peak 2341
 35 LEU  HA     40 LEU  QQD     4.62            #peak 2275
 35 LEU  QB     36 GLU  H       3.72            #peak 513
 35 LEU  QB     38 GLY  H       5.34            #peak 583
 35 LEU  QQD    36 GLU  H       4.90            #peak 511
 35 LEU  QQD    36 GLU  HA      5.44            #peak 2342
 35 LEU  QQD    38 GLY  H       5.31            #peak 2335
 35 LEU  QQD    38 GLY  QA      5.28            #peak 2342
 35 LEU  QQD    39 ILE  H       5.44            #peak 2335
 35 LEU  QQD    40 LEU  H       4.10            #peak 2336
 35 LEU  QQD    40 LEU  HA      5.16            #peak 2340
 35 LEU  QQD    40 LEU  HB2     3.65            #peak 2356
 35 LEU  QQD    40 LEU  HB3     4.13            #peak 2355
 35 LEU  QQD    40 LEU  QQD     3.24            #peak 2584
 35 LEU  QQD    41 ASN  H       4.96            #peak 294
 35 LEU  QQD   142 PYA  H51     5.18            #peak 6011
 35 LEU  QQD    45 ILE  QD1     3.59            #peak 2333
 35 LEU  QQD    67 GLY  QA      3.20            #peak 292
 35 LEU  QQD    70 PHE  H       4.30            #peak 290
 35 LEU  QQD    70 PHE  QB      3.06            #peak 27
 35 LEU  QQD    71 LYS  H       4.51            #peak 291
 35 LEU  QQD    71 LYS  HA      3.67            #peak 591
 35 LEU  QQD    71 LYS  QB      5.11            #peak 4072
 36 GLU  H      36 GLU  QB      3.35            #peak 915
 36 GLU  H      36 GLU  QG      4.50            #peak 29
 36 GLU  HA     36 GLU  QG      3.25            #peak 2380
 36 GLU  QB     37 TRP  HA      4.38            #peak 308
 36 GLU  QB     37 TRP  HE1     4.10            #peak 551
 36 GLU  QG     37 TRP  HD1     4.29            #peak 29
 36 GLU  QG     37 TRP  HE1     5.19            #peak 552
 37 TRP  H      40 LEU  QQD     5.44            #peak 544
 37 TRP  HB2    39 ILE  QG1     4.70            #peak 897
 39 ILE  H      39 ILE  QG1     3.53            #peak 593
 39 ILE  H      40 LEU  QQD     4.39            #peak 2603
 39 ILE  HA     39 ILE  QG1     3.43            #peak 2481
 39 ILE  QG2    39 ILE  QG1     3.03            #peak 2557
 39 ILE  QG2    44 ASN  QD2     5.34            #peak 726
 40 LEU  H      40 LEU  QQD     3.43            #peak 627
 40 LEU  HA     40 LEU  QQD     3.52            #peak 2244
 40 LEU  HA     44 ASN  QD2     3.86            #peak 735
 40 LEU  HB3    40 LEU  QQD     2.93            #peak 2606
 40 LEU  QQD    41 ASN  H       4.75            #peak 630
 40 LEU  QQD    44 ASN  QD2     5.27            #peak 726
 40 LEU  QQD    45 ILE  QD1     3.65            #peak 332
 40 LEU  QQD    70 PHE  HA      4.58            #peak 4009
 40 LEU  QQD    70 PHE  QB      4.07            #peak 2594
 40 LEU  QQD    70 PHE  QD      4.02            #peak 2599
 42 SER  HA     43 MET  QG      5.34            #peak 2663
 42 SER  QB    142 PYA  Q30     4.83            #peak 2678
 42 SER  QB    142 PYA  Q31     5.35            #peak 2678
 42 SER  QB     43 MET  HA      5.35            #peak 2685
 42 SER  QB     43 MET  QE      4.39            #peak 2709
 42 SER  QB     45 ILE  QG2     4.71            #peak 6022
142 PYA  Q28   142 PYA  Q30     3.14            #peak 23
142 PYA  Q28   142 PYA  Q31     3.20            #peak 26
142 PYA  Q28   142 PYA  H36     4.84            #peak 8
142 PYA  Q28    45 ILE  QG2     4.35            #peak 6012
142 PYA  Q28    46 VAL  QG2     4.85            #peak 2915
142 PYA  Q28    65 ILE  QG2     4.24            #peak 3821
142 PYA  Q30   142 PYA  Q37     4.77            #peak 37
142 PYA  Q37   142 PYA  H41     4.85            #peak 20
 43 MET  H      43 MET  QB      3.41            #peak 367
 43 MET  H      43 MET  QG      3.60            #peak 372
 43 MET  HA     43 MET  QG      3.57            #peak 2741
 43 MET  QB     44 ASN  H       3.79            #peak 1445
 43 MET  QG     43 MET  QE      2.98            #peak 2725
 45 ILE  H      45 ILE  QG1     4.10            #peak 762
 45 ILE  HA     45 ILE  QG1     3.45            #peak 2807
 45 ILE  HA     48 LEU  QQD     3.96            #peak 2806
 45 ILE  QG2    49 MET  QG      4.92            #peak 2881
 45 ILE  QD1    48 LEU  QQD     4.87            #peak 3041
 46 VAL  HA     49 MET  QG      3.68            #peak 2893
 46 VAL  QG1    49 MET  QG      4.89            #peak 837
 46 VAL  QG2    49 MET  QG      4.18            #peak 3137
 47 LYS  HA     47 LYS  QG      3.41            #peak 2987
 47 LYS  HA     48 LEU  QQD     4.71            #peak 3033
 47 LYS  HB2    48 LEU  QQD     4.26            #peak 3037
 47 LYS  QG     47 LYS  QE      3.27            #peak 2979
 48 LEU  H      48 LEU  QQD     3.80            #peak 415
 48 LEU  HA     48 LEU  QQD     3.24            #peak 3046
 48 LEU  QQD    51 TYR  HB2     4.11            #peak 3052
 48 LEU  QQD    51 TYR  QD      4.46            #peak 3045
 48 LEU  QQD    52 ILE  H       5.24            #peak 414
 48 LEU  QQD    70 PHE  QD      4.64            #peak 3030
 48 LEU  QQD    70 PHE  QE      3.76            #peak 130
 49 MET  H      49 MET  QG      3.10            #peak 837
 49 MET  HA     49 MET  QG      3.46            #peak 3073
 49 MET  QG     49 MET  QE      2.96            #peak 3091
 49 MET  QG     50 VAL  H       4.34            #peak 852
 49 MET  QG     60 ILE  H       5.29            #peak 1739
 49 MET  QG     60 ILE  HB      4.39            #peak 3128
 49 MET  QG     70 PHE  HZ      4.90            #peak 142
 49 MET  QE     65 ILE  QG1     3.00            #peak 3088
 50 VAL  QG2    54 ASP  QB      3.87            #peak 839
 51 TYR  QE     55 GLU  QG      4.47            #peak 3403
 52 ILE  H      52 ILE  QG1     3.52            #peak 890
 52 ILE  HA     52 ILE  QG1     3.56            #peak 3205
 52 ILE  HB     58 VAL  QQG     3.81            #peak 3522
 52 ILE  QG2    56 MET  QG      3.93            #peak 6020
 52 ILE  QG2    58 VAL  QQG     2.99            #peak 3525
 53 ARG  H      53 ARG  QD      5.34            #peak 914
 53 ARG  HA     53 ARG  QG      3.46            #peak 3299
 53 ARG  HA     53 ARG  QD      4.05            #peak 3295
 53 ARG  HA     58 VAL  QQG     4.12            #peak 4482
 53 ARG  QG     54 ASP  HA      4.39            #peak 3360
 54 ASP  QB     55 GLU  H       3.56            #peak 958
 55 GLU  H      55 GLU  QG      4.16            #peak 960
 55 GLU  HA     55 GLU  QG      3.27            #peak 3374
 56 MET  H      56 MET  QG      4.30            #peak 970
 56 MET  HA     56 MET  QG      3.18            #peak 477
 56 MET  HA     58 VAL  QQG     4.75            #peak 3428
 56 MET  QB     56 MET  QE      3.47            #peak 3466
 56 MET  QB     58 VAL  QQG     4.49            #peak 6023
 56 MET  QG     57 GLY  H       5.34            #peak 998
 56 MET  QG     58 VAL  QQG     3.92            #peak 3521
 56 MET  QE     58 VAL  QQG     4.58            #peak 3521
 57 GLY  H      58 VAL  QQG     4.63            #peak 1005
 57 GLY  QA     58 VAL  QQG     4.47            #peak 3480
 58 VAL  H      58 VAL  QQG     3.46            #peak 1006
 58 VAL  HB     83 LEU  QB      4.64            #peak 3493
 58 VAL  QQG    59 SER  H       3.46            #peak 1046
 58 VAL  QQG    80 VAL  HA      3.72            #peak 3535
 58 VAL  QQG    83 LEU  H       4.32            #peak 499
 58 VAL  QQG    83 LEU  QB      3.05            #peak 3538
 58 VAL  QQG    84 LYS  H       3.69            #peak 498
 58 VAL  QQG    84 LYS  HA      3.92            #peak 3533
 58 VAL  QQG    84 LYS  HB2     4.79            #peak 880
 58 VAL  QQG    84 LYS  HB3     4.68            #peak 881
 58 VAL  QQG    84 LYS  QG      3.37            #peak 3524
 58 VAL  QQG    84 LYS  QD      3.48            #peak 3523
 58 VAL  QQG    84 LYS  QE      3.74            #peak 944
 59 SER  H      59 SER  QB      3.26            #peak 1036
 59 SER  HA     60 ILE  QG1     4.61            #peak 1257
 59 SER  QB     60 ILE  H       3.83            #peak 1059
 60 ILE  HA     60 ILE  QG1     3.62            #peak 3601
 60 ILE  QG2    61 PRO  QB      4.85            #peak 883
 60 ILE  QG2    61 PRO  QD      3.40            #peak 3614
 60 ILE  QG2    64 HIS  QB      3.19            #peak 3617
 60 ILE  QG2    65 ILE  QG1     3.97            #peak 3623
 60 ILE  QG1    61 PRO  QD      5.06            #peak 3643
 60 ILE  QG1    64 HIS  QB      5.18            #peak 3595
 60 ILE  QG1    70 PHE  QE      4.21            #peak 130
 60 ILE  QD1    61 PRO  QD      4.33            #peak 3587
 60 ILE  QD1    64 HIS  QB      3.99            #peak 3583
 61 PRO  QB     63 THR  H       4.29            #peak 1083
 61 PRO  QB     63 THR  QG2     4.05            #peak 3725
 61 PRO  QB     64 HIS  H       4.54            #peak 1029
 64 HIS  HA     69 TYR  QB      5.34            #peak 1560
 64 HIS  QB     79 THR  QG2     5.01            #peak 4410
 65 ILE  H      65 ILE  QG1     3.52            #peak 12
 65 ILE  QG2    65 ILE  QG1     2.93            #peak 3826
 66 THR  QG2    67 GLY  QA      4.96            #peak 3855
 66 THR  QG2    68 LYS  QB      4.31            #peak 3846
 66 THR  QG2    68 LYS  QG      3.76            #peak 4840
 66 THR  QG2    69 TYR  QB      4.47            #peak 3851
 68 LYS  HA     68 LYS  QG      3.57            #peak 3891
 68 LYS  HA     68 LYS  QD      4.52            #peak 3926
 68 LYS  HA     71 LYS  QB      4.65            #peak 3889
 68 LYS  HA     71 LYS  QG      4.17            #peak 604
 68 LYS  HA     71 LYS  QD      4.40            #peak 4078
 68 LYS  QB     69 TYR  H       4.08            #peak 1181
 68 LYS  QG     69 TYR  H       4.19            #peak 1183
 68 LYS  QG     69 TYR  HA      4.65            #peak 3967
 69 TYR  H      69 TYR  QB      3.59            #peak 1176
 69 TYR  QB     75 ALA  QB      5.34            #peak 4263
 69 TYR  QB     79 THR  QG2     4.29            #peak 4407
 70 PHE  H      71 LYS  QG      5.24            #peak 599
 70 PHE  QB     76 ILE  QD1     4.13            #peak 4831
 71 LYS  H      71 LYS  QB      3.24            #peak 1223
 71 LYS  H      71 LYS  QG      3.49            #peak 1228
 71 LYS  H      71 LYS  QD      4.85            #peak 1224
 71 LYS  HA     71 LYS  QD      4.07            #peak 4051
 71 LYS  QB     71 LYS  QD      3.20            #peak 4084
 71 LYS  QB     71 LYS  QE      4.12            #peak 4093
 71 LYS  QB     72 ASP  H       3.62            #peak 1234
 71 LYS  QB     75 ALA  HA      4.92            #peak 4249
 71 LYS  QB     75 ALA  QB      3.62            #peak 4066
 71 LYS  QB     76 ILE  HG13    5.34            #peak 4073
 71 LYS  QG     71 LYS  QE      3.11            #peak 4094
 71 LYS  QG     72 ASP  H       4.73            #peak 600
 72 ASP  QB     74 ASN  H       4.44            #peak 1283
 73 LEU  H      73 LEU  QB      3.53            #peak 1270
 73 LEU  QB     74 ASN  H       3.85            #peak 1279
 73 LEU  QQD    74 ASN  QD2     4.92            #peak 4169
 74 ASN  H      74 ASN  QB      3.15            #peak 1281
 74 ASN  H      74 ASN  QD2     4.29            #peak 1289
 74 ASN  HA     77 SER  QB      3.83            #peak 4193
 74 ASN  QB     74 ASN  QD2     3.18            #peak 1304
 74 ASN  QB     75 ALA  H       3.51            #peak 1332
 74 ASN  QB     75 ALA  QB      4.57            #peak 4265
 76 ILE  QG2    77 SER  QB      4.77            #peak 4799
 77 SER  H      77 SER  QB      3.07            #peak 1380
 77 SER  QB     78 ARG  H       4.03            #peak 1400
 78 ARG  H      78 ARG  QG      3.45            #peak 1407
 78 ARG  H      81 GLU  QG      5.27            #peak 1405
 78 ARG  HA     78 ARG  QG      3.28            #peak 641
 78 ARG  HA     81 GLU  QB      3.89            #peak 4339
 78 ARG  QG     79 THR  H       4.36            #peak 4358
 78 ARG  QD     81 GLU  QB      5.27            #peak 987
 78 ARG  QD     81 GLU  QG      4.55            #peak 4355
 79 THR  HB     82 GLN  QG      5.25            #peak 4543
 79 THR  QG2    82 GLN  QB      5.34            #peak 4413
 80 VAL  HA     83 LEU  QB      4.24            #peak 4433
 80 VAL  QG1    81 GLU  QB      5.28            #peak 745
 80 VAL  QG1    81 GLU  QG      4.75            #peak 4450
 80 VAL  QG2    83 LEU  QB      4.18            #peak 4475
 80 VAL  QG2    84 LYS  QG      4.13            #peak 964
 81 GLU  H      81 GLU  QB      2.86            #peak 1446
 81 GLU  H      81 GLU  QG      3.27            #peak 1448
 81 GLU  QB     82 GLN  H       3.76            #peak 1465
 81 GLU  QB     84 LYS  QE      5.13            #peak 931
 81 GLU  QB     85 ALA  QB      4.59            #peak 4687
 82 GLN  H      82 GLN  QB      2.95            #peak 1464
 82 GLN  H      82 GLN  QG      3.35            #peak 1463
 82 GLN  QB     82 GLN  QE2     4.36            #peak 1480
 82 GLN  QB     83 LEU  H       3.77            #peak 4500
 82 GLN  QB     83 LEU  HG      4.61            #peak 4522
 82 GLN  QB     83 LEU  QD2     5.21            #peak 4618
 82 GLN  QB     85 ALA  H       5.34            #peak 1546
 82 GLN  QG     83 LEU  HG      4.83            #peak 4555
 83 LEU  H      83 LEU  QB      3.57            #peak 1509
 83 LEU  H      84 LYS  QG      4.56            #peak 1510
 83 LEU  HA     86 GLU  QB      3.76            #peak 4567
 83 LEU  QB     83 LEU  QD1     3.40            #peak 4585
 83 LEU  QB     83 LEU  QD2     3.06            #peak 4617
 83 LEU  QB     84 LYS  H       3.84            #peak 1516
 83 LEU  QD2    86 GLU  QB      4.62            #peak 744
 84 LYS  H      84 LYS  QG      3.33            #peak 1517
 84 LYS  HA     84 LYS  QG      3.72            #peak 4636
 84 LYS  QG     84 LYS  QE      3.27            #peak 4658
 85 ALA  QB     86 GLU  QG      3.96            #peak 4685
 86 GLU  H      86 GLU  QB      2.99            #peak 1557
 86 GLU  H      86 GLU  QG      3.41            #peak 1560
 86 GLU  HA     86 GLU  QG      3.55            #peak 4701
 86 GLU  QB     87 SER  H       3.71            #peak 1584
 86 GLU  QB     87 SER  HA      4.40            #peak 4715
 88 ALA  QB     89 LEU  QQD     3.49            #peak 4757
 89 LEU  HA     89 LEU  QQD     3.52            #peak 4753
 89 LEU  HB3    89 LEU  QQD     3.10            #peak 4755
 89 LEU  QQD    90 GLU  H       4.20            #peak 1614
 89 LEU  QQD    90 GLU  HA      3.82            #peak 4749
 89 LEU  QQD    90 GLU  QB      4.45            #peak 2080

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1   3.446  16.096  -2.550
    2    H2   MET   1           2H       MET   1   4.984  16.662  -2.132
    3    H3   MET   1           3H       MET   1   3.608  17.483  -1.605
    4    HA   MET   1           HA       MET   1   4.317  14.708  -0.826
    5    HB2  MET   1           2HB      MET   1   4.538  17.282   0.789
    6    HB3  MET   1           1HB      MET   1   4.859  15.668   1.412
    7    HG2  MET   1           2HG      MET   1   6.949  16.763   0.980
    8    HG3  MET   1           1HG      MET   1   6.744  15.475  -0.206
    9    HE1  MET   1           3HE      MET   1   6.268  19.984  -1.190
   10    HE2  MET   1           1HE      MET   1   6.703  19.376   0.409
   11    HE3  MET   1           2HE      MET   1   5.074  19.121  -0.224
   12    H    ASP   2           H        ASP   2   1.895  15.520  -1.936
   13    HA   ASP   2           HA       ASP   2  -0.026  16.413   0.052
   14    HB2  ASP   2           2HB      ASP   2  -0.347  15.719  -2.910
   15    HB3  ASP   2           1HB      ASP   2  -1.569  16.501  -1.902
   16    H    GLY   3           H        GLY   3   1.215  13.449  -0.842
   17    HA2  GLY   3           2HA      GLY   3   0.584  11.362   0.046
   18    HA3  GLY   3           1HA      GLY   3  -1.056  11.951   0.284
   19    H    GLU   4           H        GLU   4  -1.647  12.950  -2.223
   20    HA   GLU   4           HA       GLU   4  -2.495  10.549  -3.504
   21    HB2  GLU   4           2HB      GLU   4  -2.747  13.450  -4.295
   22    HB3  GLU   4           1HB      GLU   4  -3.481  12.145  -5.212
   23    HG2  GLU   4           2HG      GLU   4  -4.208  11.888  -2.393
   24    HG3  GLU   4           1HG      GLU   4  -4.573  13.512  -2.970
   25    H    GLU   5           H        GLU   5  -0.308  13.117  -4.642
   26    HA   GLU   5           HA       GLU   5   0.550  11.744  -6.981
   27    HB2  GLU   5           2HB      GLU   5   2.631  13.409  -6.636
   28    HB3  GLU   5           1HB      GLU   5   1.070  13.947  -7.234
   29    HG2  GLU   5           2HG      GLU   5   1.884  15.534  -5.628
   30    HG3  GLU   5           1HG      GLU   5   0.467  14.725  -4.971
   31    H    VAL   6           H        VAL   6   1.393  11.304  -3.669
   32    HA   VAL   6           HA       VAL   6   3.761   9.729  -4.226
   33    HB   VAL   6           HB       VAL   6   2.208  10.193  -1.659
   34   HG11  VAL   6          1HG1      VAL   6   4.799   8.661  -1.995
   35   HG12  VAL   6          2HG1      VAL   6   3.240   7.971  -1.542
   36   HG13  VAL   6          3HG1      VAL   6   4.056   9.090  -0.450
   37   HG21  VAL   6          3HG2      VAL   6   4.179  11.505  -0.953
   38   HG22  VAL   6          1HG2      VAL   6   3.446  12.170  -2.414
   39   HG23  VAL   6          2HG2      VAL   6   4.927  11.216  -2.527
   40    H    LYS   7           H        LYS   7   0.319   9.157  -3.593
   41    HA   LYS   7           HA       LYS   7   0.533   6.396  -2.951
   42    HB2  LYS   7           2HB      LYS   7  -1.820   8.121  -3.749
   43    HB3  LYS   7           1HB      LYS   7  -2.005   6.381  -3.522
   44    HG2  LYS   7           2HG      LYS   7  -1.237   6.577  -1.194
   45    HG3  LYS   7           1HG      LYS   7  -0.953   8.302  -1.407
   46    HD2  LYS   7           2HD      LYS   7  -3.634   6.882  -1.448
   47    HD3  LYS   7           1HD      LYS   7  -3.030   7.960  -0.195
   48    HE2  LYS   7           2HE      LYS   7  -3.060   9.825  -1.814
   49    HE3  LYS   7           1HE      LYS   7  -3.735   8.744  -3.033
   50    HZ1  LYS   7           3HZ      LYS   7  -5.658   8.413  -1.597
   51    HZ2  LYS   7           1HZ      LYS   7  -5.447  10.048  -1.978
   52    HZ3  LYS   7           2HZ      LYS   7  -5.012   9.468  -0.451
   53    H    GLU   8           H        GLU   8   0.040   8.078  -5.989
   54    HA   GLU   8           HA       GLU   8  -0.372   5.804  -7.618
   55    HB2  GLU   8           2HB      GLU   8   0.350   7.304  -9.490
   56    HB3  GLU   8           1HB      GLU   8  -0.895   7.992  -8.452
   57    HG2  GLU   8           2HG      GLU   8   0.814   9.326  -7.274
   58    HG3  GLU   8           1HG      GLU   8   2.058   8.665  -8.339
   59    H    LYS   9           H        LYS   9   2.601   7.353  -6.422
   60    HA   LYS   9           HA       LYS   9   4.482   5.893  -7.968
   61    HB2  LYS   9           2HB      LYS   9   4.909   6.990  -5.167
   62    HB3  LYS   9           1HB      LYS   9   6.158   6.532  -6.316
   63    HG2  LYS   9           2HG      LYS   9   5.401   8.378  -7.805
   64    HG3  LYS   9           1HG      LYS   9   4.264   8.878  -6.546
   65    HD2  LYS   9           2HD      LYS   9   7.298   8.819  -6.383
   66    HD3  LYS   9           1HD      LYS   9   6.261  10.241  -6.362
   67    HE2  LYS   9           2HE      LYS   9   5.377   9.588  -4.153
   68    HE3  LYS   9           1HE      LYS   9   6.348   8.115  -4.184
   69    HZ1  LYS   9           3HZ      LYS   9   8.345   9.449  -4.151
   70    HZ2  LYS   9           1HZ      LYS   9   7.357   9.855  -2.842
   71    HZ3  LYS   9           2HZ      LYS   9   7.448  10.877  -4.190
   72    H    ILE  10           H        ILE  10   2.756   5.191  -4.994
   73    HA   ILE  10           HA       ILE  10   4.215   3.008  -4.014
   74    HB   ILE  10           HB       ILE  10   1.178   3.189  -3.898
   75   HG12  ILE  10          2HG1      ILE  10   2.034   5.344  -3.122
   76   HG13  ILE  10          1HG1      ILE  10   1.396   4.430  -1.770
   77   HG21  ILE  10          1HG2      ILE  10   3.165   1.883  -2.009
   78   HG22  ILE  10          2HG2      ILE  10   2.078   1.056  -3.125
   79   HG23  ILE  10          3HG2      ILE  10   1.414   1.964  -1.769
   80   HD11  ILE  10          3HD1      ILE  10   3.698   3.876  -1.100
   81   HD12  ILE  10          1HD1      ILE  10   3.391   5.613  -1.146
   82   HD13  ILE  10          2HD1      ILE  10   4.293   4.847  -2.451
   83    H    ARG  11           H        ARG  11   1.553   3.167  -6.362
   84    HA   ARG  11           HA       ARG  11   1.240   0.445  -6.960
   85    HB2  ARG  11           2HB      ARG  11   0.748   2.911  -8.666
   86    HB3  ARG  11           1HB      ARG  11   0.345   1.284  -9.210
   87    HG2  ARG  11           2HG      ARG  11  -1.168   1.020  -7.276
   88    HG3  ARG  11           1HG      ARG  11  -0.805   2.677  -6.780
   89    HD2  ARG  11           2HD      ARG  11  -2.064   1.871  -9.426
   90    HD3  ARG  11           1HD      ARG  11  -2.943   2.504  -8.031
   91    HE   ARG  11           HE       ARG  11  -0.817   4.228  -8.985
   92   HH11  ARG  11          1HH1      ARG  11  -4.208   3.422  -9.385
   93   HH12  ARG  11          2HH1      ARG  11  -4.621   4.962 -10.061
   94   HH21  ARG  11          1HH2      ARG  11  -1.372   6.225  -9.944
   95   HH22  ARG  11          2HH2      ARG  11  -3.018   6.543 -10.377
   96    H    ARG  12           H        ARG  12   3.514   2.791  -8.340
   97    HA   ARG  12           HA       ARG  12   4.561   1.162 -10.404
   98    HB2  ARG  12           2HB      ARG  12   5.539   3.632  -8.975
   99    HB3  ARG  12           1HB      ARG  12   6.686   2.746  -9.966
  100    HG2  ARG  12           2HG      ARG  12   5.609   4.638 -11.178
  101    HG3  ARG  12           1HG      ARG  12   5.356   3.070 -11.947
  102    HD2  ARG  12           2HD      ARG  12   3.105   2.944 -10.989
  103    HD3  ARG  12           1HD      ARG  12   3.350   4.489 -10.178
  104    HE   ARG  12           HE       ARG  12   3.012   5.591 -12.159
  105   HH11  ARG  12          1HH1      ARG  12   3.165   2.149 -12.828
  106   HH12  ARG  12          2HH1      ARG  12   2.542   2.314 -14.439
  107   HH21  ARG  12          1HH2      ARG  12   2.110   5.771 -14.210
  108   HH22  ARG  12          2HH2      ARG  12   1.942   4.374 -15.222
  109    H    TYR  13           H        TYR  13   5.650   1.758  -7.116
  110    HA   TYR  13           HA       TYR  13   7.789  -0.075  -7.025
  111    HB2  TYR  13           2HB      TYR  13   7.558   1.693  -5.360
  112    HB3  TYR  13           1HB      TYR  13   6.023   1.032  -4.806
  113    HD1  TYR  13           HD1      TYR  13   9.660   0.134  -5.113
  114    HD2  TYR  13           HD2      TYR  13   6.008  -0.506  -2.980
  115    HE1  TYR  13           HE1      TYR  13  10.855  -1.247  -3.487
  116    HE2  TYR  13           HE2      TYR  13   7.225  -1.879  -1.340
  117    HH   TYR  13           HH       TYR  13   9.420  -3.315  -1.464
  118    H    ILE  14           H        ILE  14   4.315  -0.511  -6.507
  119    HA   ILE  14           HA       ILE  14   4.360  -3.054  -5.271
  120    HB   ILE  14           HB       ILE  14   2.171  -1.623  -6.826
  121   HG12  ILE  14          2HG1      ILE  14   2.382  -2.238  -3.843
  122   HG13  ILE  14          1HG1      ILE  14   2.898  -0.718  -4.556
  123   HG21  ILE  14          1HG2      ILE  14   1.911  -4.258  -5.327
  124   HG22  ILE  14          2HG2      ILE  14   1.752  -4.038  -7.070
  125   HG23  ILE  14          3HG2      ILE  14   0.565  -3.324  -5.979
  126   HD11  ILE  14          3HD1      ILE  14   0.093  -1.809  -4.510
  127   HD12  ILE  14          1HD1      ILE  14   0.592  -0.303  -5.287
  128   HD13  ILE  14          2HD1      ILE  14   0.740  -0.487  -3.540
  129    H    MET  15           H        MET  15   4.130  -2.072  -8.674
  130    HA   MET  15           HA       MET  15   3.832  -4.760  -9.649
  131    HB2  MET  15           2HB      MET  15   4.739  -2.256 -11.134
  132    HB3  MET  15           1HB      MET  15   4.210  -3.766 -11.874
  133    HG2  MET  15           2HG      MET  15   2.556  -1.813 -10.286
  134    HG3  MET  15           1HG      MET  15   2.393  -2.231 -11.987
  135    HE1  MET  15           3HE      MET  15   1.346  -4.532 -12.849
  136    HE2  MET  15           1HE      MET  15   0.886  -5.854 -11.779
  137    HE3  MET  15           2HE      MET  15   2.585  -5.424 -11.963
  138    H    GLU  16           H        GLU  16   6.629  -2.619  -9.157
  139    HA   GLU  16           HA       GLU  16   8.504  -4.257 -10.577
  140    HB2  GLU  16           2HB      GLU  16   8.939  -2.012  -8.585
  141    HB3  GLU  16           1HB      GLU  16  10.204  -2.730  -9.575
  142    HG2  GLU  16           2HG      GLU  16   7.777  -1.232 -10.608
  143    HG3  GLU  16           1HG      GLU  16   9.415  -0.600 -10.492
  144    H    ASP  17           H        ASP  17   7.470  -4.104  -7.227
  145    HA   ASP  17           HA       ASP  17   9.570  -6.042  -6.426
  146    HB2  ASP  17           2HB      ASP  17   9.723  -3.881  -5.236
  147    HB3  ASP  17           1HB      ASP  17   8.047  -4.027  -4.723
  148    H    LEU  18           H        LEU  18   6.266  -5.097  -5.515
  149    HA   LEU  18           HA       LEU  18   5.717  -7.412  -3.999
  150    HB2  LEU  18           2HB      LEU  18   3.883  -5.298  -5.168
  151    HB3  LEU  18           1HB      LEU  18   3.297  -6.580  -4.139
  152    HG   LEU  18           HG       LEU  18   3.516  -4.526  -2.858
  153   HD11  LEU  18          1HD1      LEU  18   3.935  -6.600  -1.667
  154   HD12  LEU  18          2HD1      LEU  18   4.878  -5.275  -0.995
  155   HD13  LEU  18          3HD1      LEU  18   5.662  -6.475  -2.024
  156   HD21  LEU  18          3HD2      LEU  18   6.478  -4.482  -3.496
  157   HD22  LEU  18          1HD2      LEU  18   5.627  -3.399  -2.388
  158   HD23  LEU  18          2HD2      LEU  18   5.272  -3.356  -4.107
  159    H    ILE  19           H        ILE  19   4.942  -6.653  -7.429
  160    HA   ILE  19           HA       ILE  19   4.014  -9.393  -7.874
  161    HB   ILE  19           HB       ILE  19   4.361  -7.116  -9.872
  162   HG12  ILE  19          2HG1      ILE  19   1.841  -7.363 -10.136
  163   HG13  ILE  19          1HG1      ILE  19   1.864  -8.430  -8.751
  164   HG21  ILE  19          1HG2      ILE  19   3.336  -9.930 -10.397
  165   HG22  ILE  19          2HG2      ILE  19   4.848  -9.244 -10.995
  166   HG23  ILE  19          3HG2      ILE  19   3.309  -8.598 -11.562
  167   HD11  ILE  19          3HD1      ILE  19   2.621  -6.611  -7.349
  168   HD12  ILE  19          1HD1      ILE  19   1.120  -6.215  -8.184
  169   HD13  ILE  19          2HD1      ILE  19   2.646  -5.542  -8.752
  170    H    GLY  20           H        GLY  20   6.666  -7.268  -9.016
  171    HA2  GLY  20           2HA      GLY  20   8.978  -8.121  -8.884
  172    HA3  GLY  20           1HA      GLY  20   8.374  -9.674  -9.457
  173    HA   PRO  21           HA       PRO  21  10.036  -7.359 -13.164
  174    HB2  PRO  21           2HB      PRO  21  11.246  -9.496 -14.378
  175    HB3  PRO  21           1HB      PRO  21  12.010  -8.616 -13.042
  176    HG2  PRO  21           2HG      PRO  21  10.488 -11.199 -12.949
  177    HG3  PRO  21           1HG      PRO  21  12.038 -10.775 -12.186
  178    HD2  PRO  21           2HD      PRO  21   9.704 -10.728 -10.800
  179    HD3  PRO  21           1HD      PRO  21  11.031  -9.598 -10.454
  180    H    SER  22           H        SER  22   7.896 -10.045 -12.768
  181    HA   SER  22           HA       SER  22   6.906 -10.009 -15.543
  182    HB2  SER  22           2HB      SER  22   6.150 -11.731 -13.150
  183    HB3  SER  22           1HB      SER  22   5.560 -11.953 -14.797
  184    HG   SER  22           HG       SER  22   7.394 -13.297 -14.132
  185    H    ALA  23           H        ALA  23   6.569  -7.620 -14.209
  186    HA   ALA  23           HA       ALA  23   4.220  -7.321 -12.672
  187    HB1  ALA  23           3HB      ALA  23   6.071  -5.764 -12.534
  188    HB2  ALA  23           1HB      ALA  23   4.594  -4.914 -12.990
  189    HB3  ALA  23           2HB      ALA  23   5.821  -5.262 -14.211
  190    H    LYS  24           H        LYS  24   2.306  -7.916 -13.535
  191    HA   LYS  24           HA       LYS  24   1.534  -7.452 -16.256
  192    HB2  LYS  24           2HB      LYS  24  -0.072  -8.406 -13.874
  193    HB3  LYS  24           1HB      LYS  24  -0.683  -8.341 -15.526
  194    HG2  LYS  24           2HG      LYS  24   1.152  -9.926 -16.203
  195    HG3  LYS  24           1HG      LYS  24   1.599 -10.056 -14.497
  196    HD2  LYS  24           2HD      LYS  24   0.192 -11.935 -15.137
  197    HD3  LYS  24           1HD      LYS  24  -0.658 -10.909 -13.981
  198    HE2  LYS  24           2HE      LYS  24  -1.761  -9.810 -16.042
  199    HE3  LYS  24           1HE      LYS  24  -1.134 -11.178 -16.959
  200    HZ1  LYS  24           3HZ      LYS  24  -2.382 -12.659 -15.493
  201    HZ2  LYS  24           1HZ      LYS  24  -3.405 -11.549 -16.254
  202    HZ3  LYS  24           2HZ      LYS  24  -2.977 -11.328 -14.637
  203    H    GLU  25           H        GLU  25   1.909  -5.225 -16.326
  204    HA   GLU  25           HA       GLU  25   0.892  -3.109 -14.859
  205    HB2  GLU  25           2HB      GLU  25   1.322  -1.780 -16.947
  206    HB3  GLU  25           1HB      GLU  25   2.636  -2.872 -16.539
  207    HG2  GLU  25           2HG      GLU  25   1.749  -4.527 -18.193
  208    HG3  GLU  25           1HG      GLU  25   0.524  -3.346 -18.661
  209    H    ASP  26           H        ASP  26  -0.730  -5.126 -17.095
  210    HA   ASP  26           HA       ASP  26  -2.751  -3.519 -18.148
  211    HB2  ASP  26           2HB      ASP  26  -3.065  -6.488 -17.547
  212    HB3  ASP  26           1HB      ASP  26  -3.810  -5.569 -18.851
  213    H    GLU  27           H        GLU  27  -2.543  -5.507 -15.296
  214    HA   GLU  27           HA       GLU  27  -5.321  -5.072 -14.471
  215    HB2  GLU  27           2HB      GLU  27  -3.141  -6.774 -13.211
  216    HB3  GLU  27           1HB      GLU  27  -4.859  -6.833 -12.848
  217    HG2  GLU  27           2HG      GLU  27  -5.301  -7.601 -15.168
  218    HG3  GLU  27           1HG      GLU  27  -3.566  -7.596 -15.476
  219    H    LEU  28           H        LEU  28  -2.408  -3.491 -14.002
  220    HA   LEU  28           HA       LEU  28  -2.515  -2.879 -11.233
  221    HB2  LEU  28           2HB      LEU  28  -0.445  -2.767 -12.587
  222    HB3  LEU  28           1HB      LEU  28  -1.091  -1.419 -13.491
  223    HG   LEU  28           HG       LEU  28   0.658  -0.961 -11.614
  224   HD11  LEU  28          1HD1      LEU  28  -1.856   0.722 -11.623
  225   HD12  LEU  28          2HD1      LEU  28  -0.508   0.867 -12.750
  226   HD13  LEU  28          3HD1      LEU  28  -0.267   1.225 -11.042
  227   HD21  LEU  28          3HD2      LEU  28  -0.173  -0.634  -9.344
  228   HD22  LEU  28          1HD2      LEU  28  -0.416  -2.310  -9.826
  229   HD23  LEU  28          2HD2      LEU  28  -1.782  -1.188  -9.808
  230    H    ASP  29           H        ASP  29  -3.727  -1.472 -10.196
  231    HA   ASP  29           HA       ASP  29  -4.574   1.066 -11.187
  232    HB2  ASP  29           2HB      ASP  29  -6.261  -0.689 -12.195
  233    HB3  ASP  29           1HB      ASP  29  -6.868  -0.833 -10.552
  234    H    ASP  30           H        ASP  30  -5.996   2.136  -9.471
  235    HA   ASP  30           HA       ASP  30  -4.897   1.597  -6.849
  236    HB2  ASP  30           2HB      ASP  30  -6.199   3.672  -6.190
  237    HB3  ASP  30           1HB      ASP  30  -4.992   3.912  -7.440
  238    H    GLN  31           H        GLN  31  -8.013   1.422  -8.457
  239    HA   GLN  31           HA       GLN  31  -9.473   0.501  -6.128
  240    HB2  GLN  31           2HB      GLN  31 -10.314   0.570  -9.061
  241    HB3  GLN  31           1HB      GLN  31 -11.392   0.344  -7.684
  242    HG2  GLN  31           2HG      GLN  31 -10.812   2.614  -6.882
  243    HG3  GLN  31           1HG      GLN  31  -9.777   2.837  -8.294
  244   HE21  GLN  31          1HE2      GLN  31 -12.065   4.407  -7.454
  245   HE22  GLN  31          2HE2      GLN  31 -13.206   4.367  -8.753
  246    H    THR  32           H        THR  32  -7.422  -1.029  -8.430
  247    HA   THR  32           HA       THR  32  -8.605  -3.630  -8.440
  248    HB   THR  32           HB       THR  32  -5.724  -2.802  -8.886
  249    HG1  THR  32           HG1      THR  32  -6.330  -3.341 -11.075
  250   HG21  THR  32          3HG2      THR  32  -5.709  -5.134  -8.099
  251   HG22  THR  32          1HG2      THR  32  -5.382  -5.085  -9.835
  252   HG23  THR  32          2HG2      THR  32  -6.981  -5.554  -9.249
  253    HA   PRO  33           HA       PRO  33  -7.632  -4.398  -4.088
  254    HB2  PRO  33           2HB      PRO  33  -8.963  -6.739  -3.816
  255    HB3  PRO  33           1HB      PRO  33  -9.814  -5.194  -4.007
  256    HG2  PRO  33           2HG      PRO  33  -9.241  -7.278  -6.082
  257    HG3  PRO  33           1HG      PRO  33 -10.753  -6.405  -5.754
  258    HD2  PRO  33           2HD      PRO  33  -9.026  -5.674  -7.734
  259    HD3  PRO  33           1HD      PRO  33 -10.066  -4.511  -6.881
  260    H    LEU  34           H        LEU  34  -5.583  -4.779  -3.785
  261    HA   LEU  34           HA       LEU  34  -3.935  -6.621  -5.163
  262    HB2  LEU  34           2HB      LEU  34  -3.354  -5.157  -2.568
  263    HB3  LEU  34           1HB      LEU  34  -2.176  -5.792  -3.705
  264    HG   LEU  34           HG       LEU  34  -4.097  -3.518  -4.348
  265   HD11  LEU  34          1HD1      LEU  34  -1.181  -3.341  -3.556
  266   HD12  LEU  34          2HD1      LEU  34  -2.561  -2.803  -2.593
  267   HD13  LEU  34          3HD1      LEU  34  -2.189  -2.003  -4.118
  268   HD21  LEU  34          3HD2      LEU  34  -2.598  -3.116  -6.292
  269   HD22  LEU  34          1HD2      LEU  34  -3.375  -4.697  -6.366
  270   HD23  LEU  34          2HD2      LEU  34  -1.684  -4.568  -5.874
  271    H    LEU  35           H        LEU  35  -4.959  -6.513  -1.717
  272    HA   LEU  35           HA       LEU  35  -3.923  -8.948  -0.857
  273    HB2  LEU  35           2HB      LEU  35  -5.649  -6.902   0.189
  274    HB3  LEU  35           1HB      LEU  35  -6.421  -8.431   0.527
  275    HG   LEU  35           HG       LEU  35  -5.046  -7.677   2.404
  276   HD11  LEU  35          1HD1      LEU  35  -5.296 -10.096   2.119
  277   HD12  LEU  35          2HD1      LEU  35  -3.735  -9.689   2.822
  278   HD13  LEU  35          3HD1      LEU  35  -3.839 -10.142   1.118
  279   HD21  LEU  35          3HD2      LEU  35  -2.630  -7.513   2.288
  280   HD22  LEU  35          1HD2      LEU  35  -3.375  -6.384   1.162
  281   HD23  LEU  35          2HD2      LEU  35  -2.660  -7.881   0.564
  282    H    GLU  36           H        GLU  36  -6.989  -8.205  -2.379
  283    HA   GLU  36           HA       GLU  36  -8.228 -10.732  -1.981
  284    HB2  GLU  36           2HB      GLU  36  -9.348  -8.457  -2.455
  285    HB3  GLU  36           1HB      GLU  36  -8.925  -8.725  -4.139
  286    HG2  GLU  36           2HG      GLU  36 -11.206  -9.363  -3.852
  287    HG3  GLU  36           1HG      GLU  36 -10.274 -10.840  -4.087
  288    H    TRP  37           H        TRP  37  -6.116  -9.387  -4.475
  289    HA   TRP  37           HA       TRP  37  -6.561 -11.709  -6.278
  290    HB2  TRP  37           2HB      TRP  37  -5.114  -9.063  -6.671
  291    HB3  TRP  37           1HB      TRP  37  -5.043 -10.362  -7.850
  292    HD1  TRP  37           HD1      TRP  37  -8.457  -9.741  -6.250
  293    HE1  TRP  37           HE1      TRP  37 -10.001  -8.628  -7.972
  294    HE3  TRP  37           HE3      TRP  37  -5.025  -8.777  -9.919
  295    HZ2  TRP  37           HZ2      TRP  37  -9.806  -7.494 -10.545
  296    HZ3  TRP  37           HZ3      TRP  37  -5.796  -7.680 -11.980
  297    HH2  TRP  37           HH2      TRP  37  -8.132  -7.049 -12.290
  298    H    GLY  38           H        GLY  38  -4.879 -11.399  -3.609
  299    HA2  GLY  38           2HA      GLY  38  -3.107 -12.521  -2.709
  300    HA3  GLY  38           1HA      GLY  38  -3.056 -13.482  -4.174
  301    H    ILE  39           H        ILE  39  -2.706 -10.074  -4.501
  302    HA   ILE  39           HA       ILE  39  -0.091 -10.204  -5.658
  303    HB   ILE  39           HB       ILE  39  -1.896  -7.878  -4.846
  304   HG12  ILE  39          2HG1      ILE  39  -1.289  -9.057  -7.595
  305   HG13  ILE  39          1HG1      ILE  39  -2.786  -9.266  -6.701
  306   HG21  ILE  39          1HG2      ILE  39  -0.455  -6.366  -6.152
  307   HG22  ILE  39          2HG2      ILE  39   0.685  -7.687  -6.412
  308   HG23  ILE  39          3HG2      ILE  39   0.406  -7.074  -4.783
  309   HD11  ILE  39          3HD1      ILE  39  -3.204  -6.833  -6.923
  310   HD12  ILE  39          1HD1      ILE  39  -3.089  -7.673  -8.471
  311   HD13  ILE  39          2HD1      ILE  39  -1.735  -6.704  -7.894
  312    H    LEU  40           H        LEU  40  -1.470  -9.254  -2.580
  313    HA   LEU  40           HA       LEU  40   1.215  -8.989  -1.373
  314    HB2  LEU  40           2HB      LEU  40  -1.385  -7.906  -0.265
  315    HB3  LEU  40           1HB      LEU  40   0.243  -7.531   0.271
  316    HG   LEU  40           HG       LEU  40  -1.008  -6.670  -2.359
  317   HD11  LEU  40          1HD1      LEU  40  -0.917  -4.384  -1.396
  318   HD12  LEU  40          2HD1      LEU  40  -0.447  -5.078   0.159
  319   HD13  LEU  40          3HD1      LEU  40  -2.026  -5.460  -0.547
  320   HD21  LEU  40          3HD2      LEU  40   1.712  -6.040  -1.196
  321   HD22  LEU  40          1HD2      LEU  40   1.005  -5.272  -2.624
  322   HD23  LEU  40          2HD2      LEU  40   1.364  -6.995  -2.645
  323    H    ASN  41           H        ASN  41   1.733 -10.744  -0.165
  324    HA   ASN  41           HA       ASN  41  -0.186 -11.790   1.777
  325    HB2  ASN  41           2HB      ASN  41  -0.527 -13.284  -0.170
  326    HB3  ASN  41           1HB      ASN  41   1.191 -13.632  -0.234
  327   HD21  ASN  41          1HD2      ASN  41  -1.787 -14.148   1.523
  328   HD22  ASN  41          2HD2      ASN  41  -1.243 -15.491   2.460
  329    H    SER  42           H        SER  42   1.239 -10.596   3.140
  330    HA   SER  42           HA       SER  42   2.594 -10.586   4.903
  331    HB2  SER  42           3HB      SER  42   1.679 -12.889   5.166
  332    HB3  SER  42           2HB      SER  42   3.115 -13.519   4.371
  333    H    MET  43           H        MET  43   4.494 -12.824   2.834
  334    HA   MET  43           HA       MET  43   7.006 -12.026   3.680
  335    HB2  MET  43           2HB      MET  43   6.287 -13.103   0.926
  336    HB3  MET  43           1HB      MET  43   7.882 -13.146   1.670
  337    HG2  MET  43           2HG      MET  43   5.424 -14.662   2.572
  338    HG3  MET  43           1HG      MET  43   6.863 -15.325   1.808
  339    HE1  MET  43           3HE      MET  43   5.093 -15.032   5.110
  340    HE2  MET  43           1HE      MET  43   5.600 -13.342   5.028
  341    HE3  MET  43           2HE      MET  43   6.287 -14.422   6.251
  342    H    ASN  44           H        ASN  44   5.089 -10.732   1.059
  343    HA   ASN  44           HA       ASN  44   7.147  -8.754   0.358
  344    HB2  ASN  44           2HB      ASN  44   5.665  -8.248  -1.577
  345    HB3  ASN  44           1HB      ASN  44   6.208  -9.913  -1.528
  346   HD21  ASN  44          1HD2      ASN  44   4.477 -10.400  -2.986
  347   HD22  ASN  44          2HD2      ASN  44   2.853 -10.569  -2.426
  348    H    ILE  45           H        ILE  45   4.255  -9.010   2.193
  349    HA   ILE  45           HA       ILE  45   3.126  -6.445   1.807
  350    HB   ILE  45           HB       ILE  45   2.336  -8.796   3.067
  351   HG12  ILE  45          2HG1      ILE  45   0.883  -6.155   3.414
  352   HG13  ILE  45          1HG1      ILE  45   0.897  -7.068   1.908
  353   HG21  ILE  45          1HG2      ILE  45   1.714  -8.336   5.387
  354   HG22  ILE  45          2HG2      ILE  45   2.485  -6.751   5.301
  355   HG23  ILE  45          3HG2      ILE  45   3.468  -8.213   5.195
  356   HD11  ILE  45          3HD1      ILE  45  -0.149  -8.963   3.080
  357   HD12  ILE  45          1HD1      ILE  45  -1.131  -7.495   3.124
  358   HD13  ILE  45          2HD1      ILE  45  -0.217  -7.988   4.553
  359    H    VAL  46           H        VAL  46   5.717  -7.532   3.832
  360    HA   VAL  46           HA       VAL  46   5.754  -5.468   5.775
  361    HB   VAL  46           HB       VAL  46   8.102  -7.123   4.762
  362   HG11  VAL  46          1HG1      VAL  46   8.825  -5.190   6.104
  363   HG12  VAL  46          2HG1      VAL  46   9.101  -6.695   6.983
  364   HG13  VAL  46          3HG1      VAL  46   7.726  -5.670   7.403
  365   HG21  VAL  46          3HG2      VAL  46   7.614  -8.680   6.612
  366   HG22  VAL  46          1HG2      VAL  46   6.249  -8.580   5.498
  367   HG23  VAL  46          2HG2      VAL  46   6.187  -7.734   7.046
  368    H    LYS  47           H        LYS  47   6.747  -5.594   2.462
  369    HA   LYS  47           HA       LYS  47   8.562  -3.429   2.391
  370    HB2  LYS  47           2HB      LYS  47   6.876  -4.729   0.248
  371    HB3  LYS  47           1HB      LYS  47   7.829  -3.291  -0.104
  372    HG2  LYS  47           2HG      LYS  47   9.115  -5.164  -0.793
  373    HG3  LYS  47           1HG      LYS  47   9.867  -4.516   0.662
  374    HD2  LYS  47           2HD      LYS  47   9.082  -6.324   2.000
  375    HD3  LYS  47           1HD      LYS  47   7.966  -6.874   0.747
  376    HE2  LYS  47           2HE      LYS  47  10.992  -6.962   0.639
  377    HE3  LYS  47           1HE      LYS  47   9.904  -8.340   0.825
  378    HZ1  LYS  47           3HZ      LYS  47   8.970  -7.788  -1.369
  379    HZ2  LYS  47           1HZ      LYS  47  10.609  -8.189  -1.445
  380    HZ3  LYS  47           2HZ      LYS  47  10.123  -6.573  -1.555
  381    H    LEU  48           H        LEU  48   5.018  -3.568   2.203
  382    HA   LEU  48           HA       LEU  48   4.580  -0.836   1.533
  383    HB2  LEU  48           2HB      LEU  48   2.809  -2.785   3.064
  384    HB3  LEU  48           1HB      LEU  48   2.311  -1.146   2.695
  385    HG   LEU  48           HG       LEU  48   1.269  -2.625   1.107
  386   HD11  LEU  48          1HD1      LEU  48   1.939  -0.453   0.186
  387   HD12  LEU  48          2HD1      LEU  48   2.017  -1.702  -1.052
  388   HD13  LEU  48          3HD1      LEU  48   3.503  -1.115  -0.304
  389   HD21  LEU  48          3HD2      LEU  48   2.775  -4.554   1.239
  390   HD22  LEU  48          1HD2      LEU  48   4.016  -3.668   0.346
  391   HD23  LEU  48          2HD2      LEU  48   2.490  -4.089  -0.436
  392    H    MET  49           H        MET  49   5.099  -2.501   4.590
  393    HA   MET  49           HA       MET  49   4.428  -0.419   6.392
  394    HB2  MET  49           2HB      MET  49   6.500  -2.598   6.902
  395    HB3  MET  49           1HB      MET  49   5.585  -1.704   8.106
  396    HG2  MET  49           2HG      MET  49   3.539  -2.837   7.450
  397    HG3  MET  49           1HG      MET  49   4.394  -3.673   6.145
  398    HE1  MET  49           3HE      MET  49   3.915  -6.699   8.573
  399    HE2  MET  49           1HE      MET  49   3.980  -6.223   6.875
  400    HE3  MET  49           2HE      MET  49   2.785  -5.499   7.952
  401    H    VAL  50           H        VAL  50   7.595  -1.546   5.187
  402    HA   VAL  50           HA       VAL  50   9.096   0.515   6.501
  403    HB   VAL  50           HB       VAL  50  10.038  -1.747   6.049
  404   HG11  VAL  50          1HG1      VAL  50   9.144  -2.171   3.806
  405   HG12  VAL  50          2HG1      VAL  50  10.900  -2.329   3.802
  406   HG13  VAL  50          3HG1      VAL  50  10.149  -0.877   3.134
  407   HG21  VAL  50          3HG2      VAL  50  11.592   0.100   6.531
  408   HG22  VAL  50          1HG2      VAL  50  11.668   0.500   4.811
  409   HG23  VAL  50          2HG2      VAL  50  12.313  -1.036   5.390
  410    H    TYR  51           H        TYR  51   7.648   0.226   3.320
  411    HA   TYR  51           HA       TYR  51   9.223   2.123   1.901
  412    HB2  TYR  51           2HB      TYR  51   7.511   0.504   0.856
  413    HB3  TYR  51           1HB      TYR  51   6.262   1.603   1.397
  414    HD1  TYR  51           HD1      TYR  51   9.090   1.187  -0.958
  415    HD2  TYR  51           HD2      TYR  51   5.915   3.780   0.263
  416    HE1  TYR  51           HE1      TYR  51   9.358   2.500  -3.018
  417    HE2  TYR  51           HE2      TYR  51   6.189   5.078  -1.794
  418    HH   TYR  51           HH       TYR  51   7.981   5.531  -3.472
  419    H    ILE  52           H        ILE  52   6.083   2.361   3.447
  420    HA   ILE  52           HA       ILE  52   5.689   5.162   3.069
  421    HB   ILE  52           HB       ILE  52   4.310   3.150   4.894
  422   HG12  ILE  52          2HG1      ILE  52   3.380   4.188   2.181
  423   HG13  ILE  52          1HG1      ILE  52   4.304   2.702   2.361
  424   HG21  ILE  52          1HG2      ILE  52   3.909   5.470   5.634
  425   HG22  ILE  52          2HG2      ILE  52   2.441   4.719   5.012
  426   HG23  ILE  52          3HG2      ILE  52   3.327   5.877   4.021
  427   HD11  ILE  52          3HD1      ILE  52   2.519   1.737   3.685
  428   HD12  ILE  52          1HD1      ILE  52   1.942   2.272   2.107
  429   HD13  ILE  52          2HD1      ILE  52   1.585   3.233   3.544
  430    H    ARG  53           H        ARG  53   6.948   3.180   5.677
  431    HA   ARG  53           HA       ARG  53   7.305   5.088   7.699
  432    HB2  ARG  53           2HB      ARG  53   7.620   2.626   7.960
  433    HB3  ARG  53           1HB      ARG  53   9.093   2.732   7.003
  434    HG2  ARG  53           2HG      ARG  53  10.134   4.142   8.731
  435    HG3  ARG  53           1HG      ARG  53   8.649   4.082   9.685
  436    HD2  ARG  53           2HD      ARG  53   8.906   1.584   9.812
  437    HD3  ARG  53           1HD      ARG  53  10.470   1.752   9.003
  438    HE   ARG  53           HE       ARG  53  11.092   3.225  10.944
  439   HH11  ARG  53          1HH1      ARG  53   8.733   0.656  11.336
  440   HH12  ARG  53          2HH1      ARG  53   9.042   0.474  13.030
  441   HH21  ARG  53          1HH2      ARG  53  11.471   3.015  13.155
  442   HH22  ARG  53          2HH2      ARG  53  10.606   1.821  14.066
  443    H    ASP  54           H        ASP  54   9.326   4.259   4.915
  444    HA   ASP  54           HA       ASP  54  11.448   6.142   5.517
  445    HB2  ASP  54           2HB      ASP  54  11.871   3.998   4.301
  446    HB3  ASP  54           1HB      ASP  54  10.876   4.564   2.967
  447    H    GLU  55           H        GLU  55   8.559   6.078   3.548
  448    HA   GLU  55           HA       GLU  55   9.246   8.389   1.935
  449    HB2  GLU  55           2HB      GLU  55   8.102   6.578   0.830
  450    HB3  GLU  55           1HB      GLU  55   6.840   6.545   2.054
  451    HG2  GLU  55           2HG      GLU  55   6.036   7.490  -0.048
  452    HG3  GLU  55           1HG      GLU  55   5.954   8.659   1.263
  453    H    MET  56           H        MET  56   6.301   7.691   3.814
  454    HA   MET  56           HA       MET  56   5.908  10.572   4.264
  455    HB2  MET  56           2HB      MET  56   4.088   8.150   4.288
  456    HB3  MET  56           1HB      MET  56   3.565   9.666   5.006
  457    HG2  MET  56           2HG      MET  56   3.580  10.794   2.948
  458    HG3  MET  56           1HG      MET  56   4.570   9.566   2.162
  459    HE1  MET  56           3HE      MET  56   3.405   6.843   2.609
  460    HE2  MET  56           1HE      MET  56   3.636   7.454   0.969
  461    HE3  MET  56           2HE      MET  56   2.107   6.696   1.423
  462    H    GLY  57           H        GLY  57   7.550   8.328   5.864
  463    HA2  GLY  57           2HA      GLY  57   8.469   8.332   7.955
  464    HA3  GLY  57           1HA      GLY  57   7.662   9.861   8.255
  465    H    VAL  58           H        VAL  58   5.740   7.083   7.411
  466    HA   VAL  58           HA       VAL  58   4.966   6.660  10.239
  467    HB   VAL  58           HB       VAL  58   3.311   8.252   9.415
  468   HG11  VAL  58          1HG1      VAL  58   2.772   6.374   7.092
  469   HG12  VAL  58          2HG1      VAL  58   3.550   7.955   6.979
  470   HG13  VAL  58          3HG1      VAL  58   1.855   7.834   7.462
  471   HG21  VAL  58          3HG2      VAL  58   2.092   5.480   9.470
  472   HG22  VAL  58          1HG2      VAL  58   1.226   6.994   9.751
  473   HG23  VAL  58          2HG2      VAL  58   2.476   6.464  10.882
  474    H    SER  59           H        SER  59   5.017   4.550  10.698
  475    HA   SER  59           HA       SER  59   4.794   2.539   8.559
  476    HB2  SER  59           2HB      SER  59   6.854   2.511  10.008
  477    HB3  SER  59           1HB      SER  59   5.831   2.216  11.410
  478    HG   SER  59           HG       SER  59   5.255   0.249  10.573
  479    H    ILE  60           H        ILE  60   3.011   1.317   8.476
  480    HA   ILE  60           HA       ILE  60   0.786   1.615  10.204
  481    HB   ILE  60           HB       ILE  60   1.366  -0.566   8.151
  482   HG12  ILE  60          2HG1      ILE  60  -0.167   2.053   8.050
  483   HG13  ILE  60          1HG1      ILE  60   1.122   1.510   6.987
  484   HG21  ILE  60          1HG2      ILE  60  -1.253  -0.019   9.608
  485   HG22  ILE  60          2HG2      ILE  60  -0.208  -1.416   9.864
  486   HG23  ILE  60          3HG2      ILE  60  -1.017  -1.201   8.316
  487   HD11  ILE  60          3HD1      ILE  60  -1.040   1.531   5.889
  488   HD12  ILE  60          1HD1      ILE  60  -1.678   0.405   7.090
  489   HD13  ILE  60          2HD1      ILE  60  -0.391  -0.108   5.984
  490    HA   PRO  61           HA       PRO  61   2.488  -0.976  13.523
  491    HB2  PRO  61           2HB      PRO  61   0.220  -0.947  15.138
  492    HB3  PRO  61           1HB      PRO  61   1.386   0.389  15.065
  493    HG2  PRO  61           2HG      PRO  61  -1.238   0.105  13.647
  494    HG3  PRO  61           1HG      PRO  61  -0.552   1.521  14.478
  495    HD2  PRO  61           2HD      PRO  61  -0.474   1.297  11.798
  496    HD3  PRO  61           1HD      PRO  61   0.861   2.050  12.700
  497    H    SER  62           H        SER  62   2.043  -3.048  14.519
  498    HA   SER  62           HA       SER  62   1.232  -5.000  12.656
  499    HB2  SER  62           2HB      SER  62   1.647  -6.592  14.609
  500    HB3  SER  62           1HB      SER  62   2.984  -5.514  14.215
  501    HG   SER  62           HG       SER  62   1.519  -5.705  16.506
  502    H    THR  63           H        THR  63  -0.544  -3.350  15.154
  503    HA   THR  63           HA       THR  63  -2.780  -5.114  15.344
  504    HB   THR  63           HB       THR  63  -2.296  -3.519  17.127
  505    HG1  THR  63           HG1      THR  63  -4.379  -3.906  17.279
  506   HG21  THR  63          3HG2      THR  63  -3.001  -1.309  15.166
  507   HG22  THR  63          1HG2      THR  63  -1.387  -1.656  15.789
  508   HG23  THR  63          2HG2      THR  63  -2.654  -1.099  16.885
  509    H    HIS  64           H        HIS  64  -1.931  -2.508  13.154
  510    HA   HIS  64           HA       HIS  64  -4.565  -2.450  11.841
  511    HB2  HIS  64           2HB      HIS  64  -2.137  -0.678  11.756
  512    HB3  HIS  64           1HB      HIS  64  -3.228  -0.671  10.377
  513    HD1  HIS  64           HD1      HIS  64  -5.119  -1.114  13.490
  514    HD2  HIS  64           HD2      HIS  64  -3.583   2.058  11.274
  515    HE1  HIS  64           HE1      HIS  64  -6.354   0.922  14.273
  516    HE2  HIS  64           HE2      HIS  64  -5.273   2.845  13.051
  517    H    ILE  65           H        ILE  65  -1.893  -4.395  11.602
  518    HA   ILE  65           HA       ILE  65  -1.876  -4.699   8.737
  519    HB   ILE  65           HB       ILE  65  -0.844  -6.650  10.832
  520   HG12  ILE  65          2HG1      ILE  65   0.367  -4.536  11.028
  521   HG13  ILE  65          1HG1      ILE  65   1.418  -5.716  10.258
  522   HG21  ILE  65          1HG2      ILE  65  -1.314  -7.716   8.647
  523   HG22  ILE  65          2HG2      ILE  65   0.414  -7.667   8.971
  524   HG23  ILE  65          3HG2      ILE  65  -0.299  -6.519   7.839
  525   HD11  ILE  65          3HD1      ILE  65   1.630  -3.524   9.245
  526   HD12  ILE  65          1HD1      ILE  65  -0.092  -3.511   8.861
  527   HD13  ILE  65          2HD1      ILE  65   0.976  -4.683   8.083
  528    H    THR  66           H        THR  66  -3.925  -5.008   8.086
  529    HA   THR  66           HA       THR  66  -4.921  -7.697   8.329
  530    HB   THR  66           HB       THR  66  -6.230  -6.852  10.120
  531    HG1  THR  66           HG1      THR  66  -8.068  -7.528   9.303
  532   HG21  THR  66          3HG2      THR  66  -7.544  -4.761  10.036
  533   HG22  THR  66          1HG2      THR  66  -6.903  -4.414   8.432
  534   HG23  THR  66          2HG2      THR  66  -5.819  -4.434   9.828
  535    H    GLY  67           H        GLY  67  -6.212  -8.308   6.629
  536    HA2  GLY  67           2HA      GLY  67  -5.549  -7.273   4.133
  537    HA3  GLY  67           1HA      GLY  67  -6.817  -8.440   4.454
  538    H    LYS  68           H        LYS  68  -8.193  -6.353   6.243
  539    HA   LYS  68           HA       LYS  68  -9.826  -5.228   4.148
  540    HB2  LYS  68           2HB      LYS  68 -11.246  -4.356   5.975
  541    HB3  LYS  68           1HB      LYS  68 -10.928  -6.076   6.109
  542    HG2  LYS  68           2HG      LYS  68 -10.742  -5.383   8.323
  543    HG3  LYS  68           1HG      LYS  68  -9.062  -5.376   7.796
  544    HD2  LYS  68           2HD      LYS  68  -9.540  -3.384   9.150
  545    HD3  LYS  68           1HD      LYS  68  -9.167  -2.917   7.490
  546    HE2  LYS  68           2HE      LYS  68 -11.059  -1.625   8.366
  547    HE3  LYS  68           1HE      LYS  68 -11.567  -2.650   7.024
  548    HZ1  LYS  68           3HZ      LYS  68 -13.154  -2.718   8.813
  549    HZ2  LYS  68           1HZ      LYS  68 -11.976  -3.239   9.908
  550    HZ3  LYS  68           2HZ      LYS  68 -12.440  -4.235   8.626
  551    H    TYR  69           H        TYR  69  -7.225  -4.020   6.127
  552    HA   TYR  69           HA       TYR  69  -7.633  -1.267   5.233
  553    HB2  TYR  69           2HB      TYR  69  -5.633  -2.564   7.095
  554    HB3  TYR  69           1HB      TYR  69  -5.348  -0.943   6.469
  555    HD1  TYR  69           HD2      TYR  69  -8.255   0.060   6.548
  556    HD2  TYR  69           HD1      TYR  69  -5.904  -2.033   9.437
  557    HE1  TYR  69           HE2      TYR  69  -9.579   1.066   8.345
  558    HE2  TYR  69           HE1      TYR  69  -7.229  -1.016  11.242
  559    HH   TYR  69           HH       TYR  69  -8.690   0.899  11.638
  560    H    PHE  70           H        PHE  70  -5.873  -4.086   4.353
  561    HA   PHE  70           HA       PHE  70  -4.062  -2.620   2.539
  562    HB2  PHE  70           2HB      PHE  70  -3.921  -5.345   3.855
  563    HB3  PHE  70           1HB      PHE  70  -2.922  -4.983   2.458
  564    HD1  PHE  70           HD2      PHE  70  -3.629  -3.919   5.975
  565    HD2  PHE  70           HD1      PHE  70  -0.882  -3.770   2.701
  566    HE1  PHE  70           HE2      PHE  70  -1.918  -2.940   7.443
  567    HE2  PHE  70           HE1      PHE  70   0.820  -2.793   4.182
  568    HZ   PHE  70           HZ       PHE  70   0.307  -2.381   6.551
  569    H    LYS  71           H        LYS  71  -7.045  -3.539   2.126
  570    HA   LYS  71           HA       LYS  71  -7.288  -5.626   0.322
  571    HB2  LYS  71           2HB      LYS  71  -8.868  -3.027   0.255
  572    HB3  LYS  71           1HB      LYS  71  -9.323  -4.505  -0.587
  573    HG2  LYS  71           2HG      LYS  71  -9.587  -5.658   1.552
  574    HG3  LYS  71           1HG      LYS  71  -9.079  -4.203   2.404
  575    HD2  LYS  71           2HD      LYS  71 -11.591  -4.489   0.717
  576    HD3  LYS  71           1HD      LYS  71 -11.521  -4.493   2.476
  577    HE2  LYS  71           2HE      LYS  71 -12.174  -2.302   2.032
  578    HE3  LYS  71           1HE      LYS  71 -10.427  -2.122   2.176
  579    HZ1  LYS  71           3HZ      LYS  71 -10.349  -2.321  -0.301
  580    HZ2  LYS  71           1HZ      LYS  71 -11.122  -0.941   0.276
  581    HZ3  LYS  71           2HZ      LYS  71 -12.031  -2.234  -0.312
  582    H    ASP  72           H        ASP  72  -6.624  -2.237  -0.424
  583    HA   ASP  72           HA       ASP  72  -5.420  -2.797  -3.003
  584    HB2  ASP  72           2HB      ASP  72  -7.013  -1.344  -4.267
  585    HB3  ASP  72           1HB      ASP  72  -7.771  -2.804  -3.663
  586    H    LEU  73           H        LEU  73  -5.220  -0.300  -4.070
  587    HA   LEU  73           HA       LEU  73  -3.406   1.003  -2.294
  588    HB2  LEU  73           2HB      LEU  73  -3.098   1.218  -4.731
  589    HB3  LEU  73           1HB      LEU  73  -4.618   2.089  -4.854
  590    HG   LEU  73           HG       LEU  73  -3.591   3.869  -3.303
  591   HD11  LEU  73          1HD1      LEU  73  -1.766   2.588  -2.357
  592   HD12  LEU  73          2HD1      LEU  73  -1.122   3.986  -3.214
  593   HD13  LEU  73          3HD1      LEU  73  -1.030   2.385  -3.951
  594   HD21  LEU  73          3HD2      LEU  73  -2.344   5.005  -5.102
  595   HD22  LEU  73          1HD2      LEU  73  -3.865   4.331  -5.678
  596   HD23  LEU  73          2HD2      LEU  73  -2.345   3.514  -6.042
  597    H    ASN  74           H        ASN  74  -6.770   1.662  -3.221
  598    HA   ASN  74           HA       ASN  74  -6.921   4.190  -1.845
  599    HB2  ASN  74           2HB      ASN  74  -9.145   2.381  -2.856
  600    HB3  ASN  74           1HB      ASN  74  -9.374   4.024  -2.261
  601   HD21  ASN  74          1HD2      ASN  74  -9.955   2.858  -4.855
  602   HD22  ASN  74          2HD2      ASN  74  -9.115   3.827  -6.012
  603    H    ALA  75           H        ALA  75  -7.574   0.828  -0.943
  604    HA   ALA  75           HA       ALA  75  -8.789   1.366   1.583
  605    HB1  ALA  75           3HB      ALA  75  -8.831  -0.871   0.561
  606    HB2  ALA  75           1HB      ALA  75  -8.142  -0.930   2.184
  607    HB3  ALA  75           2HB      ALA  75  -7.084  -1.011   0.769
  608    H    ILE  76           H        ILE  76  -5.422   0.730   0.667
  609    HA   ILE  76           HA       ILE  76  -4.169   1.297   3.143
  610    HB   ILE  76           HB       ILE  76  -3.095   1.404   0.293
  611   HG12  ILE  76          2HG1      ILE  76  -2.720  -0.680   2.486
  612   HG13  ILE  76          1HG1      ILE  76  -3.828  -0.850   1.129
  613   HG21  ILE  76          1HG2      ILE  76  -1.699   2.870   1.716
  614   HG22  ILE  76          2HG2      ILE  76  -0.807   1.428   1.232
  615   HG23  ILE  76          3HG2      ILE  76  -1.470   1.547   2.863
  616   HD11  ILE  76          3HD1      ILE  76  -1.879  -0.822  -0.400
  617   HD12  ILE  76          1HD1      ILE  76  -1.860  -2.155   0.758
  618   HD13  ILE  76          2HD1      ILE  76  -0.820  -0.754   1.014
  619    H    SER  77           H        SER  77  -5.340   3.361   0.564
  620    HA   SER  77           HA       SER  77  -3.990   5.763   1.181
  621    HB2  SER  77           2HB      SER  77  -5.242   5.557  -0.922
  622    HB3  SER  77           1HB      SER  77  -6.749   5.336  -0.045
  623    HG   SER  77           HG       SER  77  -6.347   7.501   0.799
  624    H    ARG  78           H        ARG  78  -7.132   4.490   2.268
  625    HA   ARG  78           HA       ARG  78  -7.785   6.774   3.868
  626    HB2  ARG  78           2HB      ARG  78  -8.885   3.953   4.169
  627    HB3  ARG  78           1HB      ARG  78  -9.637   5.448   4.730
  628    HG2  ARG  78           2HG      ARG  78  -9.306   4.468   1.895
  629    HG3  ARG  78           1HG      ARG  78 -10.796   4.835   2.756
  630    HD2  ARG  78           2HD      ARG  78  -8.710   6.899   1.932
  631    HD3  ARG  78           1HD      ARG  78 -10.187   6.537   1.030
  632    HE   ARG  78           HE       ARG  78 -11.051   7.185   3.563
  633   HH11  ARG  78          1HH1      ARG  78  -9.193   8.796   1.070
  634   HH12  ARG  78          2HH1      ARG  78  -9.711  10.384   1.519
  635   HH21  ARG  78          1HH2      ARG  78 -11.746   9.291   4.160
  636   HH22  ARG  78          2HH2      ARG  78 -11.164  10.667   3.280
  637    H    THR  79           H        THR  79  -6.159   3.748   4.467
  638    HA   THR  79           HA       THR  79  -6.010   3.963   7.296
  639    HB   THR  79           HB       THR  79  -4.183   2.336   5.489
  640    HG1  THR  79           HG1      THR  79  -5.943   1.289   4.982
  641   HG21  THR  79          3HG2      THR  79  -5.080   1.894   8.370
  642   HG22  THR  79          1HG2      THR  79  -3.464   2.409   7.870
  643   HG23  THR  79          2HG2      THR  79  -4.057   0.802   7.437
  644    H    VAL  80           H        VAL  80  -3.840   4.913   4.663
  645    HA   VAL  80           HA       VAL  80  -1.617   5.388   6.442
  646    HB   VAL  80           HB       VAL  80  -1.334   4.536   4.068
  647   HG11  VAL  80          1HG1      VAL  80  -2.912   6.017   2.891
  648   HG12  VAL  80          2HG1      VAL  80  -1.296   6.110   2.194
  649   HG13  VAL  80          3HG1      VAL  80  -1.874   7.409   3.237
  650   HG21  VAL  80          3HG2      VAL  80   0.722   5.794   3.628
  651   HG22  VAL  80          1HG2      VAL  80   0.550   5.417   5.343
  652   HG23  VAL  80          2HG2      VAL  80   0.207   7.048   4.762
  653    H    GLU  81           H        GLU  81  -4.116   7.306   4.865
  654    HA   GLU  81           HA       GLU  81  -2.852   9.858   5.457
  655    HB2  GLU  81           2HB      GLU  81  -5.675   9.288   4.444
  656    HB3  GLU  81           1HB      GLU  81  -4.909  10.873   4.509
  657    HG2  GLU  81           2HG      GLU  81  -3.210  10.129   2.891
  658    HG3  GLU  81           1HG      GLU  81  -3.960   8.532   2.834
  659    H    GLN  82           H        GLN  82  -5.364   7.778   6.865
  660    HA   GLN  82           HA       GLN  82  -6.207   9.646   8.845
  661    HB2  GLN  82           2HB      GLN  82  -7.432   7.921   9.880
  662    HB3  GLN  82           1HB      GLN  82  -7.446   7.494   8.180
  663    HG2  GLN  82           2HG      GLN  82  -5.770   5.758   8.562
  664    HG3  GLN  82           1HG      GLN  82  -5.611   6.245  10.247
  665   HE21  GLN  82          1HE2      GLN  82  -7.297   5.766  11.696
  666   HE22  GLN  82          2HE2      GLN  82  -8.459   4.536  11.356
  667    H    LEU  83           H        LEU  83  -3.648   7.182   8.741
  668    HA   LEU  83           HA       LEU  83  -2.812   7.401  11.443
  669    HB2  LEU  83           2HB      LEU  83  -1.353   6.445   8.968
  670    HB3  LEU  83           1HB      LEU  83  -0.620   6.407  10.565
  671    HG   LEU  83           HG       LEU  83  -3.139   4.890   9.779
  672   HD11  LEU  83          1HD1      LEU  83  -1.147   3.999   8.659
  673   HD12  LEU  83          2HD1      LEU  83  -1.728   2.882   9.893
  674   HD13  LEU  83          3HD1      LEU  83  -0.308   3.886  10.210
  675   HD21  LEU  83          3HD2      LEU  83  -1.516   4.822  12.350
  676   HD22  LEU  83          1HD2      LEU  83  -2.868   3.754  11.958
  677   HD23  LEU  83          2HD2      LEU  83  -3.143   5.480  12.164
  678    H    LYS  84           H        LYS  84  -1.785   9.122   8.517
  679    HA   LYS  84           HA       LYS  84   0.263  10.658   9.798
  680    HB2  LYS  84           2HB      LYS  84  -1.276  11.230   7.225
  681    HB3  LYS  84           1HB      LYS  84   0.116  12.160   7.778
  682    HG2  LYS  84           2HG      LYS  84   1.494  10.092   7.678
  683    HG3  LYS  84           1HG      LYS  84   0.103   9.227   7.038
  684    HD2  LYS  84           2HD      LYS  84   1.482  11.575   5.673
  685    HD3  LYS  84           1HD      LYS  84   1.730   9.879   5.279
  686    HE2  LYS  84           2HE      LYS  84   0.226  10.531   3.629
  687    HE3  LYS  84           1HE      LYS  84  -0.861   9.865   4.844
  688    HZ1  LYS  84           3HZ      LYS  84  -1.693  11.954   3.994
  689    HZ2  LYS  84           1HZ      LYS  84  -0.264  12.748   4.421
  690    HZ3  LYS  84           2HZ      LYS  84  -1.281  12.138   5.621
  691    H    ALA  85           H        ALA  85  -3.204  11.030   9.552
  692    HA   ALA  85           HA       ALA  85  -3.335  13.734  10.526
  693    HB1  ALA  85           3HB      ALA  85  -5.489  11.592  10.499
  694    HB2  ALA  85           1HB      ALA  85  -5.161  12.732   9.185
  695    HB3  ALA  85           2HB      ALA  85  -5.740  13.325  10.742
  696    H    GLU  86           H        GLU  86  -3.436  10.498  11.974
  697    HA   GLU  86           HA       GLU  86  -4.072  11.406  14.639
  698    HB2  GLU  86           2HB      GLU  86  -2.941   8.698  13.822
  699    HB3  GLU  86           1HB      GLU  86  -3.742   9.090  15.337
  700    HG2  GLU  86           2HG      GLU  86  -4.989   8.873  12.597
  701    HG3  GLU  86           1HG      GLU  86  -5.261   7.838  13.978
  702    H    SER  87           H        SER  87  -1.177  10.654  12.830
  703    HA   SER  87           HA       SER  87   0.666  10.856  15.046
  704    HB2  SER  87           2HB      SER  87   1.190   9.476  13.036
  705    HB3  SER  87           1HB      SER  87   1.224  10.932  12.045
  706    HG   SER  87           HG       SER  87   3.007  11.643  13.268
  707    H    ALA  88           H        ALA  88  -0.921  13.127  12.937
  708    HA   ALA  88           HA       ALA  88   1.051  15.176  13.033
  709    HB1  ALA  88           3HB      ALA  88  -0.632  15.145  11.284
  710    HB2  ALA  88           1HB      ALA  88  -0.626  16.681  12.157
  711    HB3  ALA  88           2HB      ALA  88  -1.896  15.486  12.466
  712    H    LEU  89           H        LEU  89   1.701  15.534  15.051
  713    HA   LEU  89           HA       LEU  89   0.055  16.210  17.282
  714    HB2  LEU  89           2HB      LEU  89   2.078  16.681  18.453
  715    HB3  LEU  89           1HB      LEU  89   2.376  15.276  17.455
  716    HG   LEU  89           HG       LEU  89   3.364  18.096  16.834
  717   HD11  LEU  89          1HD1      LEU  89   4.460  17.163  18.820
  718   HD12  LEU  89          2HD1      LEU  89   5.587  17.233  17.466
  719   HD13  LEU  89          3HD1      LEU  89   4.858  15.692  17.925
  720   HD21  LEU  89          3HD2      LEU  89   4.756  17.053  15.099
  721   HD22  LEU  89          1HD2      LEU  89   3.045  16.738  14.783
  722   HD23  LEU  89          2HD2      LEU  89   4.068  15.468  15.472
  723    H    GLU  90           H        GLU  90   1.118  17.904  14.516
  724    HA   GLU  90           HA       GLU  90   1.072  20.570  15.603
  725    HB2  GLU  90           2HB      GLU  90   1.174  19.647  12.689
  726    HB3  GLU  90           1HB      GLU  90   1.533  21.271  13.277
  727    HG2  GLU  90           2HG      GLU  90   3.471  20.391  14.533
  728    HG3  GLU  90           1HG      GLU  90   3.097  18.766  13.969
  729   H281  4EM 101          2H28      PYA 142   2.560 -11.409   9.983
  730   H283  4EM 101          3H28      PYA 142   2.516 -13.079   9.420
  731   H303  4EM 101          3H30      PYA 142   0.298 -14.271   9.218
  732   H301  4EM 101          1H30      PYA 142  -0.321 -12.959   8.201
  733   H302  4EM 101          2H30      PYA 142  -1.187 -13.439   9.664
  734   H312  4EM 101          2H31      PYA 142  -1.101 -11.075  10.498
  735   H313  4EM 101          3H31      PYA 142   0.442 -10.233  10.610
  736   H311  4EM 101          1H31      PYA 142  -0.241 -10.600   9.020
  737    H32  4EM 101           H32      PYA 142   1.378 -13.742  11.444
  738    H33  4EM 101           H33      PYA 142   1.611 -12.040  13.149
  739    H36  4EM 101           H36      PYA 142  -0.727 -14.793  11.343
  740   H373  4EM 101          3H37      PYA 142  -2.359 -15.719  12.667
  741   H372  4EM 101          2H37      PYA 142  -2.438 -14.256  13.640
  742   H382  4EM 101          2H38      PYA 142  -4.517 -14.658  12.363
  743   H383  4EM 101          3H38      PYA 142  -3.600 -14.615  10.858
  744    H41  4EM 101           H41      PYA 142  -4.835 -12.922  10.030
  745   H423  4EM 101          3H42      PYA 142  -4.071 -10.215  10.780
  746   H422  4EM 101          2H42      PYA 142  -5.787 -10.603  10.952
  747   H433  4EM 101          3H43      PYA 142  -5.343  -9.560   8.778
  748   H432  4EM 101          2H43      PYA 142  -5.864 -11.238   8.561
  749    H44  4EM 101           H44      PYA 142  -3.546 -11.786   8.477
  750    H49  4EM 101           H49      PYA 142  -1.354  -8.579   6.257
  751    H51  4EM 101           H51      PYA 142   0.638 -10.108   5.496
  752    H50  4EM 101           H50      PYA 142   0.023 -12.571   6.072
  753    H48  4EM 101           H48      PYA 142  -2.291 -12.524   7.173
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1   5.449  10.802   0.891
    2    H2   MET   1           2H       MET   1   6.155  11.338   2.329
    3    H3   MET   1           3H       MET   1   7.126  11.001   0.986
    4    HA   MET   1           HA       MET   1   6.850  13.361   1.327
    5    HB2  MET   1           2HB      MET   1   7.176  12.393  -0.966
    6    HB3  MET   1           1HB      MET   1   5.433  12.382  -1.188
    7    HG2  MET   1           2HG      MET   1   7.017  14.903  -0.650
    8    HG3  MET   1           1HG      MET   1   6.669  14.303  -2.273
    9    HE1  MET   1           3HE      MET   1   5.536  16.781  -2.781
   10    HE2  MET   1           1HE      MET   1   5.877  17.259  -1.121
   11    HE3  MET   1           2HE      MET   1   4.249  17.446  -1.773
   12    H    ASP   2           H        ASP   2   3.735  11.907   0.290
   13    HA   ASP   2           HA       ASP   2   2.230  13.774   1.986
   14    HB2  ASP   2           2HB      ASP   2   2.374  15.083  -0.013
   15    HB3  ASP   2           1HB      ASP   2   2.117  13.690  -1.055
   16    H    GLY   3           H        GLY   3   0.997  11.858  -0.741
   17    HA2  GLY   3           2HA      GLY   3   0.010   9.631   0.555
   18    HA3  GLY   3           1HA      GLY   3  -1.170  10.919   0.816
   19    H    GLU   4           H        GLU   4  -1.698  12.212  -1.191
   20    HA   GLU   4           HA       GLU   4  -2.732  10.676  -3.312
   21    HB2  GLU   4           2HB      GLU   4  -1.971  13.615  -3.193
   22    HB3  GLU   4           1HB      GLU   4  -2.866  12.903  -4.532
   23    HG2  GLU   4           2HG      GLU   4  -3.819  12.849  -1.653
   24    HG3  GLU   4           1HG      GLU   4  -4.268  14.079  -2.819
   25    H    GLU   5           H        GLU   5   0.265  12.473  -3.002
   26    HA   GLU   5           HA       GLU   5   1.293  12.140  -5.609
   27    HB2  GLU   5           2HB      GLU   5   2.757  12.619  -2.993
   28    HB3  GLU   5           1HB      GLU   5   3.467  12.830  -4.590
   29    HG2  GLU   5           2HG      GLU   5   1.173  14.431  -3.411
   30    HG3  GLU   5           1HG      GLU   5   2.828  14.981  -3.646
   31    H    VAL   6           H        VAL   6   1.478  10.079  -2.748
   32    HA   VAL   6           HA       VAL   6   3.545   8.401  -3.904
   33    HB   VAL   6           HB       VAL   6   3.491   9.012  -1.431
   34   HG11  VAL   6          1HG1      VAL   6   1.348   6.864  -1.279
   35   HG12  VAL   6          2HG1      VAL   6   1.110   8.582  -0.972
   36   HG13  VAL   6          3HG1      VAL   6   2.145   7.637   0.090
   37   HG21  VAL   6          3HG2      VAL   6   4.987   7.295  -2.295
   38   HG22  VAL   6          1HG2      VAL   6   3.707   6.084  -2.185
   39   HG23  VAL   6          2HG2      VAL   6   4.372   6.804  -0.719
   40    H    LYS   7           H        LYS   7   0.086   8.436  -3.714
   41    HA   LYS   7           HA       LYS   7  -0.703   5.818  -3.556
   42    HB2  LYS   7           2HB      LYS   7  -1.814   7.994  -5.372
   43    HB3  LYS   7           1HB      LYS   7  -2.619   6.444  -5.137
   44    HG2  LYS   7           2HG      LYS   7  -2.693   6.982  -2.653
   45    HG3  LYS   7           1HG      LYS   7  -2.134   8.599  -3.080
   46    HD2  LYS   7           2HD      LYS   7  -4.753   7.282  -3.814
   47    HD3  LYS   7           1HD      LYS   7  -4.494   8.761  -2.890
   48    HE2  LYS   7           2HE      LYS   7  -3.619   9.844  -4.964
   49    HE3  LYS   7           1HE      LYS   7  -4.035   8.382  -5.865
   50    HZ1  LYS   7           3HZ      LYS   7  -6.348   8.700  -5.157
   51    HZ2  LYS   7           1HZ      LYS   7  -5.767   9.993  -6.075
   52    HZ3  LYS   7           2HZ      LYS   7  -5.913  10.151  -4.399
   53    H    GLU   8           H        GLU   8   0.173   7.403  -6.628
   54    HA   GLU   8           HA       GLU   8  -0.020   5.106  -8.263
   55    HB2  GLU   8           2HB      GLU   8   1.320   6.426  -9.908
   56    HB3  GLU   8           1HB      GLU   8  -0.085   7.283  -9.282
   57    HG2  GLU   8           2HG      GLU   8   1.321   8.624  -7.808
   58    HG3  GLU   8           1HG      GLU   8   2.748   7.689  -8.261
   59    H    LYS   9           H        LYS   9   2.680   6.437  -6.383
   60    HA   LYS   9           HA       LYS   9   4.687   4.683  -7.448
   61    HB2  LYS   9           2HB      LYS   9   4.705   6.273  -4.852
   62    HB3  LYS   9           1HB      LYS   9   6.104   5.493  -5.585
   63    HG2  LYS   9           2HG      LYS   9   5.826   7.010  -7.574
   64    HG3  LYS   9           1HG      LYS   9   4.543   7.847  -6.695
   65    HD2  LYS   9           2HD      LYS   9   7.470   7.642  -5.895
   66    HD3  LYS   9           1HD      LYS   9   6.624   9.086  -6.444
   67    HE2  LYS   9           2HE      LYS   9   5.231   9.056  -4.415
   68    HE3  LYS   9           1HE      LYS   9   6.031   7.582  -3.872
   69    HZ1  LYS   9           3HZ      LYS   9   6.892   9.561  -2.786
   70    HZ2  LYS   9           1HZ      LYS   9   7.366  10.203  -4.276
   71    HZ3  LYS   9           2HZ      LYS   9   8.093   8.792  -3.695
   72    H    ILE  10           H        ILE  10   2.283   4.357  -4.948
   73    HA   ILE  10           HA       ILE  10   3.456   2.093  -3.601
   74    HB   ILE  10           HB       ILE  10   0.520   2.926  -3.743
   75   HG12  ILE  10          2HG1      ILE  10   1.874   4.709  -2.720
   76   HG13  ILE  10          1HG1      ILE  10   0.869   3.944  -1.500
   77   HG21  ILE  10          1HG2      ILE  10   1.889   1.012  -1.820
   78   HG22  ILE  10          2HG2      ILE  10   0.726   0.585  -3.074
   79   HG23  ILE  10          3HG2      ILE  10   0.211   1.553  -1.693
   80   HD11  ILE  10          3HD1      ILE  10   2.820   2.666  -0.710
   81   HD12  ILE  10          1HD1      ILE  10   3.086   4.408  -0.648
   82   HD13  ILE  10          2HD1      ILE  10   3.813   3.459  -1.940
   83    H    ARG  11           H        ARG  11   1.091   2.592  -6.187
   84    HA   ARG  11           HA       ARG  11   0.517  -0.121  -6.764
   85    HB2  ARG  11           2HB      ARG  11   0.375   2.325  -8.550
   86    HB3  ARG  11           1HB      ARG  11  -0.233   0.744  -9.016
   87    HG2  ARG  11           2HG      ARG  11  -1.262   2.500  -6.779
   88    HG3  ARG  11           1HG      ARG  11  -2.057   2.145  -8.313
   89    HD2  ARG  11           2HD      ARG  11  -3.166   0.759  -6.805
   90    HD3  ARG  11           1HD      ARG  11  -1.991  -0.340  -7.528
   91    HE   ARG  11           HE       ARG  11  -1.602   0.977  -4.898
   92   HH11  ARG  11          1HH1      ARG  11  -1.426  -1.914  -6.859
   93   HH12  ARG  11          2HH1      ARG  11  -0.751  -2.881  -5.592
   94   HH21  ARG  11          1HH2      ARG  11  -0.652  -0.278  -3.261
   95   HH22  ARG  11          2HH2      ARG  11  -0.312  -1.951  -3.551
   96    H    ARG  12           H        ARG  12   2.871   2.132  -8.121
   97    HA   ARG  12           HA       ARG  12   3.950   0.420 -10.073
   98    HB2  ARG  12           2HB      ARG  12   5.186   2.803  -8.656
   99    HB3  ARG  12           1HB      ARG  12   5.996   1.948  -9.956
  100    HG2  ARG  12           2HG      ARG  12   3.519   3.661 -10.074
  101    HG3  ARG  12           1HG      ARG  12   5.010   3.811 -11.000
  102    HD2  ARG  12           2HD      ARG  12   2.864   1.696 -11.327
  103    HD3  ARG  12           1HD      ARG  12   3.238   3.009 -12.448
  104    HE   ARG  12           HE       ARG  12   5.493   1.284 -11.988
  105   HH11  ARG  12          1HH1      ARG  12   2.543   1.574 -13.871
  106   HH12  ARG  12          2HH1      ARG  12   3.110   0.522 -15.131
  107   HH21  ARG  12          1HH2      ARG  12   6.192  -0.107 -13.593
  108   HH22  ARG  12          2HH2      ARG  12   5.189  -0.432 -14.974
  109    H    TYR  13           H        TYR  13   5.081   1.219  -6.833
  110    HA   TYR  13           HA       TYR  13   7.415  -0.227  -6.684
  111    HB2  TYR  13           2HB      TYR  13   6.773   1.317  -4.935
  112    HB3  TYR  13           1HB      TYR  13   5.371   0.346  -4.518
  113    HD1  TYR  13           HD1      TYR  13   9.113  -0.093  -4.828
  114    HD2  TYR  13           HD2      TYR  13   5.587  -0.971  -2.570
  115    HE1  TYR  13           HE1      TYR  13  10.467  -1.295  -3.185
  116    HE2  TYR  13           HE2      TYR  13   6.954  -2.166  -0.927
  117    HH   TYR  13           HH       TYR  13   9.329  -3.420  -1.108
  118    H    ILE  14           H        ILE  14   4.145  -1.445  -6.116
  119    HA   ILE  14           HA       ILE  14   4.713  -4.076  -5.332
  120    HB   ILE  14           HB       ILE  14   2.377  -3.026  -6.993
  121   HG12  ILE  14          2HG1      ILE  14   2.600  -1.986  -4.732
  122   HG13  ILE  14          1HG1      ILE  14   1.129  -2.943  -4.876
  123   HG21  ILE  14          1HG2      ILE  14   2.502  -5.428  -7.309
  124   HG22  ILE  14          2HG2      ILE  14   1.153  -5.078  -6.233
  125   HG23  ILE  14          3HG2      ILE  14   2.669  -5.701  -5.573
  126   HD11  ILE  14          3HD1      ILE  14   2.176  -3.266  -2.723
  127   HD12  ILE  14          1HD1      ILE  14   3.674  -3.778  -3.493
  128   HD13  ILE  14          2HD1      ILE  14   2.220  -4.770  -3.642
  129    H    MET  15           H        MET  15   4.085  -2.811  -8.608
  130    HA   MET  15           HA       MET  15   4.742  -5.179 -10.018
  131    HB2  MET  15           2HB      MET  15   4.472  -2.253 -10.796
  132    HB3  MET  15           1HB      MET  15   4.955  -3.460 -11.987
  133    HG2  MET  15           2HG      MET  15   2.407  -3.460 -10.367
  134    HG3  MET  15           1HG      MET  15   2.571  -3.128 -12.096
  135    HE1  MET  15           3HE      MET  15   0.853  -6.722 -11.757
  136    HE2  MET  15           1HE      MET  15   0.608  -5.068 -12.307
  137    HE3  MET  15           2HE      MET  15   0.713  -5.417 -10.580
  138    H    GLU  16           H        GLU  16   6.794  -2.387  -9.076
  139    HA   GLU  16           HA       GLU  16   8.916  -2.937 -10.884
  140    HB2  GLU  16           2HB      GLU  16   9.181  -1.330  -8.323
  141    HB3  GLU  16           1HB      GLU  16  10.231  -1.270  -9.729
  142    HG2  GLU  16           2HG      GLU  16   7.470  -0.127  -9.386
  143    HG3  GLU  16           1HG      GLU  16   8.959   0.705  -9.779
  144    H    ASP  17           H        ASP  17   8.449  -3.448  -7.434
  145    HA   ASP  17           HA       ASP  17  11.025  -4.869  -7.179
  146    HB2  ASP  17           2HB      ASP  17  10.762  -2.949  -5.707
  147    HB3  ASP  17           1HB      ASP  17   9.192  -3.518  -5.167
  148    H    LEU  18           H        LEU  18   7.605  -5.181  -6.132
  149    HA   LEU  18           HA       LEU  18   8.076  -7.705  -4.858
  150    HB2  LEU  18           2HB      LEU  18   5.518  -6.205  -5.435
  151    HB3  LEU  18           1HB      LEU  18   5.524  -7.768  -4.645
  152    HG   LEU  18           HG       LEU  18   5.347  -6.152  -2.913
  153   HD11  LEU  18          1HD1      LEU  18   7.314  -6.540  -1.530
  154   HD12  LEU  18          2HD1      LEU  18   8.258  -7.027  -2.938
  155   HD13  LEU  18          3HD1      LEU  18   6.889  -8.007  -2.401
  156   HD21  LEU  18          3HD2      LEU  18   6.073  -4.140  -4.128
  157   HD22  LEU  18          1HD2      LEU  18   7.756  -4.665  -4.002
  158   HD23  LEU  18          2HD2      LEU  18   6.839  -4.261  -2.549
  159    H    ILE  19           H        ILE  19   6.628  -6.825  -7.982
  160    HA   ILE  19           HA       ILE  19   6.309  -9.650  -8.725
  161    HB   ILE  19           HB       ILE  19   5.609  -7.063 -10.177
  162   HG12  ILE  19          2HG1      ILE  19   3.292  -7.945 -10.157
  163   HG13  ILE  19          1HG1      ILE  19   3.852  -9.399  -9.375
  164   HG21  ILE  19          1HG2      ILE  19   5.451  -9.863 -11.348
  165   HG22  ILE  19          2HG2      ILE  19   6.507  -8.558 -11.898
  166   HG23  ILE  19          3HG2      ILE  19   4.757  -8.415 -12.085
  167   HD11  ILE  19          3HD1      ILE  19   2.706  -7.950  -7.835
  168   HD12  ILE  19          1HD1      ILE  19   3.853  -6.653  -8.180
  169   HD13  ILE  19          2HD1      ILE  19   4.400  -8.134  -7.381
  170    H    GLY  20           H        GLY  20   8.224  -6.801  -9.624
  171    HA2  GLY  20           2HA      GLY  20  10.483  -6.856 -10.363
  172    HA3  GLY  20           1HA      GLY  20  10.268  -8.511 -10.925
  173    HA   PRO  21           HA       PRO  21   9.943  -5.514 -14.585
  174    HB2  PRO  21           2HB      PRO  21  11.793  -6.729 -16.205
  175    HB3  PRO  21           1HB      PRO  21  12.244  -5.565 -14.945
  176    HG2  PRO  21           2HG      PRO  21  12.309  -8.564 -14.829
  177    HG3  PRO  21           1HG      PRO  21  13.541  -7.387 -14.316
  178    HD2  PRO  21           2HD      PRO  21  11.845  -8.548 -12.539
  179    HD3  PRO  21           1HD      PRO  21  12.444  -6.884 -12.334
  180    H    SER  22           H        SER  22   9.110  -8.684 -13.945
  181    HA   SER  22           HA       SER  22   7.886  -9.344 -16.500
  182    HB2  SER  22           2HB      SER  22   7.640 -10.648 -13.753
  183    HB3  SER  22           1HB      SER  22   7.058 -11.328 -15.277
  184    HG   SER  22           HG       SER  22   9.274 -11.216 -15.996
  185    H    ALA  23           H        ALA  23   7.165  -6.881 -14.716
  186    HA   ALA  23           HA       ALA  23   4.671  -7.207 -13.481
  187    HB1  ALA  23           3HB      ALA  23   5.907  -4.664 -14.568
  188    HB2  ALA  23           1HB      ALA  23   6.198  -5.371 -12.974
  189    HB3  ALA  23           2HB      ALA  23   4.584  -4.783 -13.392
  190    H    LYS  24           H        LYS  24   2.724  -7.312 -14.204
  191    HA   LYS  24           HA       LYS  24   1.954  -6.416 -16.898
  192    HB2  LYS  24           2HB      LYS  24   0.572  -8.263 -14.924
  193    HB3  LYS  24           1HB      LYS  24  -0.113  -7.752 -16.466
  194    HG2  LYS  24           2HG      LYS  24   1.656  -8.867 -17.689
  195    HG3  LYS  24           1HG      LYS  24   2.485  -9.284 -16.185
  196    HD2  LYS  24           2HD      LYS  24   0.674 -10.769 -15.535
  197    HD3  LYS  24           1HD      LYS  24  -0.297 -10.265 -16.924
  198    HE2  LYS  24           2HE      LYS  24   2.392 -11.644 -17.136
  199    HE3  LYS  24           1HE      LYS  24   0.846 -12.487 -17.224
  200    HZ1  LYS  24           3HZ      LYS  24   0.291 -11.096 -19.153
  201    HZ2  LYS  24           1HZ      LYS  24   1.662 -12.044 -19.420
  202    HZ3  LYS  24           2HZ      LYS  24   1.826 -10.396 -19.093
  203    H    GLU  25           H        GLU  25   2.062  -4.191 -16.193
  204    HA   GLU  25           HA       GLU  25   0.663  -3.072 -14.015
  205    HB2  GLU  25           2HB      GLU  25   0.854  -0.895 -15.221
  206    HB3  GLU  25           1HB      GLU  25   2.363  -1.778 -15.148
  207    HG2  GLU  25           2HG      GLU  25   2.254  -2.404 -17.447
  208    HG3  GLU  25           1HG      GLU  25   0.568  -1.902 -17.567
  209    H    ASP  26           H        ASP  26  -0.465  -4.180 -17.076
  210    HA   ASP  26           HA       ASP  26  -2.876  -2.728 -17.275
  211    HB2  ASP  26           2HB      ASP  26  -1.825  -3.919 -19.183
  212    HB3  ASP  26           1HB      ASP  26  -2.139  -5.470 -18.408
  213    H    GLU  27           H        GLU  27  -1.981  -5.706 -15.646
  214    HA   GLU  27           HA       GLU  27  -4.606  -6.453 -14.731
  215    HB2  GLU  27           2HB      GLU  27  -1.866  -7.278 -13.684
  216    HB3  GLU  27           1HB      GLU  27  -3.382  -8.076 -13.307
  217    HG2  GLU  27           2HG      GLU  27  -2.114  -7.935 -16.050
  218    HG3  GLU  27           1HG      GLU  27  -2.019  -9.303 -14.952
  219    H    LEU  28           H        LEU  28  -2.287  -4.153 -13.764
  220    HA   LEU  28           HA       LEU  28  -3.048  -3.921 -10.968
  221    HB2  LEU  28           2HB      LEU  28  -0.704  -3.729 -11.634
  222    HB3  LEU  28           1HB      LEU  28  -1.102  -2.427 -12.735
  223    HG   LEU  28           HG       LEU  28  -1.810  -1.067 -10.688
  224   HD11  LEU  28          1HD1      LEU  28  -2.083  -2.847  -9.062
  225   HD12  LEU  28          2HD1      LEU  28  -0.835  -1.727  -8.524
  226   HD13  LEU  28          3HD1      LEU  28  -0.376  -3.286  -9.210
  227   HD21  LEU  28          3HD2      LEU  28   0.483  -0.400 -10.172
  228   HD22  LEU  28          1HD2      LEU  28   0.272  -0.655 -11.902
  229   HD23  LEU  28          2HD2      LEU  28   1.091  -1.872 -10.923
  230    H    ASP  29           H        ASP  29  -4.252  -2.268 -10.116
  231    HA   ASP  29           HA       ASP  29  -4.576   0.301 -11.384
  232    HB2  ASP  29           2HB      ASP  29  -6.474  -1.176 -12.373
  233    HB3  ASP  29           1HB      ASP  29  -7.126  -1.247 -10.736
  234    H    ASP  30           H        ASP  30  -5.910   1.760  -9.852
  235    HA   ASP  30           HA       ASP  30  -5.016   1.403  -7.160
  236    HB2  ASP  30           2HB      ASP  30  -6.176   3.511  -6.664
  237    HB3  ASP  30           1HB      ASP  30  -5.181   3.656  -8.106
  238    H    GLN  31           H        GLN  31  -8.029   0.987  -8.840
  239    HA   GLN  31           HA       GLN  31  -9.654   0.432  -6.530
  240    HB2  GLN  31           2HB      GLN  31 -10.175  -0.025  -9.495
  241    HB3  GLN  31           1HB      GLN  31 -11.394  -0.115  -8.224
  242    HG2  GLN  31           2HG      GLN  31 -11.272   2.237  -7.803
  243    HG3  GLN  31           1HG      GLN  31  -9.811   2.411  -8.780
  244   HE21  GLN  31          1HE2      GLN  31  -9.991   2.308 -11.060
  245   HE22  GLN  31          2HE2      GLN  31 -11.501   2.598 -11.853
  246    H    THR  32           H        THR  32  -7.434  -1.422  -8.402
  247    HA   THR  32           HA       THR  32  -8.653  -3.960  -8.404
  248    HB   THR  32           HB       THR  32  -5.689  -3.308  -8.401
  249    HG1  THR  32           HG1      THR  32  -7.383  -4.019 -10.558
  250   HG21  THR  32          3HG2      THR  32  -7.124  -5.912  -9.099
  251   HG22  THR  32          1HG2      THR  32  -6.011  -5.664  -7.749
  252   HG23  THR  32          2HG2      THR  32  -5.416  -5.587  -9.408
  253    HA   PRO  33           HA       PRO  33  -8.204  -4.724  -3.940
  254    HB2  PRO  33           2HB      PRO  33  -9.542  -7.112  -3.884
  255    HB3  PRO  33           1HB      PRO  33 -10.380  -5.549  -4.004
  256    HG2  PRO  33           2HG      PRO  33  -9.773  -7.527  -6.164
  257    HG3  PRO  33           1HG      PRO  33 -11.246  -6.573  -5.890
  258    HD2  PRO  33           2HD      PRO  33  -9.337  -5.887  -7.726
  259    HD3  PRO  33           1HD      PRO  33 -10.394  -4.701  -6.929
  260    H    LEU  34           H        LEU  34  -6.117  -5.177  -3.536
  261    HA   LEU  34           HA       LEU  34  -4.498  -6.977  -4.983
  262    HB2  LEU  34           2HB      LEU  34  -3.995  -5.758  -2.255
  263    HB3  LEU  34           1HB      LEU  34  -2.778  -6.403  -3.348
  264    HG   LEU  34           HG       LEU  34  -4.487  -3.945  -3.902
  265   HD11  LEU  34          1HD1      LEU  34  -2.441  -2.650  -3.532
  266   HD12  LEU  34          2HD1      LEU  34  -1.577  -4.120  -3.074
  267   HD13  LEU  34          3HD1      LEU  34  -2.914  -3.531  -2.082
  268   HD21  LEU  34          3HD2      LEU  34  -2.946  -3.559  -5.804
  269   HD22  LEU  34          1HD2      LEU  34  -3.853  -5.057  -5.988
  270   HD23  LEU  34          2HD2      LEU  34  -2.163  -5.108  -5.480
  271    H    LEU  35           H        LEU  35  -6.168  -7.248  -1.871
  272    HA   LEU  35           HA       LEU  35  -5.070  -9.716  -0.997
  273    HB2  LEU  35           2HB      LEU  35  -7.811  -8.542  -0.436
  274    HB3  LEU  35           1HB      LEU  35  -7.077  -9.866   0.459
  275    HG   LEU  35           HG       LEU  35  -5.940  -7.043   0.361
  276   HD11  LEU  35          1HD1      LEU  35  -8.133  -7.093   1.465
  277   HD12  LEU  35          2HD1      LEU  35  -6.831  -6.769   2.603
  278   HD13  LEU  35          3HD1      LEU  35  -7.563  -8.374   2.541
  279   HD21  LEU  35          3HD2      LEU  35  -4.548  -7.779   2.261
  280   HD22  LEU  35          1HD2      LEU  35  -4.223  -8.751   0.828
  281   HD23  LEU  35          2HD2      LEU  35  -5.213  -9.410   2.132
  282    H    GLU  36           H        GLU  36  -8.010  -8.960  -2.850
  283    HA   GLU  36           HA       GLU  36  -8.932 -11.640  -3.099
  284    HB2  GLU  36           2HB      GLU  36  -9.575  -9.307  -4.929
  285    HB3  GLU  36           1HB      GLU  36 -10.519 -10.779  -4.758
  286    HG2  GLU  36           2HG      GLU  36 -10.167  -8.569  -2.725
  287    HG3  GLU  36           1HG      GLU  36 -11.633  -8.995  -3.595
  288    H    TRP  37           H        TRP  37  -6.585  -9.752  -4.837
  289    HA   TRP  37           HA       TRP  37  -6.420 -11.711  -7.056
  290    HB2  TRP  37           2HB      TRP  37  -5.133  -8.995  -6.587
  291    HB3  TRP  37           1HB      TRP  37  -4.605 -10.063  -7.884
  292    HD1  TRP  37           HD1      TRP  37  -8.220  -9.060  -6.783
  293    HE1  TRP  37           HE1      TRP  37  -9.480  -8.240  -8.841
  294    HE3  TRP  37           HE3      TRP  37  -4.446  -9.406 -10.235
  295    HZ2  TRP  37           HZ2      TRP  37  -8.970  -7.776 -11.579
  296    HZ3  TRP  37           HZ3      TRP  37  -4.927  -8.748 -12.562
  297    HH2  TRP  37           HH2      TRP  37  -7.142  -7.950 -13.219
  298    H    GLY  38           H        GLY  38  -5.409 -11.767  -3.996
  299    HA2  GLY  38           2HA      GLY  38  -3.953 -13.141  -2.895
  300    HA3  GLY  38           1HA      GLY  38  -3.594 -13.899  -4.436
  301    H    ILE  39           H        ILE  39  -3.062 -10.511  -4.111
  302    HA   ILE  39           HA       ILE  39  -0.287 -10.758  -4.839
  303    HB   ILE  39           HB       ILE  39  -2.083  -8.342  -4.320
  304   HG12  ILE  39          2HG1      ILE  39  -1.012  -9.478  -6.942
  305   HG13  ILE  39          1HG1      ILE  39  -2.645  -9.720  -6.334
  306   HG21  ILE  39          1HG2      ILE  39   0.252  -7.697  -3.839
  307   HG22  ILE  39          2HG2      ILE  39  -0.360  -6.888  -5.280
  308   HG23  ILE  39          3HG2      ILE  39   0.738  -8.261  -5.443
  309   HD11  ILE  39          3HD1      ILE  39  -3.037  -7.295  -6.512
  310   HD12  ILE  39          1HD1      ILE  39  -2.628  -8.045  -8.054
  311   HD13  ILE  39          2HD1      ILE  39  -1.416  -7.102  -7.187
  312    H    LEU  40           H        LEU  40  -2.128  -9.994  -1.919
  313    HA   LEU  40           HA       LEU  40   0.324  -9.090  -0.559
  314    HB2  LEU  40           2HB      LEU  40  -2.559  -8.629   0.222
  315    HB3  LEU  40           1HB      LEU  40  -1.160  -8.040   1.110
  316    HG   LEU  40           HG       LEU  40  -2.007  -7.193  -1.683
  317   HD11  LEU  40          1HD1      LEU  40  -3.405  -6.249   0.039
  318   HD12  LEU  40          2HD1      LEU  40  -2.362  -4.998  -0.632
  319   HD13  LEU  40          3HD1      LEU  40  -1.990  -5.698   0.947
  320   HD21  LEU  40          3HD2      LEU  40  -0.155  -5.558  -1.572
  321   HD22  LEU  40          1HD2      LEU  40   0.424  -7.223  -1.595
  322   HD23  LEU  40          2HD2      LEU  40   0.415  -6.312  -0.080
  323    H    ASN  41           H        ASN  41   1.115  -9.977   0.999
  324    HA   ASN  41           HA       ASN  41   0.087 -11.102   3.287
  325    HB2  ASN  41           2HB      ASN  41   0.373 -13.135   1.189
  326    HB3  ASN  41           1HB      ASN  41   1.506 -13.486   2.486
  327   HD21  ASN  41          1HD2      ASN  41   0.657 -13.938   4.595
  328   HD22  ASN  41          2HD2      ASN  41  -0.986 -14.425   4.808
  329    H    SER  42           H        SER  42   2.274 -12.377   4.314
  330    HA   SER  42           HA       SER  42   3.800 -10.335   5.106
  331    HB2  SER  42           3HB      SER  42   4.704 -13.231   4.810
  332    HB3  SER  42           2HB      SER  42   5.563 -12.026   5.772
  333    H    MET  43           H        MET  43   4.725 -12.400   2.322
  334    HA   MET  43           HA       MET  43   7.340 -11.292   1.988
  335    HB2  MET  43           2HB      MET  43   7.302 -12.546  -0.248
  336    HB3  MET  43           1HB      MET  43   7.077 -13.510   1.205
  337    HG2  MET  43           2HG      MET  43   5.564 -14.264  -0.521
  338    HG3  MET  43           1HG      MET  43   4.643 -13.533   0.793
  339    HE1  MET  43           3HE      MET  43   2.215 -11.690  -1.341
  340    HE2  MET  43           1HE      MET  43   2.706 -12.093   0.305
  341    HE3  MET  43           2HE      MET  43   2.469 -13.377  -0.885
  342    H    ASN  44           H        ASN  44   4.490  -9.831   1.329
  343    HA   ASN  44           HA       ASN  44   5.624  -8.055  -0.734
  344    HB2  ASN  44           2HB      ASN  44   3.832  -9.594  -1.648
  345    HB3  ASN  44           1HB      ASN  44   2.691  -8.906  -0.498
  346   HD21  ASN  44          1HD2      ASN  44   2.801  -8.957  -3.490
  347   HD22  ASN  44          2HD2      ASN  44   2.607  -7.310  -3.972
  348    H    ILE  45           H        ILE  45   3.344  -8.429   1.917
  349    HA   ILE  45           HA       ILE  45   2.353  -5.784   1.914
  350    HB   ILE  45           HB       ILE  45   1.177  -7.879   2.743
  351   HG12  ILE  45          2HG1      ILE  45   1.132  -5.527   4.676
  352   HG13  ILE  45          1HG1      ILE  45   0.258  -5.586   3.146
  353   HG21  ILE  45          1HG2      ILE  45   2.762  -7.410   5.295
  354   HG22  ILE  45          2HG2      ILE  45   2.983  -8.766   4.192
  355   HG23  ILE  45          3HG2      ILE  45   1.467  -8.590   5.076
  356   HD11  ILE  45          3HD1      ILE  45  -1.086  -7.415   3.935
  357   HD12  ILE  45          1HD1      ILE  45  -1.144  -6.098   5.110
  358   HD13  ILE  45          2HD1      ILE  45  -0.134  -7.522   5.420
  359    H    VAL  46           H        VAL  46   4.952  -7.363   3.688
  360    HA   VAL  46           HA       VAL  46   5.322  -5.401   5.727
  361    HB   VAL  46           HB       VAL  46   7.278  -7.485   4.663
  362   HG11  VAL  46          1HG1      VAL  46   7.353  -5.933   7.277
  363   HG12  VAL  46          2HG1      VAL  46   8.475  -5.756   5.927
  364   HG13  VAL  46          3HG1      VAL  46   8.435  -7.260   6.847
  365   HG21  VAL  46          3HG2      VAL  46   6.551  -8.872   6.585
  366   HG22  VAL  46          1HG2      VAL  46   5.216  -8.533   5.483
  367   HG23  VAL  46          2HG2      VAL  46   5.342  -7.654   7.011
  368    H    LYS  47           H        LYS  47   6.263  -5.673   2.433
  369    HA   LYS  47           HA       LYS  47   8.448  -3.816   2.457
  370    HB2  LYS  47           2HB      LYS  47   6.873  -5.091   0.202
  371    HB3  LYS  47           1HB      LYS  47   8.112  -3.877  -0.094
  372    HG2  LYS  47           2HG      LYS  47   9.064  -6.073  -0.415
  373    HG3  LYS  47           1HG      LYS  47   9.785  -5.319   1.007
  374    HD2  LYS  47           2HD      LYS  47   8.405  -6.678   2.489
  375    HD3  LYS  47           1HD      LYS  47   7.539  -7.365   1.115
  376    HE2  LYS  47           2HE      LYS  47  10.490  -7.733   1.704
  377    HE3  LYS  47           1HE      LYS  47   9.221  -8.916   2.021
  378    HZ1  LYS  47           3HZ      LYS  47   8.774  -9.009  -0.335
  379    HZ2  LYS  47           1HZ      LYS  47  10.382  -9.394  -0.015
  380    HZ3  LYS  47           2HZ      LYS  47   9.986  -7.879  -0.640
  381    H    LEU  48           H        LEU  48   4.963  -3.618   2.005
  382    HA   LEU  48           HA       LEU  48   4.893  -0.866   1.193
  383    HB2  LEU  48           2HB      LEU  48   2.742  -2.579   2.502
  384    HB3  LEU  48           1HB      LEU  48   2.481  -0.907   2.034
  385    HG   LEU  48           HG       LEU  48   1.517  -2.245   0.316
  386   HD11  LEU  48          1HD1      LEU  48   2.754  -1.579  -1.706
  387   HD12  LEU  48          2HD1      LEU  48   4.195  -1.251  -0.746
  388   HD13  LEU  48          3HD1      LEU  48   2.743  -0.271  -0.525
  389   HD21  LEU  48          3HD2      LEU  48   4.126  -3.770   0.055
  390   HD22  LEU  48          1HD2      LEU  48   2.676  -3.995  -0.927
  391   HD23  LEU  48          2HD2      LEU  48   2.642  -4.379   0.789
  392    H    MET  49           H        MET  49   4.848  -2.548   4.294
  393    HA   MET  49           HA       MET  49   4.196  -0.403   6.005
  394    HB2  MET  49           2HB      MET  49   6.067  -2.715   6.693
  395    HB3  MET  49           1HB      MET  49   5.194  -1.699   7.833
  396    HG2  MET  49           2HG      MET  49   3.077  -2.647   7.121
  397    HG3  MET  49           1HG      MET  49   3.896  -3.606   5.881
  398    HE1  MET  49           3HE      MET  49   2.067  -5.230   7.656
  399    HE2  MET  49           1HE      MET  49   3.057  -6.494   8.380
  400    HE3  MET  49           2HE      MET  49   3.245  -6.099   6.668
  401    H    VAL  50           H        VAL  50   7.386  -1.678   5.034
  402    HA   VAL  50           HA       VAL  50   8.912   0.365   6.339
  403    HB   VAL  50           HB       VAL  50   9.852  -1.887   5.921
  404   HG11  VAL  50          1HG1      VAL  50   8.914  -2.365   3.708
  405   HG12  VAL  50          2HG1      VAL  50  10.666  -2.551   3.682
  406   HG13  VAL  50          3HG1      VAL  50   9.923  -1.108   2.980
  407   HG21  VAL  50          3HG2      VAL  50  11.417  -0.021   6.306
  408   HG22  VAL  50          1HG2      VAL  50  11.478   0.294   4.569
  409   HG23  VAL  50          2HG2      VAL  50  12.118  -1.218   5.216
  410    H    TYR  51           H        TYR  51   7.470   0.097   3.154
  411    HA   TYR  51           HA       TYR  51   9.010   2.010   1.739
  412    HB2  TYR  51           2HB      TYR  51   7.291   0.382   0.718
  413    HB3  TYR  51           1HB      TYR  51   6.045   1.480   1.269
  414    HD1  TYR  51           HD1      TYR  51   8.942   1.144  -1.038
  415    HD2  TYR  51           HD2      TYR  51   5.599   3.565   0.065
  416    HE1  TYR  51           HE1      TYR  51   9.207   2.445  -3.097
  417    HE2  TYR  51           HE2      TYR  51   5.866   4.863  -2.001
  418    HH   TYR  51           HH       TYR  51   7.753   5.409  -3.584
  419    H    ILE  52           H        ILE  52   5.863   2.259   3.271
  420    HA   ILE  52           HA       ILE  52   5.507   5.064   3.027
  421    HB   ILE  52           HB       ILE  52   4.136   3.058   4.871
  422   HG12  ILE  52          2HG1      ILE  52   3.145   4.036   2.156
  423   HG13  ILE  52          1HG1      ILE  52   4.125   2.584   2.322
  424   HG21  ILE  52          1HG2      ILE  52   3.722   5.396   5.571
  425   HG22  ILE  52          2HG2      ILE  52   2.251   4.632   4.967
  426   HG23  ILE  52          3HG2      ILE  52   3.134   5.772   3.953
  427   HD11  ILE  52          3HD1      ILE  52   1.409   3.036   3.536
  428   HD12  ILE  52          1HD1      ILE  52   2.404   1.587   3.723
  429   HD13  ILE  52          2HD1      ILE  52   1.799   2.041   2.131
  430    H    ARG  53           H        ARG  53   6.910   2.988   5.468
  431    HA   ARG  53           HA       ARG  53   7.172   4.787   7.626
  432    HB2  ARG  53           2HB      ARG  53   7.461   2.323   7.848
  433    HB3  ARG  53           1HB      ARG  53   8.910   2.411   6.851
  434    HG2  ARG  53           2HG      ARG  53   9.490   2.198   9.224
  435    HG3  ARG  53           1HG      ARG  53  10.055   3.735   8.569
  436    HD2  ARG  53           2HD      ARG  53   7.894   4.757   9.540
  437    HD3  ARG  53           1HD      ARG  53   7.702   3.242  10.425
  438    HE   ARG  53           HE       ARG  53   9.597   5.371  10.909
  439   HH11  ARG  53          1HH1      ARG  53   8.871   2.022  11.606
  440   HH12  ARG  53          2HH1      ARG  53   9.837   2.008  13.042
  441   HH21  ARG  53          1HH2      ARG  53  10.800   5.345  12.784
  442   HH22  ARG  53          2HH2      ARG  53  10.926   3.887  13.708
  443    H    ASP  54           H        ASP  54   9.086   4.336   4.718
  444    HA   ASP  54           HA       ASP  54  11.200   6.184   5.664
  445    HB2  ASP  54           2HB      ASP  54  11.882   4.039   4.591
  446    HB3  ASP  54           1HB      ASP  54  11.044   4.514   3.120
  447    H    GLU  55           H        GLU  55   8.538   6.016   3.392
  448    HA   GLU  55           HA       GLU  55   9.434   8.273   1.782
  449    HB2  GLU  55           2HB      GLU  55   8.002   6.040   1.149
  450    HB3  GLU  55           1HB      GLU  55   6.671   7.138   1.433
  451    HG2  GLU  55           2HG      GLU  55   8.907   7.508  -0.577
  452    HG3  GLU  55           1HG      GLU  55   7.271   6.986  -0.945
  453    H    MET  56           H        MET  56   6.526   7.572   3.791
  454    HA   MET  56           HA       MET  56   6.024  10.472   4.119
  455    HB2  MET  56           2HB      MET  56   4.292   8.020   4.522
  456    HB3  MET  56           1HB      MET  56   3.865   9.519   5.340
  457    HG2  MET  56           2HG      MET  56   2.619   9.308   3.271
  458    HG3  MET  56           1HG      MET  56   3.736  10.669   3.182
  459    HE1  MET  56           3HE      MET  56   3.005   6.989   2.004
  460    HE2  MET  56           1HE      MET  56   4.572   6.833   2.800
  461    HE3  MET  56           2HE      MET  56   4.450   6.635   1.054
  462    H    GLY  57           H        GLY  57   7.594   7.991   5.761
  463    HA2  GLY  57           2HA      GLY  57   8.707   8.057   7.779
  464    HA3  GLY  57           1HA      GLY  57   7.992   9.627   8.111
  465    H    VAL  58           H        VAL  58   5.888   6.965   7.296
  466    HA   VAL  58           HA       VAL  58   5.233   6.443  10.142
  467    HB   VAL  58           HB       VAL  58   3.690   8.240   9.443
  468   HG11  VAL  58          1HG1      VAL  58   2.811   6.422   7.171
  469   HG12  VAL  58          2HG1      VAL  58   3.679   7.950   7.010
  470   HG13  VAL  58          3HG1      VAL  58   2.025   7.938   7.627
  471   HG21  VAL  58          3HG2      VAL  58   2.807   6.532  10.982
  472   HG22  VAL  58          1HG2      VAL  58   2.240   5.576   9.611
  473   HG23  VAL  58          2HG2      VAL  58   1.522   7.155   9.941
  474    H    SER  59           H        SER  59   5.125   4.233  10.438
  475    HA   SER  59           HA       SER  59   4.307   2.505   8.184
  476    HB2  SER  59           2HB      SER  59   6.436   1.864   9.336
  477    HB3  SER  59           1HB      SER  59   5.559   1.707  10.853
  478    HG   SER  59           HG       SER  59   4.290   0.064   9.816
  479    H    ILE  60           H        ILE  60   2.527   1.181   8.411
  480    HA   ILE  60           HA       ILE  60   0.484   1.797  10.298
  481    HB   ILE  60           HB       ILE  60   0.725  -0.684   8.529
  482   HG12  ILE  60          2HG1      ILE  60  -0.493   2.047   8.035
  483   HG13  ILE  60          1HG1      ILE  60   0.626   1.163   7.021
  484   HG21  ILE  60          1HG2      ILE  60  -1.697  -0.978   8.911
  485   HG22  ILE  60          2HG2      ILE  60  -1.713   0.419   9.988
  486   HG23  ILE  60          3HG2      ILE  60  -0.810  -1.032  10.431
  487   HD11  ILE  60          3HD1      ILE  60  -1.131  -0.364   6.389
  488   HD12  ILE  60          1HD1      ILE  60  -1.622   1.300   6.086
  489   HD13  ILE  60          2HD1      ILE  60  -2.259   0.435   7.490
  490    HA   PRO  61           HA       PRO  61   2.394  -0.581  13.721
  491    HB2  PRO  61           2HB      PRO  61   0.135  -0.515  15.389
  492    HB3  PRO  61           1HB      PRO  61   1.338   0.783  15.273
  493    HG2  PRO  61           2HG      PRO  61  -1.320   0.570  13.922
  494    HG3  PRO  61           1HG      PRO  61  -0.551   1.977  14.693
  495    HD2  PRO  61           2HD      PRO  61  -0.566   1.703  12.022
  496    HD3  PRO  61           1HD      PRO  61   0.847   2.391  12.860
  497    H    SER  62           H        SER  62   2.141  -2.692  14.632
  498    HA   SER  62           HA       SER  62   1.294  -4.580  12.724
  499    HB2  SER  62           2HB      SER  62   1.996  -5.161  15.628
  500    HB3  SER  62           1HB      SER  62   2.061  -6.273  14.257
  501    HG   SER  62           HG       SER  62   3.534  -4.452  13.403
  502    H    THR  63           H        THR  63  -0.440  -3.287  15.478
  503    HA   THR  63           HA       THR  63  -2.512  -5.278  15.582
  504    HB   THR  63           HB       THR  63  -2.067  -3.863  17.550
  505    HG1  THR  63           HG1      THR  63  -4.194  -4.696  17.249
  506   HG21  THR  63          3HG2      THR  63  -1.461  -1.748  16.402
  507   HG22  THR  63          1HG2      THR  63  -2.700  -1.493  17.637
  508   HG23  THR  63          2HG2      THR  63  -3.147  -1.530  15.931
  509    H    HIS  64           H        HIS  64  -2.013  -2.276  13.817
  510    HA   HIS  64           HA       HIS  64  -4.644  -2.317  12.539
  511    HB2  HIS  64           2HB      HIS  64  -2.304  -0.410  12.536
  512    HB3  HIS  64           1HB      HIS  64  -3.451  -0.341  11.202
  513    HD1  HIS  64           HD1      HIS  64  -3.288   0.128  14.955
  514    HD2  HIS  64           HD2      HIS  64  -5.789   0.943  11.749
  515    HE1  HIS  64           HE1      HIS  64  -5.166   1.479  15.897
  516    HE2  HIS  64           HE2      HIS  64  -6.786   1.749  13.981
  517    H    ILE  65           H        ILE  65  -1.769  -3.999  12.051
  518    HA   ILE  65           HA       ILE  65  -1.935  -4.179   9.185
  519    HB   ILE  65           HB       ILE  65  -0.607  -6.130  11.110
  520   HG12  ILE  65          2HG1      ILE  65   0.415  -3.907  11.266
  521   HG13  ILE  65          1HG1      ILE  65   1.515  -5.010  10.451
  522   HG21  ILE  65          1HG2      ILE  65   0.634  -6.920   9.107
  523   HG22  ILE  65          2HG2      ILE  65  -0.350  -5.863   8.091
  524   HG23  ILE  65          3HG2      ILE  65  -1.101  -7.198   8.968
  525   HD11  ILE  65          3HD1      ILE  65  -0.237  -2.960   9.115
  526   HD12  ILE  65          1HD1      ILE  65   0.909  -4.033   8.309
  527   HD13  ILE  65          2HD1      ILE  65   1.491  -2.811   9.441
  528    H    THR  66           H        THR  66  -3.973  -4.568   8.683
  529    HA   THR  66           HA       THR  66  -4.854  -7.320   8.782
  530    HB   THR  66           HB       THR  66  -6.081  -6.440  10.695
  531    HG1  THR  66           HG1      THR  66  -7.368  -7.755   9.412
  532   HG21  THR  66          3HG2      THR  66  -7.066  -4.186   8.905
  533   HG22  THR  66          1HG2      THR  66  -5.899  -4.022  10.223
  534   HG23  THR  66          2HG2      THR  66  -7.568  -4.480  10.570
  535    H    GLY  67           H        GLY  67  -6.505  -7.688   7.128
  536    HA2  GLY  67           2HA      GLY  67  -5.734  -6.612   4.654
  537    HA3  GLY  67           1HA      GLY  67  -7.139  -7.629   4.943
  538    H    LYS  68           H        LYS  68  -8.255  -5.646   6.871
  539    HA   LYS  68           HA       LYS  68 -10.062  -4.235   5.350
  540    HB2  LYS  68           2HB      LYS  68 -10.276  -4.628   7.764
  541    HB3  LYS  68           1HB      LYS  68  -8.912  -3.561   8.093
  542    HG2  LYS  68           2HG      LYS  68 -10.228  -1.649   7.211
  543    HG3  LYS  68           1HG      LYS  68 -11.597  -2.732   6.941
  544    HD2  LYS  68           2HD      LYS  68 -10.349  -1.989   9.613
  545    HD3  LYS  68           1HD      LYS  68 -11.944  -1.527   9.022
  546    HE2  LYS  68           2HE      LYS  68 -11.023  -4.309   9.797
  547    HE3  LYS  68           1HE      LYS  68 -12.194  -3.299  10.643
  548    HZ1  LYS  68           3HZ      LYS  68 -13.682  -3.485   8.763
  549    HZ2  LYS  68           1HZ      LYS  68 -13.249  -5.022   9.312
  550    HZ3  LYS  68           2HZ      LYS  68 -12.550  -4.401   7.909
  551    H    TYR  69           H        TYR  69  -6.917  -3.137   6.513
  552    HA   TYR  69           HA       TYR  69  -7.225  -0.463   5.342
  553    HB2  TYR  69           2HB      TYR  69  -5.044  -1.647   7.101
  554    HB3  TYR  69           1HB      TYR  69  -5.135   0.038   6.588
  555    HD1  TYR  69           HD2      TYR  69  -7.705   1.062   7.074
  556    HD2  TYR  69           HD1      TYR  69  -5.741  -1.977   9.337
  557    HE1  TYR  69           HE2      TYR  69  -9.115   1.593   9.004
  558    HE2  TYR  69           HE1      TYR  69  -7.158  -1.457  11.262
  559    HH   TYR  69           HH       TYR  69  -9.907   0.553  11.037
  560    H    PHE  70           H        PHE  70  -6.098  -3.440   4.349
  561    HA   PHE  70           HA       PHE  70  -4.148  -2.297   2.410
  562    HB2  PHE  70           2HB      PHE  70  -4.106  -4.958   3.894
  563    HB3  PHE  70           1HB      PHE  70  -3.141  -4.681   2.454
  564    HD1  PHE  70           HD1      PHE  70  -1.242  -3.084   2.489
  565    HD2  PHE  70           HD2      PHE  70  -3.444  -3.974   6.043
  566    HE1  PHE  70           HE1      PHE  70   0.616  -2.230   3.855
  567    HE2  PHE  70           HE2      PHE  70  -1.590  -3.124   7.401
  568    HZ   PHE  70           HZ       PHE  70   0.448  -2.252   6.317
  569    H    LYS  71           H        LYS  71  -7.197  -3.002   2.294
  570    HA   LYS  71           HA       LYS  71  -7.725  -5.249   0.753
  571    HB2  LYS  71           2HB      LYS  71  -9.045  -2.521   0.616
  572    HB3  LYS  71           1HB      LYS  71  -9.702  -3.964  -0.161
  573    HG2  LYS  71           2HG      LYS  71  -9.977  -5.048   2.019
  574    HG3  LYS  71           1HG      LYS  71  -9.266  -3.643   2.827
  575    HD2  LYS  71           2HD      LYS  71 -11.852  -3.677   1.224
  576    HD3  LYS  71           1HD      LYS  71 -11.709  -3.568   2.979
  577    HE2  LYS  71           2HE      LYS  71 -10.577  -1.401   2.772
  578    HE3  LYS  71           1HE      LYS  71 -10.670  -1.494   1.013
  579    HZ1  LYS  71           3HZ      LYS  71 -12.914  -1.217   2.929
  580    HZ2  LYS  71           1HZ      LYS  71 -13.133  -1.561   1.285
  581    HZ3  LYS  71           2HZ      LYS  71 -12.400  -0.116   1.757
  582    H    ASP  72           H        ASP  72  -6.667  -2.095  -0.320
  583    HA   ASP  72           HA       ASP  72  -5.680  -2.959  -2.864
  584    HB2  ASP  72           2HB      ASP  72  -7.229  -1.710  -4.283
  585    HB3  ASP  72           1HB      ASP  72  -8.180  -2.797  -3.283
  586    H    LEU  73           H        LEU  73  -5.750  -0.288  -4.036
  587    HA   LEU  73           HA       LEU  73  -3.724   1.018  -2.485
  588    HB2  LEU  73           2HB      LEU  73  -3.734   1.266  -4.926
  589    HB3  LEU  73           1HB      LEU  73  -5.290   2.080  -4.856
  590    HG   LEU  73           HG       LEU  73  -4.238   3.939  -3.546
  591   HD11  LEU  73          1HD1      LEU  73  -2.391   2.734  -2.493
  592   HD12  LEU  73          2HD1      LEU  73  -1.770   4.099  -3.416
  593   HD13  LEU  73          3HD1      LEU  73  -1.634   2.466  -4.068
  594   HD21  LEU  73          3HD2      LEU  73  -4.478   4.289  -5.898
  595   HD22  LEU  73          1HD2      LEU  73  -3.039   3.337  -6.257
  596   HD23  LEU  73          2HD2      LEU  73  -2.891   4.885  -5.437
  597    H    ASN  74           H        ASN  74  -7.117   1.781  -3.274
  598    HA   ASN  74           HA       ASN  74  -7.331   4.264  -2.006
  599    HB2  ASN  74           2HB      ASN  74  -9.442   2.137  -2.527
  600    HB3  ASN  74           1HB      ASN  74  -9.842   3.720  -1.866
  601   HD21  ASN  74          1HD2      ASN  74  -8.780   1.978  -4.720
  602   HD22  ASN  74          2HD2      ASN  74  -9.010   3.297  -5.825
  603    H    ALA  75           H        ALA  75  -7.867   1.034  -0.629
  604    HA   ALA  75           HA       ALA  75  -8.716   1.678   1.942
  605    HB1  ALA  75           3HB      ALA  75  -7.781  -0.494   2.627
  606    HB2  ALA  75           1HB      ALA  75  -6.833  -0.571   1.145
  607    HB3  ALA  75           2HB      ALA  75  -8.598  -0.624   1.064
  608    H    ILE  76           H        ILE  76  -5.393   1.291   0.768
  609    HA   ILE  76           HA       ILE  76  -4.031   2.058   3.166
  610    HB   ILE  76           HB       ILE  76  -3.071   1.925   0.275
  611   HG12  ILE  76          2HG1      ILE  76  -2.713  -0.043   2.568
  612   HG13  ILE  76          1HG1      ILE  76  -3.867  -0.247   1.244
  613   HG21  ILE  76          1HG2      ILE  76  -1.582   3.414   1.579
  614   HG22  ILE  76          2HG2      ILE  76  -0.755   1.910   1.169
  615   HG23  ILE  76          3HG2      ILE  76  -1.381   2.153   2.800
  616   HD11  ILE  76          3HD1      ILE  76  -1.984  -0.389  -0.331
  617   HD12  ILE  76          1HD1      ILE  76  -1.919  -1.622   0.930
  618   HD13  ILE  76          2HD1      ILE  76  -0.856  -0.215   1.021
  619    H    SER  77           H        SER  77  -5.197   3.835   0.343
  620    HA   SER  77           HA       SER  77  -3.619   6.190   0.690
  621    HB2  SER  77           2HB      SER  77  -6.268   5.891  -0.791
  622    HB3  SER  77           1HB      SER  77  -5.082   7.180  -1.008
  623    HG   SER  77           HG       SER  77  -3.998   4.698  -1.292
  624    H    ARG  78           H        ARG  78  -6.701   5.091   1.910
  625    HA   ARG  78           HA       ARG  78  -7.454   7.619   3.113
  626    HB2  ARG  78           2HB      ARG  78  -8.597   4.816   3.461
  627    HB3  ARG  78           1HB      ARG  78  -9.300   6.274   4.155
  628    HG2  ARG  78           2HG      ARG  78  -9.019   5.642   1.209
  629    HG3  ARG  78           1HG      ARG  78 -10.511   5.619   2.147
  630    HD2  ARG  78           2HD      ARG  78 -10.304   8.055   2.526
  631    HD3  ARG  78           1HD      ARG  78  -8.804   8.072   1.587
  632    HE   ARG  78           HE       ARG  78 -10.829   6.952   0.008
  633   HH11  ARG  78          1HH1      ARG  78  -9.975  10.058   1.374
  634   HH12  ARG  78          2HH1      ARG  78 -10.766  10.965   0.126
  635   HH21  ARG  78          1HH2      ARG  78 -11.889   8.139  -1.611
  636   HH22  ARG  78          2HH2      ARG  78 -11.852   9.872  -1.567
  637    H    THR  79           H        THR  79  -6.232   4.478   4.191
  638    HA   THR  79           HA       THR  79  -6.273   4.940   6.963
  639    HB   THR  79           HB       THR  79  -4.469   3.033   5.409
  640    HG1  THR  79           HG1      THR  79  -6.259   1.939   5.140
  641   HG21  THR  79          3HG2      THR  79  -3.692   3.310   7.757
  642   HG22  THR  79          1HG2      THR  79  -4.408   1.714   7.512
  643   HG23  THR  79          2HG2      THR  79  -5.328   2.975   8.332
  644    H    VAL  80           H        VAL  80  -3.728   5.474   4.565
  645    HA   VAL  80           HA       VAL  80  -1.605   5.955   6.391
  646    HB   VAL  80           HB       VAL  80  -1.277   5.274   3.974
  647   HG11  VAL  80          1HG1      VAL  80  -1.276   6.961   2.189
  648   HG12  VAL  80          2HG1      VAL  80  -1.880   8.189   3.305
  649   HG13  VAL  80          3HG1      VAL  80  -2.892   6.803   2.885
  650   HG21  VAL  80          3HG2      VAL  80   0.601   6.128   5.305
  651   HG22  VAL  80          1HG2      VAL  80   0.219   7.784   4.827
  652   HG23  VAL  80          2HG2      VAL  80   0.763   6.616   3.618
  653    H    GLU  81           H        GLU  81  -4.005   8.034   4.830
  654    HA   GLU  81           HA       GLU  81  -3.017  10.539   5.764
  655    HB2  GLU  81           2HB      GLU  81  -5.811   9.691   4.921
  656    HB3  GLU  81           1HB      GLU  81  -5.364  11.355   5.284
  657    HG2  GLU  81           2HG      GLU  81  -4.209   9.646   3.075
  658    HG3  GLU  81           1HG      GLU  81  -5.406  10.923   2.867
  659    H    GLN  82           H        GLN  82  -5.279   8.152   7.090
  660    HA   GLN  82           HA       GLN  82  -6.195   9.600   9.351
  661    HB2  GLN  82           2HB      GLN  82  -5.836   6.586   9.027
  662    HB3  GLN  82           1HB      GLN  82  -6.721   7.342  10.348
  663    HG2  GLN  82           2HG      GLN  82  -7.450   7.521   7.419
  664    HG3  GLN  82           1HG      GLN  82  -8.196   6.448   8.599
  665   HE21  GLN  82          1HE2      GLN  82  -9.427   8.567   6.967
  666   HE22  GLN  82          2HE2      GLN  82 -10.169   9.659   8.080
  667    H    LEU  83           H        LEU  83  -3.447   7.434   8.884
  668    HA   LEU  83           HA       LEU  83  -2.537   7.350  11.551
  669    HB2  LEU  83           2HB      LEU  83  -0.898   6.944   9.028
  670    HB3  LEU  83           1HB      LEU  83  -0.451   6.436  10.651
  671    HG   LEU  83           HG       LEU  83  -2.742   5.321   8.995
  672   HD11  LEU  83          1HD1      LEU  83  -0.124   4.067   9.855
  673   HD12  LEU  83          2HD1      LEU  83  -0.555   4.579   8.221
  674   HD13  LEU  83          3HD1      LEU  83  -1.430   3.254   8.983
  675   HD21  LEU  83          3HD2      LEU  83  -1.870   4.525  11.795
  676   HD22  LEU  83          1HD2      LEU  83  -3.043   3.659  10.796
  677   HD23  LEU  83          2HD2      LEU  83  -3.396   5.291  11.348
  678    H    LYS  84           H        LYS  84  -1.633   9.433   8.811
  679    HA   LYS  84           HA       LYS  84   0.364  10.883  10.306
  680    HB2  LYS  84           2HB      LYS  84  -0.982  11.518   7.653
  681    HB3  LYS  84           1HB      LYS  84   0.374  12.427   8.323
  682    HG2  LYS  84           2HG      LYS  84   1.778  10.408   8.248
  683    HG3  LYS  84           1HG      LYS  84   0.426   9.484   7.602
  684    HD2  LYS  84           2HD      LYS  84   1.745  11.844   6.211
  685    HD3  LYS  84           1HD      LYS  84   2.074  10.148   5.866
  686    HE2  LYS  84           2HE      LYS  84   0.550  10.693   4.196
  687    HE3  LYS  84           1HE      LYS  84  -0.504   9.999   5.419
  688    HZ1  LYS  84           3HZ      LYS  84  -1.151  12.180   6.104
  689    HZ2  LYS  84           1HZ      LYS  84  -1.345  12.067   4.433
  690    HZ3  LYS  84           2HZ      LYS  84  -0.031  12.910   5.077
  691    H    ALA  85           H        ALA  85  -3.085  11.198   9.898
  692    HA   ALA  85           HA       ALA  85  -3.307  13.931  10.757
  693    HB1  ALA  85           3HB      ALA  85  -5.407  11.732  10.741
  694    HB2  ALA  85           1HB      ALA  85  -5.064  12.841   9.410
  695    HB3  ALA  85           2HB      ALA  85  -5.716  13.460  10.928
  696    H    GLU  86           H        GLU  86  -3.535  10.777  12.378
  697    HA   GLU  86           HA       GLU  86  -4.227  11.952  14.953
  698    HB2  GLU  86           2HB      GLU  86  -3.749   9.053  14.162
  699    HB3  GLU  86           1HB      GLU  86  -4.400   9.596  15.706
  700    HG2  GLU  86           2HG      GLU  86  -6.356  10.563  14.513
  701    HG3  GLU  86           1HG      GLU  86  -5.719   9.944  12.992
  702    H    SER  87           H        SER  87  -1.495  10.195  13.539
  703    HA   SER  87           HA       SER  87   0.010  10.189  16.040
  704    HB2  SER  87           2HB      SER  87   0.017   8.161  14.605
  705    HB3  SER  87           1HB      SER  87   0.777   9.072  13.305
  706    HG   SER  87           HG       SER  87   2.583   9.336  14.596
  707    H    ALA  88           H        ALA  88  -0.242  12.223  13.256
  708    HA   ALA  88           HA       ALA  88   2.067  13.825  14.213
  709    HB1  ALA  88           3HB      ALA  88   2.818  12.614  12.204
  710    HB2  ALA  88           1HB      ALA  88   2.701  14.347  11.885
  711    HB3  ALA  88           2HB      ALA  88   1.450  13.250  11.290
  712    H    LEU  89           H        LEU  89   1.956  16.018  13.006
  713    HA   LEU  89           HA       LEU  89  -0.803  17.037  12.877
  714    HB2  LEU  89           2HB      LEU  89  -0.121  19.068  14.009
  715    HB3  LEU  89           1HB      LEU  89   0.237  17.693  15.004
  716    HG   LEU  89           HG       LEU  89   2.014  19.171  15.425
  717   HD11  LEU  89          1HD1      LEU  89   3.180  17.350  13.311
  718   HD12  LEU  89          2HD1      LEU  89   2.915  16.935  15.007
  719   HD13  LEU  89          3HD1      LEU  89   4.081  18.187  14.578
  720   HD21  LEU  89          3HD2      LEU  89   2.296  19.770  12.461
  721   HD22  LEU  89          1HD2      LEU  89   3.327  20.424  13.735
  722   HD23  LEU  89          2HD2      LEU  89   1.616  20.844  13.685
  723    H    GLU  90           H        GLU  90   1.907  16.421  11.135
  724    HA   GLU  90           HA       GLU  90   1.604  18.723   9.297
  725    HB2  GLU  90           2HB      GLU  90   3.939  16.766   9.537
  726    HB3  GLU  90           1HB      GLU  90   3.884  18.209   8.527
  727    HG2  GLU  90           2HG      GLU  90   3.858  19.648  10.487
  728    HG3  GLU  90           1HG      GLU  90   3.748  18.251  11.559
  729   H281  4EM 101          2H28      PYA 142   0.689 -10.375   6.487
  730   H283  4EM 101          3H28      PYA 142   2.331 -10.744   7.002
  731   H303  4EM 101          3H30      PYA 142  -0.951 -11.946   9.434
  732   H301  4EM 101          1H30      PYA 142  -0.543 -12.815   7.941
  733   H302  4EM 101          2H30      PYA 142  -1.237 -11.191   7.872
  734   H312  4EM 101          2H31      PYA 142   0.447  -9.932  10.129
  735   H313  4EM 101          3H31      PYA 142   1.775  -9.399   9.104
  736   H311  4EM 101          1H31      PYA 142   0.103  -9.202   8.556
  737    H32  4EM 101           H32      PYA 142   1.717 -13.162   8.862
  738    H33  4EM 101           H33      PYA 142   3.447 -11.821   8.393
  739    H36  4EM 101           H36      PYA 142   0.083 -13.796  10.302
  740   H373  4EM 101          3H37      PYA 142  -0.130 -14.521  12.574
  741   H372  4EM 101          2H37      PYA 142   0.245 -12.887  13.116
  742   H382  4EM 101          2H38      PYA 142  -1.854 -12.067  12.121
  743   H383  4EM 101          3H38      PYA 142  -2.161 -13.320  13.326
  744    H41  4EM 101           H41      PYA 142  -3.864 -12.413  11.111
  745   H423  4EM 101          3H42      PYA 142  -5.224 -14.602  10.333
  746   H422  4EM 101          2H42      PYA 142  -3.948 -14.526   9.116
  747   H433  4EM 101          3H43      PYA 142  -5.944 -12.319   9.719
  748   H432  4EM 101          2H43      PYA 142  -6.011 -13.426   8.345
  749    H44  4EM 101           H44      PYA 142  -4.089 -12.571   7.546
  750    H49  4EM 101           H49      PYA 142  -2.774  -8.581   8.957
  751    H51  4EM 101           H51      PYA 142  -1.169  -8.198   6.921
  752    H50  4EM 101           H50      PYA 142  -1.684  -9.998   5.120
  753    H48  4EM 101           H48      PYA 142  -3.480 -11.537   6.124
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1   6.226  15.566  -0.882
    2    H2   MET   1           2H       MET   1   7.105  15.019   0.454
    3    H3   MET   1           3H       MET   1   6.097  16.369   0.596
    4    HA   MET   1           HA       MET   1   5.242  13.571   0.137
    5    HB2  MET   1           2HB      MET   1   5.903  14.083   2.474
    6    HB3  MET   1           1HB      MET   1   4.828  15.467   2.491
    7    HG2  MET   1           2HG      MET   1   2.896  13.861   2.172
    8    HG3  MET   1           1HG      MET   1   4.042  12.544   2.415
    9    HE1  MET   1           3HE      MET   1   5.291  13.496   6.117
   10    HE2  MET   1           1HE      MET   1   5.930  14.267   4.664
   11    HE3  MET   1           2HE      MET   1   5.647  12.527   4.690
   12    H    ASP   2           H        ASP   2   3.419  13.411  -1.041
   13    HA   ASP   2           HA       ASP   2   1.183  15.249  -0.615
   14    HB2  ASP   2           2HB      ASP   2   2.292  16.215  -2.625
   15    HB3  ASP   2           1HB      ASP   2   2.348  14.632  -3.389
   16    H    GLY   3           H        GLY   3  -0.779  14.219  -0.841
   17    HA2  GLY   3           2HA      GLY   3  -0.957  11.474  -0.349
   18    HA3  GLY   3           1HA      GLY   3  -2.286  12.509  -0.839
   19    H    GLU   4           H        GLU   4  -2.211  13.072  -3.292
   20    HA   GLU   4           HA       GLU   4  -2.779  10.815  -4.798
   21    HB2  GLU   4           2HB      GLU   4  -1.836  13.544  -5.716
   22    HB3  GLU   4           1HB      GLU   4  -2.522  12.328  -6.793
   23    HG2  GLU   4           2HG      GLU   4  -3.962  13.504  -4.400
   24    HG3  GLU   4           1HG      GLU   4  -4.146  14.058  -6.061
   25    H    GLU   5           H        GLU   5   0.236  12.580  -4.585
   26    HA   GLU   5           HA       GLU   5   1.771  11.357  -6.569
   27    HB2  GLU   5           2HB      GLU   5   2.297  13.459  -5.274
   28    HB3  GLU   5           1HB      GLU   5   2.718  12.456  -3.892
   29    HG2  GLU   5           2HG      GLU   5   4.699  13.238  -5.110
   30    HG3  GLU   5           1HG      GLU   5   4.578  11.481  -5.107
   31    H    VAL   6           H        VAL   6   1.481  10.542  -3.081
   32    HA   VAL   6           HA       VAL   6   3.570   8.519  -3.317
   33    HB   VAL   6           HB       VAL   6   3.280   8.144  -0.898
   34   HG11  VAL   6          1HG1      VAL   6   3.410  11.097  -1.588
   35   HG12  VAL   6          2HG1      VAL   6   4.764   9.963  -1.582
   36   HG13  VAL   6          3HG1      VAL   6   3.948  10.370  -0.071
   37   HG21  VAL   6          3HG2      VAL   6   1.689   9.513   0.444
   38   HG22  VAL   6          1HG2      VAL   6   0.846   8.435  -0.669
   39   HG23  VAL   6          2HG2      VAL   6   0.992  10.153  -1.044
   40    H    LYS   7           H        LYS   7   0.109   8.682  -3.201
   41    HA   LYS   7           HA       LYS   7  -0.514   6.048  -2.449
   42    HB2  LYS   7           2HB      LYS   7  -1.985   8.181  -4.014
   43    HB3  LYS   7           1HB      LYS   7  -2.727   6.608  -3.719
   44    HG2  LYS   7           2HG      LYS   7  -2.847   6.960  -1.391
   45    HG3  LYS   7           1HG      LYS   7  -1.657   8.265  -1.429
   46    HD2  LYS   7           2HD      LYS   7  -4.187   8.864  -1.114
   47    HD3  LYS   7           1HD      LYS   7  -3.206   9.844  -2.200
   48    HE2  LYS   7           2HE      LYS   7  -4.162   8.861  -4.124
   49    HE3  LYS   7           1HE      LYS   7  -4.901   7.543  -3.206
   50    HZ1  LYS   7           3HZ      LYS   7  -6.545   9.195  -3.807
   51    HZ2  LYS   7           1HZ      LYS   7  -5.648  10.418  -3.064
   52    HZ3  LYS   7           2HZ      LYS   7  -6.351   9.194  -2.129
   53    H    GLU   8           H        GLU   8  -0.327   7.467  -5.766
   54    HA   GLU   8           HA       GLU   8  -0.663   4.935  -7.040
   55    HB2  GLU   8           2HB      GLU   8   0.061   5.984  -9.111
   56    HB3  GLU   8           1HB      GLU   8  -1.098   7.006  -8.277
   57    HG2  GLU   8           2HG      GLU   8   0.528   8.625  -7.724
   58    HG3  GLU   8           1HG      GLU   8   1.871   7.513  -8.001
   59    H    LYS   9           H        LYS   9   2.152   6.716  -5.887
   60    HA   LYS   9           HA       LYS   9   4.214   5.152  -6.960
   61    HB2  LYS   9           2HB      LYS   9   4.038   6.836  -4.474
   62    HB3  LYS   9           1HB      LYS   9   5.517   5.970  -4.882
   63    HG2  LYS   9           2HG      LYS   9   5.814   7.237  -6.892
   64    HG3  LYS   9           1HG      LYS   9   4.199   7.947  -6.760
   65    HD2  LYS   9           2HD      LYS   9   6.159   9.429  -6.060
   66    HD3  LYS   9           1HD      LYS   9   4.815   9.299  -4.931
   67    HE2  LYS   9           2HE      LYS   9   6.081   7.715  -3.554
   68    HE3  LYS   9           1HE      LYS   9   7.425   7.755  -4.707
   69    HZ1  LYS   9           3HZ      LYS   9   7.952   9.183  -2.913
   70    HZ2  LYS   9           1HZ      LYS   9   6.454   9.959  -2.977
   71    HZ3  LYS   9           2HZ      LYS   9   7.569  10.199  -4.217
   72    H    ILE  10           H        ILE  10   2.176   4.550  -4.160
   73    HA   ILE  10           HA       ILE  10   3.512   2.373  -2.992
   74    HB   ILE  10           HB       ILE  10   0.508   2.673  -3.340
   75   HG12  ILE  10          2HG1      ILE  10   1.318   4.654  -2.211
   76   HG13  ILE  10          1HG1      ILE  10   0.513   3.642  -1.023
   77   HG21  ILE  10          1HG2      ILE  10   1.067   0.403  -2.672
   78   HG22  ILE  10          2HG2      ILE  10   0.281   1.245  -1.337
   79   HG23  ILE  10          3HG2      ILE  10   2.030   1.010  -1.325
   80   HD11  ILE  10          3HD1      ILE  10   3.487   3.991  -1.394
   81   HD12  ILE  10          1HD1      ILE  10   2.748   2.860  -0.249
   82   HD13  ILE  10          2HD1      ILE  10   2.495   4.596  -0.068
   83    H    ARG  11           H        ARG  11   1.061   2.430  -5.558
   84    HA   ARG  11           HA       ARG  11   0.944  -0.293  -6.226
   85    HB2  ARG  11           2HB      ARG  11   0.579   2.079  -8.099
   86    HB3  ARG  11           1HB      ARG  11   0.024   0.435  -8.399
   87    HG2  ARG  11           2HG      ARG  11  -1.513   0.620  -6.464
   88    HG3  ARG  11           1HG      ARG  11  -0.988   2.293  -6.231
   89    HD2  ARG  11           2HD      ARG  11  -2.409   1.143  -8.656
   90    HD3  ARG  11           1HD      ARG  11  -3.062   2.304  -7.494
   91    HE   ARG  11           HE       ARG  11  -0.739   3.416  -8.634
   92   HH11  ARG  11          1HH1      ARG  11  -3.990   2.566  -9.645
   93   HH12  ARG  11          2HH1      ARG  11  -4.041   3.759 -10.899
   94   HH21  ARG  11          1HH2      ARG  11  -0.796   4.960 -10.323
   95   HH22  ARG  11          2HH2      ARG  11  -2.236   5.117 -11.285
   96    H    ARG  12           H        ARG  12   3.027   2.277  -7.547
   97    HA   ARG  12           HA       ARG  12   4.279   0.866  -9.633
   98    HB2  ARG  12           2HB      ARG  12   5.059   3.270  -7.973
   99    HB3  ARG  12           1HB      ARG  12   6.263   2.571  -9.047
  100    HG2  ARG  12           2HG      ARG  12   5.053   4.515 -10.030
  101    HG3  ARG  12           1HG      ARG  12   4.931   3.040 -10.987
  102    HD2  ARG  12           2HD      ARG  12   2.684   2.681 -10.327
  103    HD3  ARG  12           1HD      ARG  12   2.793   3.871  -9.040
  104    HE   ARG  12           HE       ARG  12   2.867   5.610 -10.746
  105   HH11  ARG  12          1HH1      ARG  12   1.624   2.492 -11.760
  106   HH12  ARG  12          2HH1      ARG  12   0.700   3.157 -13.074
  107   HH21  ARG  12          1HH2      ARG  12   1.608   6.477 -12.364
  108   HH22  ARG  12          2HH2      ARG  12   0.691   5.433 -13.417
  109    H    TYR  13           H        TYR  13   5.386   1.445  -6.342
  110    HA   TYR  13           HA       TYR  13   7.725  -0.073  -6.301
  111    HB2  TYR  13           2HB      TYR  13   7.187   1.538  -4.556
  112    HB3  TYR  13           1HB      TYR  13   5.758   0.620  -4.070
  113    HD1  TYR  13           HD1      TYR  13   9.481   0.060  -4.480
  114    HD2  TYR  13           HD2      TYR  13   5.997  -0.676  -2.121
  115    HE1  TYR  13           HE1      TYR  13  10.855  -1.103  -2.808
  116    HE2  TYR  13           HE2      TYR  13   7.366  -1.829  -0.459
  117    HH   TYR  13           HH       TYR  13  10.733  -1.667  -0.387
  118    H    ILE  14           H        ILE  14   4.391  -1.057  -5.612
  119    HA   ILE  14           HA       ILE  14   4.861  -3.675  -4.687
  120    HB   ILE  14           HB       ILE  14   2.400  -2.492  -6.046
  121   HG12  ILE  14          2HG1      ILE  14   2.962  -3.021  -3.093
  122   HG13  ILE  14          1HG1      ILE  14   3.065  -1.444  -3.857
  123   HG21  ILE  14          1HG2      ILE  14   1.141  -4.407  -5.094
  124   HG22  ILE  14          2HG2      ILE  14   2.659  -5.121  -4.548
  125   HG23  ILE  14          3HG2      ILE  14   2.340  -4.932  -6.273
  126   HD11  ILE  14          3HD1      ILE  14   0.580  -3.112  -3.524
  127   HD12  ILE  14          1HD1      ILE  14   0.659  -1.556  -4.360
  128   HD13  ILE  14          2HD1      ILE  14   1.015  -1.654  -2.636
  129    H    MET  15           H        MET  15   4.121  -2.482  -7.978
  130    HA   MET  15           HA       MET  15   4.114  -5.048  -9.231
  131    HB2  MET  15           2HB      MET  15   4.633  -2.326 -10.520
  132    HB3  MET  15           1HB      MET  15   4.172  -3.804 -11.363
  133    HG2  MET  15           2HG      MET  15   2.484  -2.296  -9.368
  134    HG3  MET  15           1HG      MET  15   2.274  -2.300 -11.115
  135    HE1  MET  15           3HE      MET  15   0.863  -5.806 -11.873
  136    HE2  MET  15           1HE      MET  15   2.526  -5.249 -12.071
  137    HE3  MET  15           2HE      MET  15   1.181  -4.179 -12.469
  138    H    GLU  16           H        GLU  16   6.693  -2.685  -8.619
  139    HA   GLU  16           HA       GLU  16   8.643  -3.779 -10.404
  140    HB2  GLU  16           2HB      GLU  16   9.011  -1.992  -7.967
  141    HB3  GLU  16           1HB      GLU  16  10.285  -2.377  -9.119
  142    HG2  GLU  16           2HG      GLU  16   9.046  -1.247 -10.897
  143    HG3  GLU  16           1HG      GLU  16   7.737  -0.876  -9.767
  144    H    ASP  17           H        ASP  17   8.464  -3.810  -6.838
  145    HA   ASP  17           HA       ASP  17  10.630  -5.763  -6.670
  146    HB2  ASP  17           2HB      ASP  17  10.734  -3.823  -5.168
  147    HB3  ASP  17           1HB      ASP  17   9.142  -4.196  -4.528
  148    H    LEU  18           H        LEU  18   7.353  -5.402  -5.355
  149    HA   LEU  18           HA       LEU  18   7.327  -7.836  -3.933
  150    HB2  LEU  18           2HB      LEU  18   5.087  -5.988  -4.795
  151    HB3  LEU  18           1HB      LEU  18   4.812  -7.389  -3.786
  152    HG   LEU  18           HG       LEU  18   6.285  -6.388  -2.024
  153   HD11  LEU  18          1HD1      LEU  18   7.729  -4.929  -3.383
  154   HD12  LEU  18          2HD1      LEU  18   6.925  -4.013  -2.111
  155   HD13  LEU  18          3HD1      LEU  18   6.342  -3.909  -3.771
  156   HD21  LEU  18          3HD2      LEU  18   3.860  -6.082  -1.913
  157   HD22  LEU  18          1HD2      LEU  18   3.989  -4.622  -2.899
  158   HD23  LEU  18          2HD2      LEU  18   4.702  -4.666  -1.288
  159    H    ILE  19           H        ILE  19   5.884  -6.979  -7.086
  160    HA   ILE  19           HA       ILE  19   5.053  -9.687  -7.670
  161    HB   ILE  19           HB       ILE  19   5.057  -7.145  -9.324
  162   HG12  ILE  19          2HG1      ILE  19   2.603  -7.492  -9.437
  163   HG13  ILE  19          1HG1      ILE  19   2.768  -8.972  -8.517
  164   HG21  ILE  19          1HG2      ILE  19   5.689  -8.907 -10.894
  165   HG22  ILE  19          2HG2      ILE  19   4.035  -8.383 -11.214
  166   HG23  ILE  19          3HG2      ILE  19   4.329  -9.900 -10.361
  167   HD11  ILE  19          3HD1      ILE  19   3.312  -6.192  -7.538
  168   HD12  ILE  19          1HD1      ILE  19   3.528  -7.671  -6.594
  169   HD13  ILE  19          2HD1      ILE  19   1.924  -7.210  -7.151
  170    H    GLY  20           H        GLY  20   7.427  -7.479  -9.200
  171    HA2  GLY  20           2HA      GLY  20   9.773  -8.648  -9.233
  172    HA3  GLY  20           1HA      GLY  20   8.928  -9.810 -10.251
  173    HA   PRO  21           HA       PRO  21  10.914  -6.246 -12.697
  174    HB2  PRO  21           2HB      PRO  21  12.373  -7.812 -14.454
  175    HB3  PRO  21           1HB      PRO  21  12.981  -7.333 -12.857
  176    HG2  PRO  21           2HG      PRO  21  11.685  -9.916 -13.673
  177    HG3  PRO  21           1HG      PRO  21  13.153  -9.645 -12.699
  178    HD2  PRO  21           2HD      PRO  21  10.795 -10.195 -11.517
  179    HD3  PRO  21           1HD      PRO  21  11.952  -9.060 -10.788
  180    H    SER  22           H        SER  22   9.089  -9.088 -13.584
  181    HA   SER  22           HA       SER  22   8.483  -8.273 -16.270
  182    HB2  SER  22           2HB      SER  22   6.736 -10.104 -16.112
  183    HB3  SER  22           1HB      SER  22   8.383 -10.635 -15.776
  184    HG   SER  22           HG       SER  22   6.642 -11.326 -14.291
  185    H    ALA  23           H        ALA  23   6.228  -8.736 -13.539
  186    HA   ALA  23           HA       ALA  23   4.380  -7.736 -12.796
  187    HB1  ALA  23           3HB      ALA  23   5.837  -5.801 -12.431
  188    HB2  ALA  23           1HB      ALA  23   4.195  -5.291 -12.832
  189    HB3  ALA  23           2HB      ALA  23   5.474  -5.205 -14.051
  190    H    LYS  24           H        LYS  24   2.276  -7.711 -13.411
  191    HA   LYS  24           HA       LYS  24   1.646  -7.364 -16.287
  192    HB2  LYS  24           2HB      LYS  24   0.035  -8.852 -14.191
  193    HB3  LYS  24           1HB      LYS  24  -0.317  -8.766 -15.916
  194    HG2  LYS  24           2HG      LYS  24   1.925  -9.926 -16.290
  195    HG3  LYS  24           1HG      LYS  24   1.979 -10.183 -14.553
  196    HD2  LYS  24           2HD      LYS  24  -0.067 -11.293 -16.504
  197    HD3  LYS  24           1HD      LYS  24   1.169 -12.193 -15.632
  198    HE2  LYS  24           2HE      LYS  24  -0.663 -12.668 -14.320
  199    HE3  LYS  24           1HE      LYS  24  -0.092 -11.213 -13.509
  200    HZ1  LYS  24           3HZ      LYS  24  -2.239 -11.295 -15.554
  201    HZ2  LYS  24           1HZ      LYS  24  -1.728  -9.928 -14.699
  202    HZ3  LYS  24           2HZ      LYS  24  -2.477 -11.196 -13.881
  203    H    GLU  25           H        GLU  25   1.023  -5.314 -16.553
  204    HA   GLU  25           HA       GLU  25   0.092  -3.688 -14.347
  205    HB2  GLU  25           2HB      GLU  25   0.280  -2.703 -17.221
  206    HB3  GLU  25           1HB      GLU  25   0.395  -1.785 -15.725
  207    HG2  GLU  25           2HG      GLU  25   2.629  -1.832 -16.201
  208    HG3  GLU  25           1HG      GLU  25   2.543  -3.384 -15.366
  209    H    ASP  26           H        ASP  26  -1.453  -5.677 -16.445
  210    HA   ASP  26           HA       ASP  26  -3.683  -4.399 -17.467
  211    HB2  ASP  26           2HB      ASP  26  -3.533  -7.273 -16.454
  212    HB3  ASP  26           1HB      ASP  26  -4.690  -6.649 -17.621
  213    H    GLU  27           H        GLU  27  -3.247  -5.995 -14.328
  214    HA   GLU  27           HA       GLU  27  -5.964  -5.256 -13.448
  215    HB2  GLU  27           2HB      GLU  27  -5.302  -6.534 -11.350
  216    HB3  GLU  27           1HB      GLU  27  -5.436  -7.468 -12.830
  217    HG2  GLU  27           2HG      GLU  27  -2.696  -6.460 -12.230
  218    HG3  GLU  27           1HG      GLU  27  -3.340  -7.632 -11.088
  219    H    LEU  28           H        LEU  28  -2.899  -3.845 -13.386
  220    HA   LEU  28           HA       LEU  28  -2.869  -2.838 -10.744
  221    HB2  LEU  28           2HB      LEU  28  -0.871  -3.100 -12.267
  222    HB3  LEU  28           1HB      LEU  28  -1.414  -1.693 -13.156
  223    HG   LEU  28           HG       LEU  28   0.470  -1.348 -11.417
  224   HD11  LEU  28          1HD1      LEU  28  -0.736   0.588 -12.380
  225   HD12  LEU  28          2HD1      LEU  28  -0.298   0.869 -10.696
  226   HD13  LEU  28          3HD1      LEU  28  -1.959   0.448 -11.114
  227   HD21  LEU  28          3HD2      LEU  28  -1.836  -1.564  -9.440
  228   HD22  LEU  28          1HD2      LEU  28  -0.182  -1.081  -9.065
  229   HD23  LEU  28          2HD2      LEU  28  -0.513  -2.724  -9.604
  230    H    ASP  29           H        ASP  29  -4.290  -1.508  -9.974
  231    HA   ASP  29           HA       ASP  29  -5.200   0.921 -11.267
  232    HB2  ASP  29           2HB      ASP  29  -6.705  -0.958 -12.123
  233    HB3  ASP  29           1HB      ASP  29  -7.177  -1.242 -10.448
  234    H    ASP  30           H        ASP  30  -6.740   2.045  -9.678
  235    HA   ASP  30           HA       ASP  30  -5.499   1.946  -7.070
  236    HB2  ASP  30           2HB      ASP  30  -6.617   4.049  -6.619
  237    HB3  ASP  30           1HB      ASP  30  -5.894   4.116  -8.220
  238    H    GLN  31           H        GLN  31  -8.590   1.161  -8.479
  239    HA   GLN  31           HA       GLN  31  -9.794   0.556  -5.863
  240    HB2  GLN  31           2HB      GLN  31 -10.984   0.838  -8.657
  241    HB3  GLN  31           1HB      GLN  31 -11.925   0.428  -7.221
  242    HG2  GLN  31           2HG      GLN  31 -11.606   2.553  -6.245
  243    HG3  GLN  31           1HG      GLN  31 -10.254   2.946  -7.301
  244   HE21  GLN  31          1HE2      GLN  31 -10.668   3.668  -9.406
  245   HE22  GLN  31          2HE2      GLN  31 -12.224   4.263  -9.877
  246    H    THR  32           H        THR  32  -8.130  -1.113  -8.323
  247    HA   THR  32           HA       THR  32  -9.491  -3.635  -8.228
  248    HB   THR  32           HB       THR  32  -6.596  -2.995  -8.893
  249    HG1  THR  32           HG1      THR  32  -7.304  -3.290 -10.994
  250   HG21  THR  32          3HG2      THR  32  -6.429  -5.287  -9.847
  251   HG22  THR  32          1HG2      THR  32  -8.023  -5.676  -9.192
  252   HG23  THR  32          2HG2      THR  32  -6.677  -5.339  -8.100
  253    HA   PRO  33           HA       PRO  33  -8.206  -4.594  -3.977
  254    HB2  PRO  33           2HB      PRO  33  -9.237  -7.174  -3.925
  255    HB3  PRO  33           1HB      PRO  33 -10.188  -5.708  -3.617
  256    HG2  PRO  33           2HG      PRO  33 -10.039  -7.369  -6.081
  257    HG3  PRO  33           1HG      PRO  33 -11.420  -6.505  -5.375
  258    HD2  PRO  33           2HD      PRO  33 -10.008  -5.570  -7.520
  259    HD3  PRO  33           1HD      PRO  33 -10.869  -4.513  -6.387
  260    H    LEU  34           H        LEU  34  -6.086  -4.770  -3.928
  261    HA   LEU  34           HA       LEU  34  -4.485  -6.234  -5.723
  262    HB2  LEU  34           2HB      LEU  34  -3.710  -4.986  -3.063
  263    HB3  LEU  34           1HB      LEU  34  -2.615  -5.404  -4.370
  264    HG   LEU  34           HG       LEU  34  -4.768  -3.252  -4.545
  265   HD11  LEU  34          1HD1      LEU  34  -3.020  -2.580  -2.974
  266   HD12  LEU  34          2HD1      LEU  34  -2.935  -1.624  -4.452
  267   HD13  LEU  34          3HD1      LEU  34  -1.777  -2.929  -4.180
  268   HD21  LEU  34          3HD2      LEU  34  -3.625  -2.570  -6.636
  269   HD22  LEU  34          1HD2      LEU  34  -4.279  -4.203  -6.752
  270   HD23  LEU  34          2HD2      LEU  34  -2.550  -3.963  -6.500
  271    H    LEU  35           H        LEU  35  -5.472  -6.841  -2.354
  272    HA   LEU  35           HA       LEU  35  -3.953  -9.158  -1.808
  273    HB2  LEU  35           2HB      LEU  35  -6.746  -8.401  -0.892
  274    HB3  LEU  35           1HB      LEU  35  -5.819  -9.728  -0.204
  275    HG   LEU  35           HG       LEU  35  -4.925  -6.825  -0.097
  276   HD11  LEU  35          1HD1      LEU  35  -6.320  -8.472   2.027
  277   HD12  LEU  35          2HD1      LEU  35  -7.033  -7.131   1.128
  278   HD13  LEU  35          3HD1      LEU  35  -5.685  -6.836   2.222
  279   HD21  LEU  35          3HD2      LEU  35  -3.095  -8.493   0.113
  280   HD22  LEU  35          1HD2      LEU  35  -3.957  -9.257   1.450
  281   HD23  LEU  35          2HD2      LEU  35  -3.358  -7.603   1.610
  282    H    GLU  36           H        GLU  36  -7.174  -8.767  -3.215
  283    HA   GLU  36           HA       GLU  36  -7.814 -11.548  -3.219
  284    HB2  GLU  36           2HB      GLU  36  -9.196  -9.369  -4.811
  285    HB3  GLU  36           1HB      GLU  36  -9.881 -10.897  -4.270
  286    HG2  GLU  36           2HG      GLU  36  -9.087  -8.559  -2.512
  287    HG3  GLU  36           1HG      GLU  36 -10.722  -9.020  -2.945
  288    H    TRP  37           H        TRP  37  -6.253  -9.391  -5.465
  289    HA   TRP  37           HA       TRP  37  -6.416 -11.383  -7.667
  290    HB2  TRP  37           2HB      TRP  37  -5.495  -8.486  -7.640
  291    HB3  TRP  37           1HB      TRP  37  -5.380  -9.526  -9.053
  292    HD1  TRP  37           HD1      TRP  37  -8.371  -8.812  -6.635
  293    HE1  TRP  37           HE1      TRP  37 -10.397  -8.132  -8.022
  294    HE3  TRP  37           HE3      TRP  37  -6.281  -9.060 -11.289
  295    HZ2  TRP  37           HZ2      TRP  37 -11.069  -7.742 -10.738
  296    HZ3  TRP  37           HZ3      TRP  37  -7.689  -8.523 -13.236
  297    HH2  TRP  37           HH2      TRP  37 -10.032  -7.880 -12.969
  298    H    GLY  38           H        GLY  38  -4.630 -11.373  -5.085
  299    HA2  GLY  38           2HA      GLY  38  -2.689 -12.447  -4.546
  300    HA3  GLY  38           1HA      GLY  38  -2.595 -12.993  -6.211
  301    H    ILE  39           H        ILE  39  -2.656  -9.623  -5.491
  302    HA   ILE  39           HA       ILE  39  -0.028  -9.170  -6.685
  303    HB   ILE  39           HB       ILE  39  -2.200  -7.240  -5.716
  304   HG12  ILE  39          2HG1      ILE  39  -1.526  -8.110  -8.560
  305   HG13  ILE  39          1HG1      ILE  39  -2.914  -8.669  -7.638
  306   HG21  ILE  39          1HG2      ILE  39  -1.050  -5.456  -6.937
  307   HG22  ILE  39          2HG2      ILE  39   0.233  -6.577  -7.393
  308   HG23  ILE  39          3HG2      ILE  39   0.003  -6.146  -5.699
  309   HD11  ILE  39          3HD1      ILE  39  -3.612  -7.024  -9.217
  310   HD12  ILE  39          1HD1      ILE  39  -2.405  -5.875  -8.641
  311   HD13  ILE  39          2HD1      ILE  39  -3.756  -6.334  -7.601
  312    H    LEU  40           H        LEU  40  -1.697  -9.024  -3.589
  313    HA   LEU  40           HA       LEU  40   0.818  -8.348  -2.192
  314    HB2  LEU  40           2HB      LEU  40  -2.033  -8.073  -1.187
  315    HB3  LEU  40           1HB      LEU  40  -0.580  -7.634  -0.290
  316    HG   LEU  40           HG       LEU  40  -1.575  -6.287  -2.837
  317   HD11  LEU  40          1HD1      LEU  40  -2.979  -5.741  -0.934
  318   HD12  LEU  40          2HD1      LEU  40  -2.003  -4.344  -1.389
  319   HD13  LEU  40          3HD1      LEU  40  -1.560  -5.300   0.028
  320   HD21  LEU  40          3HD2      LEU  40   0.860  -6.261  -2.768
  321   HD22  LEU  40          1HD2      LEU  40   0.835  -5.635  -1.115
  322   HD23  LEU  40          2HD2      LEU  40   0.230  -4.648  -2.448
  323    H    ASN  41           H        ASN  41   1.029  -9.288  -0.058
  324    HA   ASN  41           HA       ASN  41  -0.077 -11.781   0.743
  325    HB2  ASN  41           2HB      ASN  41   1.232 -12.610  -1.220
  326    HB3  ASN  41           1HB      ASN  41   2.687 -11.844  -0.600
  327   HD21  ASN  41          1HD2      ASN  41   3.757 -12.789   1.168
  328   HD22  ASN  41          2HD2      ASN  41   3.436 -14.406   1.697
  329    H    SER  42           H        SER  42   1.029 -12.481   2.791
  330    HA   SER  42           HA       SER  42   1.488 -10.443   4.582
  331    HB2  SER  42           3HB      SER  42   2.174 -13.375   4.620
  332    HB3  SER  42           2HB      SER  42   2.883 -12.381   5.890
  333    H    MET  43           H        MET  43   4.079 -12.310   2.985
  334    HA   MET  43           HA       MET  43   6.195 -10.956   4.351
  335    HB2  MET  43           2HB      MET  43   6.359 -12.679   1.869
  336    HB3  MET  43           1HB      MET  43   7.718 -12.215   2.885
  337    HG2  MET  43           2HG      MET  43   5.393 -13.963   3.744
  338    HG3  MET  43           1HG      MET  43   6.985 -14.544   3.281
  339    HE1  MET  43           3HE      MET  43   4.724 -13.604   6.249
  340    HE2  MET  43           1HE      MET  43   5.258 -11.969   5.842
  341    HE3  MET  43           2HE      MET  43   5.782 -12.726   7.350
  342    H    ASN  44           H        ASN  44   4.514 -10.275   1.366
  343    HA   ASN  44           HA       ASN  44   6.581  -8.359   0.531
  344    HB2  ASN  44           2HB      ASN  44   5.458  -8.119  -1.549
  345    HB3  ASN  44           1HB      ASN  44   5.475  -9.827  -1.175
  346   HD21  ASN  44          1HD2      ASN  44   3.803 -10.251  -2.632
  347   HD22  ASN  44          2HD2      ASN  44   2.177  -9.765  -2.371
  348    H    ILE  45           H        ILE  45   3.652  -8.430   2.254
  349    HA   ILE  45           HA       ILE  45   2.772  -5.750   2.002
  350    HB   ILE  45           HB       ILE  45   2.095  -8.127   3.613
  351   HG12  ILE  45          2HG1      ILE  45   0.408  -5.788   2.655
  352   HG13  ILE  45          1HG1      ILE  45   0.671  -7.293   1.781
  353   HG21  ILE  45          1HG2      ILE  45   2.765  -6.728   5.528
  354   HG22  ILE  45          2HG2      ILE  45   1.027  -7.058   5.535
  355   HG23  ILE  45          3HG2      ILE  45   1.620  -5.482   5.009
  356   HD11  ILE  45          3HD1      ILE  45  -1.489  -7.330   2.786
  357   HD12  ILE  45          1HD1      ILE  45  -0.819  -6.922   4.367
  358   HD13  ILE  45          2HD1      ILE  45  -0.462  -8.492   3.634
  359    H    VAL  46           H        VAL  46   5.205  -7.303   3.915
  360    HA   VAL  46           HA       VAL  46   5.612  -5.332   5.912
  361    HB   VAL  46           HB       VAL  46   7.624  -7.347   4.855
  362   HG11  VAL  46          1HG1      VAL  46   8.598  -7.199   7.128
  363   HG12  VAL  46          2HG1      VAL  46   7.401  -5.971   7.550
  364   HG13  VAL  46          3HG1      VAL  46   8.614  -5.634   6.313
  365   HG21  VAL  46          3HG2      VAL  46   6.828  -8.882   6.623
  366   HG22  VAL  46          1HG2      VAL  46   5.542  -8.508   5.474
  367   HG23  VAL  46          2HG2      VAL  46   5.562  -7.731   7.058
  368    H    LYS  47           H        LYS  47   6.583  -5.582   2.601
  369    HA   LYS  47           HA       LYS  47   8.760  -3.764   2.527
  370    HB2  LYS  47           2HB      LYS  47   6.807  -4.726   0.416
  371    HB3  LYS  47           1HB      LYS  47   8.005  -3.496   0.046
  372    HG2  LYS  47           2HG      LYS  47   8.780  -5.665  -0.693
  373    HG3  LYS  47           1HG      LYS  47   9.810  -5.057   0.604
  374    HD2  LYS  47           2HD      LYS  47   8.729  -6.542   2.211
  375    HD3  LYS  47           1HD      LYS  47   7.580  -7.076   0.986
  376    HE2  LYS  47           2HE      LYS  47   9.286  -8.767   1.275
  377    HE3  LYS  47           1HE      LYS  47   9.470  -8.032  -0.319
  378    HZ1  LYS  47           3HZ      LYS  47  11.595  -8.261   0.667
  379    HZ2  LYS  47           1HZ      LYS  47  11.101  -7.497   2.094
  380    HZ3  LYS  47           2HZ      LYS  47  11.221  -6.618   0.654
  381    H    LEU  48           H        LEU  48   5.243  -3.349   2.365
  382    HA   LEU  48           HA       LEU  48   5.256  -0.577   1.685
  383    HB2  LEU  48           2HB      LEU  48   3.081  -2.239   3.023
  384    HB3  LEU  48           1HB      LEU  48   2.876  -0.555   2.564
  385    HG   LEU  48           HG       LEU  48   1.837  -1.769   0.833
  386   HD11  LEU  48          1HD1      LEU  48   3.268   0.033  -0.056
  387   HD12  LEU  48          2HD1      LEU  48   3.147  -1.300  -1.200
  388   HD13  LEU  48          3HD1      LEU  48   4.613  -1.102  -0.238
  389   HD21  LEU  48          3HD2      LEU  48   2.701  -4.011   1.347
  390   HD22  LEU  48          1HD2      LEU  48   4.253  -3.590   0.617
  391   HD23  LEU  48          2HD2      LEU  48   2.796  -3.664  -0.377
  392    H    MET  49           H        MET  49   5.500  -2.290   4.733
  393    HA   MET  49           HA       MET  49   4.819  -0.174   6.503
  394    HB2  MET  49           2HB      MET  49   6.775  -2.436   7.083
  395    HB3  MET  49           1HB      MET  49   5.900  -1.474   8.265
  396    HG2  MET  49           2HG      MET  49   3.805  -2.491   7.625
  397    HG3  MET  49           1HG      MET  49   4.591  -3.355   6.295
  398    HE1  MET  49           3HE      MET  49   3.959  -6.396   8.651
  399    HE2  MET  49           1HE      MET  49   3.936  -5.819   6.985
  400    HE3  MET  49           2HE      MET  49   2.873  -5.088   8.186
  401    H    VAL  50           H        VAL  50   7.988  -1.362   5.361
  402    HA   VAL  50           HA       VAL  50   9.503   0.759   6.570
  403    HB   VAL  50           HB       VAL  50  10.498  -1.476   6.122
  404   HG11  VAL  50          1HG1      VAL  50  10.410  -0.697   3.178
  405   HG12  VAL  50          2HG1      VAL  50   9.493  -2.000   3.944
  406   HG13  VAL  50          3HG1      VAL  50  11.251  -2.102   3.845
  407   HG21  VAL  50          3HG2      VAL  50  12.705  -0.709   5.310
  408   HG22  VAL  50          1HG2      VAL  50  12.007   0.441   6.455
  409   HG23  VAL  50          2HG2      VAL  50  11.973   0.786   4.725
  410    H    TYR  51           H        TYR  51   7.956   0.300   3.460
  411    HA   TYR  51           HA       TYR  51   9.292   2.228   1.893
  412    HB2  TYR  51           2HB      TYR  51   7.641   0.531   1.008
  413    HB3  TYR  51           1HB      TYR  51   6.347   1.469   1.724
  414    HD1  TYR  51           HD1      TYR  51   9.105   1.673  -0.797
  415    HD2  TYR  51           HD2      TYR  51   5.391   3.303   0.539
  416    HE1  TYR  51           HE1      TYR  51   8.945   2.999  -2.865
  417    HE2  TYR  51           HE2      TYR  51   5.228   4.621  -1.523
  418    HH   TYR  51           HH       TYR  51   6.898   4.084  -4.240
  419    H    ILE  52           H        ILE  52   6.216   2.461   3.564
  420    HA   ILE  52           HA       ILE  52   5.771   5.232   3.138
  421    HB   ILE  52           HB       ILE  52   4.498   3.265   5.089
  422   HG12  ILE  52          2HG1      ILE  52   3.423   4.119   2.369
  423   HG13  ILE  52          1HG1      ILE  52   4.450   2.704   2.563
  424   HG21  ILE  52          1HG2      ILE  52   2.578   4.769   5.176
  425   HG22  ILE  52          2HG2      ILE  52   3.387   5.897   4.091
  426   HG23  ILE  52          3HG2      ILE  52   4.031   5.616   5.704
  427   HD11  ILE  52          3HD1      ILE  52   1.750   3.126   3.825
  428   HD12  ILE  52          1HD1      ILE  52   2.791   1.714   4.051
  429   HD13  ILE  52          2HD1      ILE  52   2.137   2.081   2.456
  430    H    ARG  53           H        ARG  53   7.286   3.375   5.715
  431    HA   ARG  53           HA       ARG  53   7.583   5.366   7.673
  432    HB2  ARG  53           2HB      ARG  53   8.085   3.057   8.222
  433    HB3  ARG  53           1HB      ARG  53   9.323   2.975   6.969
  434    HG2  ARG  53           2HG      ARG  53  10.352   3.119   9.178
  435    HG3  ARG  53           1HG      ARG  53  10.728   4.550   8.220
  436    HD2  ARG  53           2HD      ARG  53   8.698   5.639   9.468
  437    HD3  ARG  53           1HD      ARG  53   8.887   4.301  10.609
  438    HE   ARG  53           HE       ARG  53  11.387   5.223  10.520
  439   HH11  ARG  53          1HH1      ARG  53   8.373   7.001  10.840
  440   HH12  ARG  53          2HH1      ARG  53   9.103   8.301  11.731
  441   HH21  ARG  53          1HH2      ARG  53  12.325   6.920  11.660
  442   HH22  ARG  53          2HH2      ARG  53  11.349   8.252  12.198
  443    H    ASP  54           H        ASP  54   9.731   4.525   4.946
  444    HA   ASP  54           HA       ASP  54  11.675   6.606   5.465
  445    HB2  ASP  54           2HB      ASP  54  12.351   4.519   4.371
  446    HB3  ASP  54           1HB      ASP  54  11.190   4.766   3.073
  447    H    GLU  55           H        GLU  55   8.822   6.250   3.503
  448    HA   GLU  55           HA       GLU  55   9.279   8.442   1.702
  449    HB2  GLU  55           2HB      GLU  55   7.986   6.448   1.060
  450    HB3  GLU  55           1HB      GLU  55   6.814   6.770   2.326
  451    HG2  GLU  55           2HG      GLU  55   5.923   7.355   0.144
  452    HG3  GLU  55           1HG      GLU  55   6.057   8.776   1.170
  453    H    MET  56           H        MET  56   6.829   7.904   4.223
  454    HA   MET  56           HA       MET  56   6.291  10.815   4.359
  455    HB2  MET  56           2HB      MET  56   4.458   8.402   4.537
  456    HB3  MET  56           1HB      MET  56   3.953   9.976   5.137
  457    HG2  MET  56           2HG      MET  56   4.029  10.943   2.976
  458    HG3  MET  56           1HG      MET  56   4.896   9.568   2.292
  459    HE1  MET  56           3HE      MET  56   3.810   7.533   1.266
  460    HE2  MET  56           1HE      MET  56   2.255   6.882   1.782
  461    HE3  MET  56           2HE      MET  56   3.592   6.976   2.927
  462    H    GLY  57           H        GLY  57   7.848   8.561   6.081
  463    HA2  GLY  57           2HA      GLY  57   8.707   8.650   8.203
  464    HA3  GLY  57           1HA      GLY  57   7.797  10.126   8.484
  465    H    VAL  58           H        VAL  58   5.999   7.325   7.465
  466    HA   VAL  58           HA       VAL  58   5.135   6.816  10.259
  467    HB   VAL  58           HB       VAL  58   3.494   8.414   9.427
  468   HG11  VAL  58          1HG1      VAL  58   3.074   6.618   7.021
  469   HG12  VAL  58          2HG1      VAL  58   3.836   8.208   6.994
  470   HG13  VAL  58          3HG1      VAL  58   2.124   8.053   7.399
  471   HG21  VAL  58          3HG2      VAL  58   2.293   5.638   9.304
  472   HG22  VAL  58          1HG2      VAL  58   1.405   7.133   9.614
  473   HG23  VAL  58          2HG2      VAL  58   2.605   6.555  10.777
  474    H    SER  59           H        SER  59   5.337   4.663  10.635
  475    HA   SER  59           HA       SER  59   4.841   2.731   8.458
  476    HB2  SER  59           2HB      SER  59   6.972   2.432   9.693
  477    HB3  SER  59           1HB      SER  59   6.087   2.316  11.214
  478    HG   SER  59           HG       SER  59   5.119   0.413  10.457
  479    H    ILE  60           H        ILE  60   3.161   1.282   8.625
  480    HA   ILE  60           HA       ILE  60   0.987   1.818  10.421
  481    HB   ILE  60           HB       ILE  60   1.314  -0.666   8.680
  482   HG12  ILE  60          2HG1      ILE  60   0.246   2.080   7.970
  483   HG13  ILE  60          1HG1      ILE  60   1.384   1.085   7.074
  484   HG21  ILE  60          1HG2      ILE  60  -1.186   0.590   9.883
  485   HG22  ILE  60          2HG2      ILE  60  -0.369  -0.850  10.490
  486   HG23  ILE  60          3HG2      ILE  60  -1.127  -0.878   8.901
  487   HD11  ILE  60          3HD1      ILE  60  -0.801   1.226   5.997
  488   HD12  ILE  60          1HD1      ILE  60  -1.552   0.496   7.421
  489   HD13  ILE  60          2HD1      ILE  60  -0.394  -0.428   6.455
  490    HA   PRO  61           HA       PRO  61   2.579  -0.872  13.766
  491    HB2  PRO  61           2HB      PRO  61   0.146  -1.038  15.168
  492    HB3  PRO  61           1HB      PRO  61   1.330   0.268  15.358
  493    HG2  PRO  61           2HG      PRO  61  -1.167   0.226  13.721
  494    HG3  PRO  61           1HG      PRO  61  -0.488   1.533  14.714
  495    HD2  PRO  61           2HD      PRO  61  -0.242   1.540  12.035
  496    HD3  PRO  61           1HD      PRO  61   1.054   2.161  13.082
  497    H    SER  62           H        SER  62   2.333  -3.069  14.375
  498    HA   SER  62           HA       SER  62   1.731  -4.736  12.185
  499    HB2  SER  62           2HB      SER  62   2.368  -6.569  13.823
  500    HB3  SER  62           1HB      SER  62   3.552  -5.276  13.639
  501    HG   SER  62           HG       SER  62   2.720  -6.079  15.872
  502    H    THR  63           H        THR  63  -0.137  -3.875  14.991
  503    HA   THR  63           HA       THR  63  -2.127  -5.915  14.839
  504    HB   THR  63           HB       THR  63  -1.733  -4.691  16.910
  505    HG1  THR  63           HG1      THR  63  -4.344  -4.219  15.853
  506   HG21  THR  63          3HG2      THR  63  -2.384  -2.336  17.208
  507   HG22  THR  63          1HG2      THR  63  -2.806  -2.216  15.501
  508   HG23  THR  63          2HG2      THR  63  -1.127  -2.478  15.979
  509    H    HIS  64           H        HIS  64  -1.682  -2.830  13.265
  510    HA   HIS  64           HA       HIS  64  -4.401  -2.666  12.183
  511    HB2  HIS  64           2HB      HIS  64  -3.014  -0.684  13.074
  512    HB3  HIS  64           1HB      HIS  64  -2.038  -0.839  11.625
  513    HD1  HIS  64           HD1      HIS  64  -5.134   0.642  12.927
  514    HD2  HIS  64           HD2      HIS  64  -3.465  -0.118   9.204
  515    HE1  HIS  64           HE1      HIS  64  -6.394   2.096  11.324
  516    HE2  HIS  64           HE2      HIS  64  -5.483   1.485   9.052
  517    H    ILE  65           H        ILE  65  -1.635  -4.358  11.401
  518    HA   ILE  65           HA       ILE  65  -1.836  -4.197   8.520
  519    HB   ILE  65           HB       ILE  65  -0.375  -6.287  10.184
  520   HG12  ILE  65          2HG1      ILE  65   0.458  -4.012  10.706
  521   HG13  ILE  65          1HG1      ILE  65   1.667  -4.956   9.843
  522   HG21  ILE  65          1HG2      ILE  65   0.949  -6.651   8.116
  523   HG22  ILE  65          2HG2      ILE  65  -0.081  -5.497   7.264
  524   HG23  ILE  65          3HG2      ILE  65  -0.763  -7.003   7.880
  525   HD11  ILE  65          3HD1      ILE  65   1.538  -2.635   9.103
  526   HD12  ILE  65          1HD1      ILE  65  -0.132  -2.893   8.589
  527   HD13  ILE  65          2HD1      ILE  65   1.182  -3.773   7.796
  528    H    THR  66           H        THR  66  -3.877  -4.789   7.923
  529    HA   THR  66           HA       THR  66  -4.517  -7.598   8.037
  530    HB   THR  66           HB       THR  66  -5.559  -6.931  10.104
  531    HG1  THR  66           HG1      THR  66  -7.128  -8.163   9.459
  532   HG21  THR  66          3HG2      THR  66  -7.213  -5.135  10.297
  533   HG22  THR  66          1HG2      THR  66  -6.986  -4.719   8.594
  534   HG23  THR  66          2HG2      THR  66  -5.663  -4.495   9.743
  535    H    GLY  67           H        GLY  67  -6.668  -7.989   6.837
  536    HA2  GLY  67           2HA      GLY  67  -6.211  -7.366   4.174
  537    HA3  GLY  67           1HA      GLY  67  -7.666  -8.095   4.805
  538    H    LYS  68           H        LYS  68  -8.608  -5.923   6.384
  539    HA   LYS  68           HA       LYS  68 -10.132  -4.574   4.443
  540    HB2  LYS  68           2HB      LYS  68 -11.009  -3.235   6.337
  541    HB3  LYS  68           1HB      LYS  68 -11.016  -4.965   6.641
  542    HG2  LYS  68           2HG      LYS  68  -8.963  -4.722   8.015
  543    HG3  LYS  68           1HG      LYS  68  -8.999  -2.982   7.729
  544    HD2  LYS  68           2HD      LYS  68  -9.931  -3.353   9.912
  545    HD3  LYS  68           1HD      LYS  68 -11.270  -2.927   8.848
  546    HE2  LYS  68           2HE      LYS  68 -10.565  -5.794   9.560
  547    HE3  LYS  68           1HE      LYS  68 -11.715  -4.831  10.481
  548    HZ1  LYS  68           3HZ      LYS  68 -12.940  -4.548   8.301
  549    HZ2  LYS  68           1HZ      LYS  68 -12.976  -6.096   8.987
  550    HZ3  LYS  68           2HZ      LYS  68 -11.953  -5.776   7.688
  551    H    TYR  69           H        TYR  69  -7.147  -3.607   6.016
  552    HA   TYR  69           HA       TYR  69  -7.317  -0.846   5.017
  553    HB2  TYR  69           2HB      TYR  69  -5.295  -2.212   6.830
  554    HB3  TYR  69           1HB      TYR  69  -5.220  -0.513   6.356
  555    HD1  TYR  69           HD2      TYR  69  -7.715   0.700   6.721
  556    HD2  TYR  69           HD1      TYR  69  -6.140  -2.537   9.024
  557    HE1  TYR  69           HE2      TYR  69  -9.198   1.298   8.570
  558    HE2  TYR  69           HE1      TYR  69  -7.645  -1.939  10.877
  559    HH   TYR  69           HH       TYR  69 -10.233   0.215  10.518
  560    H    PHE  70           H        PHE  70  -6.125  -3.819   3.980
  561    HA   PHE  70           HA       PHE  70  -4.218  -2.536   2.102
  562    HB2  PHE  70           2HB      PHE  70  -4.063  -5.245   3.473
  563    HB3  PHE  70           1HB      PHE  70  -3.132  -4.886   2.023
  564    HD1  PHE  70           HD1      PHE  70  -1.376  -3.099   2.058
  565    HD2  PHE  70           HD2      PHE  70  -3.346  -4.360   5.638
  566    HE1  PHE  70           HE1      PHE  70   0.412  -2.083   3.404
  567    HE2  PHE  70           HE2      PHE  70  -1.552  -3.344   6.970
  568    HZ   PHE  70           HZ       PHE  70   0.327  -2.204   5.855
  569    H    LYS  71           H        LYS  71  -7.244  -3.427   2.021
  570    HA   LYS  71           HA       LYS  71  -7.703  -5.494   0.255
  571    HB2  LYS  71           2HB      LYS  71  -9.128  -2.837   0.495
  572    HB3  LYS  71           1HB      LYS  71  -9.709  -4.110  -0.577
  573    HG2  LYS  71           2HG      LYS  71 -10.051  -5.600   1.320
  574    HG3  LYS  71           1HG      LYS  71  -9.370  -4.391   2.419
  575    HD2  LYS  71           2HD      LYS  71 -11.837  -4.401   2.473
  576    HD3  LYS  71           1HD      LYS  71 -11.202  -2.851   1.918
  577    HE2  LYS  71           2HE      LYS  71 -11.650  -3.590  -0.444
  578    HE3  LYS  71           1HE      LYS  71 -12.393  -5.056   0.193
  579    HZ1  LYS  71           3HZ      LYS  71 -14.036  -3.393  -0.359
  580    HZ2  LYS  71           1HZ      LYS  71 -13.311  -2.279   0.684
  581    HZ3  LYS  71           2HZ      LYS  71 -14.042  -3.669   1.313
  582    H    ASP  72           H        ASP  72  -7.195  -2.116  -0.586
  583    HA   ASP  72           HA       ASP  72  -5.973  -2.630  -3.153
  584    HB2  ASP  72           2HB      ASP  72  -7.682  -1.392  -4.471
  585    HB3  ASP  72           1HB      ASP  72  -8.368  -2.842  -3.761
  586    H    LEU  73           H        LEU  73  -6.129  -0.073  -4.229
  587    HA   LEU  73           HA       LEU  73  -4.378   1.299  -2.424
  588    HB2  LEU  73           2HB      LEU  73  -3.988   1.478  -4.846
  589    HB3  LEU  73           1HB      LEU  73  -5.519   2.322  -5.038
  590    HG   LEU  73           HG       LEU  73  -4.648   4.185  -3.593
  591   HD11  LEU  73          1HD1      LEU  73  -3.028   2.934  -2.257
  592   HD12  LEU  73          2HD1      LEU  73  -2.236   4.281  -3.068
  593   HD13  LEU  73          3HD1      LEU  73  -2.033   2.643  -3.689
  594   HD21  LEU  73          3HD2      LEU  73  -2.925   3.583  -6.019
  595   HD22  LEU  73          1HD2      LEU  73  -3.120   5.161  -5.253
  596   HD23  LEU  73          2HD2      LEU  73  -4.495   4.387  -6.036
  597    H    ASN  74           H        ASN  74  -7.832   1.694  -3.258
  598    HA   ASN  74           HA       ASN  74  -8.121   4.260  -1.994
  599    HB2  ASN  74           2HB      ASN  74 -10.201   2.126  -2.607
  600    HB3  ASN  74           1HB      ASN  74 -10.612   3.673  -1.881
  601   HD21  ASN  74          1HD2      ASN  74  -8.228   3.117  -4.471
  602   HD22  ASN  74          2HD2      ASN  74  -9.095   3.999  -5.670
  603    H    ALA  75           H        ALA  75  -8.192   0.957  -0.809
  604    HA   ALA  75           HA       ALA  75  -9.010   1.536   1.864
  605    HB1  ALA  75           3HB      ALA  75  -9.131  -0.741   0.944
  606    HB2  ALA  75           1HB      ALA  75  -8.132  -0.704   2.401
  607    HB3  ALA  75           2HB      ALA  75  -7.373  -0.789   0.809
  608    H    ILE  76           H        ILE  76  -5.820   1.017   0.374
  609    HA   ILE  76           HA       ILE  76  -4.208   1.502   2.662
  610    HB   ILE  76           HB       ILE  76  -3.544   1.512  -0.310
  611   HG12  ILE  76          2HG1      ILE  76  -2.966  -0.511   1.890
  612   HG13  ILE  76          1HG1      ILE  76  -4.204  -0.689   0.652
  613   HG21  ILE  76          1HG2      ILE  76  -1.137   1.467   0.280
  614   HG22  ILE  76          2HG2      ILE  76  -1.550   1.682   1.981
  615   HG23  ILE  76          3HG2      ILE  76  -1.892   2.968   0.824
  616   HD11  ILE  76          3HD1      ILE  76  -2.415  -0.775  -1.055
  617   HD12  ILE  76          1HD1      ILE  76  -2.309  -2.061   0.151
  618   HD13  ILE  76          2HD1      ILE  76  -1.219  -0.678   0.247
  619    H    SER  77           H        SER  77  -5.568   3.657   0.264
  620    HA   SER  77           HA       SER  77  -3.793   5.859   0.727
  621    HB2  SER  77           2HB      SER  77  -5.488   7.175  -0.592
  622    HB3  SER  77           1HB      SER  77  -4.974   5.700  -1.411
  623    HG   SER  77           HG       SER  77  -7.425   6.294  -0.181
  624    H    ARG  78           H        ARG  78  -7.073   5.029   1.756
  625    HA   ARG  78           HA       ARG  78  -7.446   7.288   3.452
  626    HB2  ARG  78           2HB      ARG  78  -8.811   4.598   3.213
  627    HB3  ARG  78           1HB      ARG  78  -9.258   5.712   4.501
  628    HG2  ARG  78           2HG      ARG  78  -9.397   6.321   1.532
  629    HG3  ARG  78           1HG      ARG  78 -10.768   5.905   2.564
  630    HD2  ARG  78           2HD      ARG  78 -10.308   7.929   3.947
  631    HD3  ARG  78           1HD      ARG  78  -8.986   8.351   2.853
  632    HE   ARG  78           HE       ARG  78 -11.512   8.020   1.525
  633   HH11  ARG  78          1HH1      ARG  78  -9.518  10.349   3.259
  634   HH12  ARG  78          2HH1      ARG  78 -10.315  11.717   2.559
  635   HH21  ARG  78          1HH2      ARG  78 -12.539   9.812   0.641
  636   HH22  ARG  78          2HH2      ARG  78 -12.032  11.412   1.069
  637    H    THR  79           H        THR  79  -6.009   4.140   3.947
  638    HA   THR  79           HA       THR  79  -5.812   4.297   6.793
  639    HB   THR  79           HB       THR  79  -4.243   2.607   4.804
  640    HG1  THR  79           HG1      THR  79  -6.052   1.535   4.740
  641   HG21  THR  79          3HG2      THR  79  -4.498   2.295   7.820
  642   HG22  THR  79          1HG2      THR  79  -3.025   2.739   6.953
  643   HG23  THR  79          2HG2      THR  79  -3.731   1.135   6.736
  644    H    VAL  80           H        VAL  80  -3.629   5.091   4.131
  645    HA   VAL  80           HA       VAL  80  -1.339   5.483   5.834
  646    HB   VAL  80           HB       VAL  80  -1.269   4.604   3.428
  647   HG11  VAL  80          1HG1      VAL  80  -1.592   7.527   2.672
  648   HG12  VAL  80          2HG1      VAL  80  -2.747   6.235   2.345
  649   HG13  VAL  80          3HG1      VAL  80  -1.160   6.214   1.575
  650   HG21  VAL  80          3HG2      VAL  80   0.759   5.276   4.609
  651   HG22  VAL  80          1HG2      VAL  80   0.545   6.941   4.068
  652   HG23  VAL  80          2HG2      VAL  80   0.875   5.665   2.891
  653    H    GLU  81           H        GLU  81  -3.843   7.501   4.392
  654    HA   GLU  81           HA       GLU  81  -2.501  10.004   4.998
  655    HB2  GLU  81           2HB      GLU  81  -4.482  11.121   4.194
  656    HB3  GLU  81           1HB      GLU  81  -4.142   9.781   3.100
  657    HG2  GLU  81           2HG      GLU  81  -5.892   8.434   4.195
  658    HG3  GLU  81           1HG      GLU  81  -6.235   9.766   5.293
  659    H    GLN  82           H        GLN  82  -4.946   7.915   6.507
  660    HA   GLN  82           HA       GLN  82  -5.774   9.783   8.475
  661    HB2  GLN  82           2HB      GLN  82  -7.079   8.118   9.500
  662    HB3  GLN  82           1HB      GLN  82  -7.042   7.625   7.813
  663    HG2  GLN  82           2HG      GLN  82  -5.474   5.856   8.270
  664    HG3  GLN  82           1HG      GLN  82  -5.190   6.439   9.906
  665   HE21  GLN  82          1HE2      GLN  82  -5.731   4.497  10.875
  666   HE22  GLN  82          2HE2      GLN  82  -7.347   3.885  10.917
  667    H    LEU  83           H        LEU  83  -3.258   7.289   8.413
  668    HA   LEU  83           HA       LEU  83  -2.613   7.331  11.174
  669    HB2  LEU  83           2HB      LEU  83  -0.910   6.585   8.783
  670    HB3  LEU  83           1HB      LEU  83  -0.427   6.310  10.451
  671    HG   LEU  83           HG       LEU  83  -2.848   5.032   9.117
  672   HD11  LEU  83          1HD1      LEU  83  -1.515   2.966   9.177
  673   HD12  LEU  83          2HD1      LEU  83  -0.127   3.880   9.774
  674   HD13  LEU  83          3HD1      LEU  83  -0.772   4.200   8.160
  675   HD21  LEU  83          3HD2      LEU  83  -3.194   5.287  11.533
  676   HD22  LEU  83          1HD2      LEU  83  -1.620   4.554  11.856
  677   HD23  LEU  83          2HD2      LEU  83  -2.913   3.594  11.134
  678    H    LYS  84           H        LYS  84  -1.327   9.237   8.465
  679    HA   LYS  84           HA       LYS  84   0.634  10.654   9.965
  680    HB2  LYS  84           2HB      LYS  84  -0.862  11.560   7.465
  681    HB3  LYS  84           1HB      LYS  84   0.586  12.322   8.113
  682    HG2  LYS  84           2HG      LYS  84   1.834  10.210   7.704
  683    HG3  LYS  84           1HG      LYS  84   0.380   9.526   6.981
  684    HD2  LYS  84           2HD      LYS  84   1.792  12.013   5.933
  685    HD3  LYS  84           1HD      LYS  84   2.067  10.385   5.321
  686    HE2  LYS  84           2HE      LYS  84   0.545  11.404   3.803
  687    HE3  LYS  84           1HE      LYS  84  -0.414  10.289   4.770
  688    HZ1  LYS  84           3HZ      LYS  84  -1.487  12.462   4.402
  689    HZ2  LYS  84           1HZ      LYS  84  -0.244  13.220   5.265
  690    HZ3  LYS  84           2HZ      LYS  84  -1.266  12.124   6.044
  691    H    ALA  85           H        ALA  85  -2.817  11.168   9.373
  692    HA   ALA  85           HA       ALA  85  -3.049  13.697  10.702
  693    HB1  ALA  85           3HB      ALA  85  -5.193  11.612  10.161
  694    HB2  ALA  85           1HB      ALA  85  -4.694  12.882   9.033
  695    HB3  ALA  85           2HB      ALA  85  -5.456  13.314  10.562
  696    H    GLU  86           H        GLU  86  -3.231  10.346  11.787
  697    HA   GLU  86           HA       GLU  86  -4.433  10.882  14.349
  698    HB2  GLU  86           2HB      GLU  86  -3.026   8.367  13.343
  699    HB3  GLU  86           1HB      GLU  86  -3.961   8.482  14.826
  700    HG2  GLU  86           2HG      GLU  86  -5.027   8.753  12.015
  701    HG3  GLU  86           1HG      GLU  86  -5.217   7.365  13.055
  702    H    SER  87           H        SER  87  -1.192  10.395  13.077
  703    HA   SER  87           HA       SER  87   0.154  10.391  15.630
  704    HB2  SER  87           2HB      SER  87   1.219  10.724  12.792
  705    HB3  SER  87           1HB      SER  87   2.220  10.481  14.228
  706    HG   SER  87           HG       SER  87   0.673   8.683  12.808
  707    H    ALA  88           H        ALA  88  -0.404  12.785  13.036
  708    HA   ALA  88           HA       ALA  88   1.118  14.868  14.440
  709    HB1  ALA  88           3HB      ALA  88   0.810  16.192  12.392
  710    HB2  ALA  88           1HB      ALA  88  -0.257  14.948  11.730
  711    HB3  ALA  88           2HB      ALA  88   1.447  14.593  12.015
  712    H    LEU  89           H        LEU  89  -0.031  17.163  13.965
  713    HA   LEU  89           HA       LEU  89  -2.385  17.156  15.694
  714    HB2  LEU  89           2HB      LEU  89  -1.997  19.674  15.695
  715    HB3  LEU  89           1HB      LEU  89  -0.747  18.674  16.405
  716    HG   LEU  89           HG       LEU  89   0.525  18.928  14.161
  717   HD11  LEU  89          1HD1      LEU  89  -1.431  21.219  13.766
  718   HD12  LEU  89          2HD1      LEU  89  -1.260  19.796  12.736
  719   HD13  LEU  89          3HD1      LEU  89   0.053  20.965  12.840
  720   HD21  LEU  89          3HD2      LEU  89   1.231  20.018  16.228
  721   HD22  LEU  89          1HD2      LEU  89   0.125  21.361  15.923
  722   HD23  LEU  89          2HD2      LEU  89   1.496  21.079  14.847
  723    H    GLU  90           H        GLU  90  -1.866  17.136  12.342
  724    HA   GLU  90           HA       GLU  90  -3.900  19.011  11.548
  725    HB2  GLU  90           2HB      GLU  90  -3.561  17.957   9.232
  726    HB3  GLU  90           1HB      GLU  90  -2.189  18.790   9.943
  727    HG2  GLU  90           2HG      GLU  90  -1.148  16.671  10.554
  728    HG3  GLU  90           1HG      GLU  90  -2.548  15.770   9.966
  729   H281  4EM 101          2H28      PYA 142   0.973 -10.901   7.874
  730   H283  4EM 101          3H28      PYA 142   2.467 -11.057   8.797
  731   H303  4EM 101          3H30      PYA 142  -1.289 -11.615  10.725
  732   H301  4EM 101          1H30      PYA 142  -0.684 -12.839   9.597
  733   H302  4EM 101          2H30      PYA 142  -1.220 -11.263   9.004
  734   H312  4EM 101          2H31      PYA 142   0.058  -9.544  11.181
  735   H313  4EM 101          3H31      PYA 142   1.604  -9.300  10.379
  736   H311  4EM 101          1H31      PYA 142   0.100  -9.216   9.438
  737    H32  4EM 101           H32      PYA 142   1.381 -13.014  10.971
  738    H33  4EM 101           H33      PYA 142   2.775 -10.629  11.632
  739    H36  4EM 101           H36      PYA 142  -0.811 -12.997  12.140
  740   H373  4EM 101          3H37      PYA 142  -1.656 -13.129  14.321
  741   H372  4EM 101          2H37      PYA 142  -0.598 -11.820  14.827
  742   H382  4EM 101          2H38      PYA 142  -2.002 -10.216  13.583
  743   H383  4EM 101          3H38      PYA 142  -2.882 -11.037  14.866
  744    H41  4EM 101           H41      PYA 142  -3.559  -9.701  12.112
  745   H423  4EM 101          3H42      PYA 142  -5.338  -9.790  10.702
  746   H422  4EM 101          2H42      PYA 142  -5.891 -11.240  11.527
  747   H433  4EM 101          3H43      PYA 142  -5.533 -11.716   9.190
  748   H432  4EM 101          2H43      PYA 142  -4.329 -12.578  10.151
  749    H44  4EM 101           H44      PYA 142  -2.909 -10.680   9.683
  750    H49  4EM 101           H49      PYA 142  -2.771 -11.074   5.233
  751    H51  4EM 101           H51      PYA 142  -0.445  -9.905   4.961
  752    H50  4EM 101           H50      PYA 142   0.179  -8.820   7.239
  753    H48  4EM 101           H48      PYA 142  -1.791  -9.250   8.828
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1   8.378  11.437  -1.504
    2    H2   MET   1           2H       MET   1   8.200  13.104  -1.697
    3    H3   MET   1           3H       MET   1   6.877  12.082  -1.938
    4    HA   MET   1           HA       MET   1   6.953  11.415   0.363
    5    HB2  MET   1           2HB      MET   1   9.156  13.517   0.522
    6    HB3  MET   1           1HB      MET   1   8.320  12.889   1.936
    7    HG2  MET   1           2HG      MET   1   9.122  10.593   1.314
    8    HG3  MET   1           1HG      MET   1  10.104  11.337   0.044
    9    HE1  MET   1           3HE      MET   1  12.346  10.259   3.304
   10    HE2  MET   1           1HE      MET   1  11.938   9.755   1.664
   11    HE3  MET   1           2HE      MET   1  10.750   9.596   2.955
   12    H    ASP   2           H        ASP   2   4.835  12.151  -0.193
   13    HA   ASP   2           HA       ASP   2   4.075  14.404   1.367
   14    HB2  ASP   2           2HB      ASP   2   4.745  15.493  -0.882
   15    HB3  ASP   2           1HB      ASP   2   3.354  14.682  -1.592
   16    H    GLY   3           H        GLY   3   2.245  13.166  -1.496
   17    HA2  GLY   3           2HA      GLY   3   0.746  11.233   0.053
   18    HA3  GLY   3           1HA      GLY   3  -0.137  12.729  -0.178
   19    H    GLU   4           H        GLU   4  -0.511  13.429  -2.397
   20    HA   GLU   4           HA       GLU   4  -1.940  11.450  -3.775
   21    HB2  GLU   4           2HB      GLU   4  -1.085  14.184  -4.796
   22    HB3  GLU   4           1HB      GLU   4  -2.325  13.165  -5.527
   23    HG2  GLU   4           2HG      GLU   4  -2.465  14.212  -2.691
   24    HG3  GLU   4           1HG      GLU   4  -3.181  15.020  -4.067
   25    H    GLU   5           H        GLU   5   1.198  12.769  -4.398
   26    HA   GLU   5           HA       GLU   5   1.746  11.741  -6.994
   27    HB2  GLU   5           2HB      GLU   5   3.785  12.368  -4.790
   28    HB3  GLU   5           1HB      GLU   5   4.103  12.254  -6.516
   29    HG2  GLU   5           2HG      GLU   5   4.139  14.555  -5.914
   30    HG3  GLU   5           1HG      GLU   5   2.697  14.261  -6.879
   31    H    VAL   6           H        VAL   6   2.107  10.600  -3.747
   32    HA   VAL   6           HA       VAL   6   3.932   8.468  -4.332
   33    HB   VAL   6           HB       VAL   6   2.507   9.020  -1.722
   34   HG11  VAL   6          1HG1      VAL   6   5.111   7.612  -2.327
   35   HG12  VAL   6          2HG1      VAL   6   3.606   6.847  -1.810
   36   HG13  VAL   6          3HG1      VAL   6   4.475   7.921  -0.713
   37   HG21  VAL   6          3HG2      VAL   6   3.588  11.106  -2.425
   38   HG22  VAL   6          1HG2      VAL   6   5.117  10.247  -2.661
   39   HG23  VAL   6          2HG2      VAL   6   4.433  10.403  -1.040
   40    H    LYS   7           H        LYS   7   0.491   8.816  -3.918
   41    HA   LYS   7           HA       LYS   7  -0.349   6.334  -3.062
   42    HB2  LYS   7           2HB      LYS   7  -1.657   8.065  -5.194
   43    HB3  LYS   7           1HB      LYS   7  -2.457   6.747  -4.347
   44    HG2  LYS   7           2HG      LYS   7  -2.180   7.963  -2.198
   45    HG3  LYS   7           1HG      LYS   7  -1.406   9.292  -3.071
   46    HD2  LYS   7           2HD      LYS   7  -4.293   8.372  -3.269
   47    HD3  LYS   7           1HD      LYS   7  -3.683   9.945  -2.740
   48    HE2  LYS   7           2HE      LYS   7  -2.829  10.351  -5.034
   49    HE3  LYS   7           1HE      LYS   7  -3.545   8.829  -5.558
   50    HZ1  LYS   7           3HZ      LYS   7  -4.945  10.696  -6.086
   51    HZ2  LYS   7           1HZ      LYS   7  -5.031  11.149  -4.457
   52    HZ3  LYS   7           2HZ      LYS   7  -5.715   9.688  -4.974
   53    H    GLU   8           H        GLU   8   0.093   7.269  -6.512
   54    HA   GLU   8           HA       GLU   8  -0.282   4.648  -7.500
   55    HB2  GLU   8           2HB      GLU   8   0.600   5.432  -9.621
   56    HB3  GLU   8           1HB      GLU   8  -0.542   6.594  -8.957
   57    HG2  GLU   8           2HG      GLU   8   1.148   8.174  -8.468
   58    HG3  GLU   8           1HG      GLU   8   2.434   6.964  -8.554
   59    H    LYS   9           H        LYS   9   2.635   6.373  -6.364
   60    HA   LYS   9           HA       LYS   9   4.554   4.518  -7.327
   61    HB2  LYS   9           2HB      LYS   9   4.787   6.333  -4.902
   62    HB3  LYS   9           1HB      LYS   9   6.119   5.473  -5.664
   63    HG2  LYS   9           2HG      LYS   9   5.663   6.819  -7.765
   64    HG3  LYS   9           1HG      LYS   9   4.520   7.776  -6.814
   65    HD2  LYS   9           2HD      LYS   9   7.517   7.501  -6.364
   66    HD3  LYS   9           1HD      LYS   9   6.637   8.951  -6.843
   67    HE2  LYS   9           2HE      LYS   9   5.564   9.079  -4.645
   68    HE3  LYS   9           1HE      LYS   9   6.302   7.554  -4.157
   69    HZ1  LYS   9           3HZ      LYS   9   7.463   9.440  -3.258
   70    HZ2  LYS   9           1HZ      LYS   9   7.770  10.042  -4.806
   71    HZ3  LYS   9           2HZ      LYS   9   8.460   8.583  -4.314
   72    H    ILE  10           H        ILE  10   2.435   4.392  -4.572
   73    HA   ILE  10           HA       ILE  10   3.729   2.381  -3.044
   74    HB   ILE  10           HB       ILE  10   0.755   2.962  -3.356
   75   HG12  ILE  10          2HG1      ILE  10   1.870   4.934  -2.497
   76   HG13  ILE  10          1HG1      ILE  10   1.019   4.187  -1.156
   77   HG21  ILE  10          1HG2      ILE  10   2.120   1.356  -1.180
   78   HG22  ILE  10          2HG2      ILE  10   1.066   0.713  -2.440
   79   HG23  ILE  10          3HG2      ILE  10   0.409   1.796  -1.212
   80   HD11  ILE  10          3HD1      ILE  10   3.196   4.992  -0.468
   81   HD12  ILE  10          1HD1      ILE  10   3.988   4.015  -1.702
   82   HD13  ILE  10          2HD1      ILE  10   3.150   3.234  -0.355
   83    H    ARG  11           H        ARG  11   1.340   2.285  -5.639
   84    HA   ARG  11           HA       ARG  11   1.241  -0.567  -5.867
   85    HB2  ARG  11           2HB      ARG  11   0.248   1.660  -7.677
   86    HB3  ARG  11           1HB      ARG  11   0.015  -0.047  -8.053
   87    HG2  ARG  11           2HG      ARG  11  -1.025   1.380  -5.582
   88    HG3  ARG  11           1HG      ARG  11  -1.991   0.896  -6.981
   89    HD2  ARG  11           2HD      ARG  11  -1.616  -1.457  -6.509
   90    HD3  ARG  11           1HD      ARG  11  -0.427  -1.079  -5.266
   91    HE   ARG  11           HE       ARG  11  -3.345  -0.777  -5.059
   92   HH11  ARG  11          1HH1      ARG  11  -0.209  -0.678  -3.482
   93   HH12  ARG  11          2HH1      ARG  11  -0.873  -0.721  -1.884
   94   HH21  ARG  11          1HH2      ARG  11  -4.171  -1.015  -2.978
   95   HH22  ARG  11          2HH2      ARG  11  -3.139  -0.915  -1.602
   96    H    ARG  12           H        ARG  12   3.018   1.976  -7.552
   97    HA   ARG  12           HA       ARG  12   4.204   0.438  -9.598
   98    HB2  ARG  12           2HB      ARG  12   4.792   3.095  -8.308
   99    HB3  ARG  12           1HB      ARG  12   6.089   2.369  -9.234
  100    HG2  ARG  12           2HG      ARG  12   4.693   4.050 -10.492
  101    HG3  ARG  12           1HG      ARG  12   4.855   2.475 -11.264
  102    HD2  ARG  12           2HD      ARG  12   2.622   1.915 -10.911
  103    HD3  ARG  12           1HD      ARG  12   2.443   3.018  -9.549
  104    HE   ARG  12           HE       ARG  12   2.822   4.772 -11.495
  105   HH11  ARG  12          1HH1      ARG  12   0.709   1.965 -11.479
  106   HH12  ARG  12          2HH1      ARG  12  -0.436   2.676 -12.564
  107   HH21  ARG  12          1HH2      ARG  12   1.298   5.708 -12.844
  108   HH22  ARG  12          2HH2      ARG  12  -0.096   4.808 -13.341
  109    H    TYR  13           H        TYR  13   5.177   1.133  -6.278
  110    HA   TYR  13           HA       TYR  13   7.708  -0.113  -6.269
  111    HB2  TYR  13           2HB      TYR  13   7.101   1.404  -4.482
  112    HB3  TYR  13           1HB      TYR  13   5.721   0.410  -4.023
  113    HD1  TYR  13           HD1      TYR  13   9.457  -0.045  -4.487
  114    HD2  TYR  13           HD2      TYR  13   6.038  -0.845  -2.045
  115    HE1  TYR  13           HE1      TYR  13  10.888  -1.202  -2.859
  116    HE2  TYR  13           HE2      TYR  13   7.470  -1.994  -0.421
  117    HH   TYR  13           HH       TYR  13  10.811  -1.762  -0.407
  118    H    ILE  14           H        ILE  14   4.483  -1.354  -5.485
  119    HA   ILE  14           HA       ILE  14   5.193  -3.960  -4.677
  120    HB   ILE  14           HB       ILE  14   2.609  -2.892  -5.892
  121   HG12  ILE  14          2HG1      ILE  14   3.364  -3.493  -2.995
  122   HG13  ILE  14          1HG1      ILE  14   3.279  -1.885  -3.701
  123   HG21  ILE  14          1HG2      ILE  14   3.085  -5.588  -4.552
  124   HG22  ILE  14          2HG2      ILE  14   2.680  -5.323  -6.250
  125   HG23  ILE  14          3HG2      ILE  14   1.501  -4.943  -4.997
  126   HD11  ILE  14          3HD1      ILE  14   0.989  -3.789  -3.282
  127   HD12  ILE  14          1HD1      ILE  14   0.865  -2.205  -4.055
  128   HD13  ILE  14          2HD1      ILE  14   1.345  -2.329  -2.363
  129    H    MET  15           H        MET  15   4.207  -2.711  -7.877
  130    HA   MET  15           HA       MET  15   4.245  -5.312  -9.095
  131    HB2  MET  15           2HB      MET  15   4.160  -2.589 -10.459
  132    HB3  MET  15           1HB      MET  15   3.706  -4.139 -11.169
  133    HG2  MET  15           2HG      MET  15   2.309  -2.684  -8.927
  134    HG3  MET  15           1HG      MET  15   1.706  -2.960 -10.555
  135    HE1  MET  15           3HE      MET  15   0.690  -6.657 -10.552
  136    HE2  MET  15           1HE      MET  15   2.091  -5.869 -11.278
  137    HE3  MET  15           2HE      MET  15   0.508  -5.075 -11.324
  138    H    GLU  16           H        GLU  16   6.448  -2.480  -9.293
  139    HA   GLU  16           HA       GLU  16   8.265  -3.650 -11.150
  140    HB2  GLU  16           2HB      GLU  16   8.691  -1.314  -9.236
  141    HB3  GLU  16           1HB      GLU  16   9.805  -1.764 -10.524
  142    HG2  GLU  16           2HG      GLU  16   8.161  -1.249 -12.217
  143    HG3  GLU  16           1HG      GLU  16   6.923  -0.948 -10.996
  144    H    ASP  17           H        ASP  17   8.464  -3.227  -7.575
  145    HA   ASP  17           HA       ASP  17  10.991  -4.690  -7.480
  146    HB2  ASP  17           2HB      ASP  17   9.329  -3.467  -5.242
  147    HB3  ASP  17           1HB      ASP  17  10.864  -4.294  -4.996
  148    H    LEU  18           H        LEU  18   7.770  -5.114  -5.958
  149    HA   LEU  18           HA       LEU  18   8.519  -7.603  -4.758
  150    HB2  LEU  18           2HB      LEU  18   5.888  -6.124  -4.902
  151    HB3  LEU  18           1HB      LEU  18   6.014  -7.685  -4.129
  152    HG   LEU  18           HG       LEU  18   6.103  -6.043  -2.395
  153   HD11  LEU  18          1HD1      LEU  18   7.616  -7.938  -2.077
  154   HD12  LEU  18          2HD1      LEU  18   8.244  -6.482  -1.319
  155   HD13  LEU  18          3HD1      LEU  18   8.934  -7.037  -2.842
  156   HD21  LEU  18          3HD2      LEU  18   8.383  -4.621  -3.815
  157   HD22  LEU  18          1HD2      LEU  18   7.700  -4.193  -2.242
  158   HD23  LEU  18          2HD2      LEU  18   6.722  -4.040  -3.699
  159    H    ILE  19           H        ILE  19   6.499  -6.859  -7.613
  160    HA   ILE  19           HA       ILE  19   6.132  -9.681  -8.215
  161    HB   ILE  19           HB       ILE  19   5.334  -7.182  -9.738
  162   HG12  ILE  19          2HG1      ILE  19   3.013  -8.143  -9.499
  163   HG13  ILE  19          1HG1      ILE  19   3.690  -9.453  -8.556
  164   HG21  ILE  19          1HG2      ILE  19   4.332  -8.608 -11.504
  165   HG22  ILE  19          2HG2      ILE  19   5.075 -10.027 -10.761
  166   HG23  ILE  19          3HG2      ILE  19   6.092  -8.755 -11.447
  167   HD11  ILE  19          3HD1      ILE  19   2.609  -7.790  -7.177
  168   HD12  ILE  19          1HD1      ILE  19   3.706  -6.549  -7.791
  169   HD13  ILE  19          2HD1      ILE  19   4.335  -7.891  -6.824
  170    H    GLY  20           H        GLY  20   7.944  -6.952  -9.586
  171    HA2  GLY  20           2HA      GLY  20  10.326  -7.377 -10.154
  172    HA3  GLY  20           1HA      GLY  20   9.797  -8.862 -10.942
  173    HA   PRO  21           HA       PRO  21  10.006  -5.475 -14.229
  174    HB2  PRO  21           2HB      PRO  21  11.461  -7.009 -16.036
  175    HB3  PRO  21           1HB      PRO  21  12.205  -5.950 -14.824
  176    HG2  PRO  21           2HG      PRO  21  11.791  -8.914 -14.725
  177    HG3  PRO  21           1HG      PRO  21  13.203  -7.949 -14.235
  178    HD2  PRO  21           2HD      PRO  21  11.420  -8.888 -12.414
  179    HD3  PRO  21           1HD      PRO  21  12.264  -7.336 -12.201
  180    H    SER  22           H        SER  22   8.959  -8.775 -13.991
  181    HA   SER  22           HA       SER  22   7.260  -8.707 -16.371
  182    HB2  SER  22           2HB      SER  22   7.552 -10.754 -14.134
  183    HB3  SER  22           1HB      SER  22   6.585 -10.975 -15.594
  184    HG   SER  22           HG       SER  22   8.367 -11.110 -16.791
  185    H    ALA  23           H        ALA  23   6.806  -6.614 -14.482
  186    HA   ALA  23           HA       ALA  23   4.819  -7.016 -12.567
  187    HB1  ALA  23           3HB      ALA  23   6.221  -5.049 -12.594
  188    HB2  ALA  23           1HB      ALA  23   4.525  -4.565 -12.670
  189    HB3  ALA  23           2HB      ALA  23   5.522  -4.516 -14.129
  190    H    LYS  24           H        LYS  24   2.719  -7.392 -12.730
  191    HA   LYS  24           HA       LYS  24   1.419  -7.594 -15.307
  192    HB2  LYS  24           2HB      LYS  24   0.478  -8.258 -12.495
  193    HB3  LYS  24           1HB      LYS  24  -0.493  -8.517 -13.938
  194    HG2  LYS  24           2HG      LYS  24   2.162  -9.846 -13.334
  195    HG3  LYS  24           1HG      LYS  24   0.562 -10.583 -13.189
  196    HD2  LYS  24           2HD      LYS  24   0.301  -9.967 -15.727
  197    HD3  LYS  24           1HD      LYS  24   2.057  -9.784 -15.702
  198    HE2  LYS  24           2HE      LYS  24   1.413 -12.025 -16.466
  199    HE3  LYS  24           1HE      LYS  24   2.280 -12.115 -14.933
  200    HZ1  LYS  24           3HZ      LYS  24  -0.676 -12.212 -15.212
  201    HZ2  LYS  24           1HZ      LYS  24   0.200 -12.398 -13.781
  202    HZ3  LYS  24           2HZ      LYS  24   0.319 -13.558 -15.001
  203    H    GLU  25           H        GLU  25   1.594  -5.294 -15.691
  204    HA   GLU  25           HA       GLU  25   0.164  -3.307 -14.296
  205    HB2  GLU  25           2HB      GLU  25   0.946  -3.381 -17.238
  206    HB3  GLU  25           1HB      GLU  25   0.465  -1.934 -16.353
  207    HG2  GLU  25           2HG      GLU  25   2.905  -3.635 -15.749
  208    HG3  GLU  25           1HG      GLU  25   2.927  -2.104 -16.618
  209    H    ASP  26           H        ASP  26  -0.801  -5.600 -16.703
  210    HA   ASP  26           HA       ASP  26  -3.353  -4.739 -17.459
  211    HB2  ASP  26           2HB      ASP  26  -2.177  -6.659 -18.521
  212    HB3  ASP  26           1HB      ASP  26  -2.316  -7.594 -17.033
  213    H    GLU  27           H        GLU  27  -2.322  -6.755 -14.720
  214    HA   GLU  27           HA       GLU  27  -4.995  -7.008 -13.612
  215    HB2  GLU  27           2HB      GLU  27  -2.281  -7.885 -12.538
  216    HB3  GLU  27           1HB      GLU  27  -3.832  -8.298 -11.810
  217    HG2  GLU  27           2HG      GLU  27  -4.478  -9.485 -13.899
  218    HG3  GLU  27           1HG      GLU  27  -2.895  -9.117 -14.582
  219    H    LEU  28           H        LEU  28  -2.413  -4.764 -13.310
  220    HA   LEU  28           HA       LEU  28  -2.955  -3.865 -10.645
  221    HB2  LEU  28           2HB      LEU  28  -0.722  -3.664 -11.689
  222    HB3  LEU  28           1HB      LEU  28  -1.387  -2.550 -12.875
  223    HG   LEU  28           HG       LEU  28  -1.980  -0.987 -10.992
  224   HD11  LEU  28          1HD1      LEU  28  -0.375  -2.899  -9.279
  225   HD12  LEU  28          2HD1      LEU  28  -2.103  -2.566  -9.137
  226   HD13  LEU  28          3HD1      LEU  28  -0.932  -1.300  -8.783
  227   HD21  LEU  28          3HD2      LEU  28   0.017  -0.557 -12.293
  228   HD22  LEU  28          1HD2      LEU  28   0.948  -1.662 -11.280
  229   HD23  LEU  28          2HD2      LEU  28   0.313  -0.164 -10.601
  230    H    ASP  29           H        ASP  29  -4.313  -2.297  -9.999
  231    HA   ASP  29           HA       ASP  29  -5.012  -0.004 -11.556
  232    HB2  ASP  29           2HB      ASP  29  -6.725  -1.863 -12.280
  233    HB3  ASP  29           1HB      ASP  29  -7.384  -1.701 -10.655
  234    H    ASP  30           H        ASP  30  -6.507   1.407 -10.260
  235    HA   ASP  30           HA       ASP  30  -5.621   1.661  -7.569
  236    HB2  ASP  30           2HB      ASP  30  -7.902   3.139  -8.956
  237    HB3  ASP  30           1HB      ASP  30  -7.058   3.650  -7.496
  238    H    GLN  31           H        GLN  31  -8.454   0.426  -9.153
  239    HA   GLN  31           HA       GLN  31 -10.070   0.189  -6.718
  240    HB2  GLN  31           2HB      GLN  31 -10.773  -0.435  -9.622
  241    HB3  GLN  31           1HB      GLN  31 -11.911  -0.363  -8.274
  242    HG2  GLN  31           2HG      GLN  31 -11.603   2.020  -8.038
  243    HG3  GLN  31           1HG      GLN  31 -10.269   2.021  -9.195
  244   HE21  GLN  31          1HE2      GLN  31 -10.725   1.727 -11.406
  245   HE22  GLN  31          2HE2      GLN  31 -12.307   2.002 -12.053
  246    H    THR  32           H        THR  32  -7.989  -1.757  -8.674
  247    HA   THR  32           HA       THR  32  -9.147  -4.315  -8.372
  248    HB   THR  32           HB       THR  32  -6.238  -3.509  -8.718
  249    HG1  THR  32           HG1      THR  32  -6.702  -4.351 -10.859
  250   HG21  THR  32          3HG2      THR  32  -7.421  -6.313  -8.831
  251   HG22  THR  32          1HG2      THR  32  -6.269  -5.727  -7.625
  252   HG23  THR  32          2HG2      THR  32  -5.779  -5.880  -9.313
  253    HA   PRO  33           HA       PRO  33  -8.218  -4.845  -3.928
  254    HB2  PRO  33           2HB      PRO  33  -9.434  -7.290  -3.637
  255    HB3  PRO  33           1HB      PRO  33 -10.351  -5.770  -3.703
  256    HG2  PRO  33           2HG      PRO  33  -9.935  -7.810  -5.845
  257    HG3  PRO  33           1HG      PRO  33 -11.385  -6.865  -5.457
  258    HD2  PRO  33           2HD      PRO  33  -9.654  -6.250  -7.517
  259    HD3  PRO  33           1HD      PRO  33 -10.707  -5.062  -6.718
  260    H    LEU  34           H        LEU  34  -6.065  -5.168  -3.799
  261    HA   LEU  34           HA       LEU  34  -4.519  -6.987  -5.288
  262    HB2  LEU  34           2HB      LEU  34  -3.791  -5.418  -2.787
  263    HB3  LEU  34           1HB      LEU  34  -2.651  -6.315  -3.766
  264    HG   LEU  34           HG       LEU  34  -2.403  -3.970  -4.235
  265   HD11  LEU  34          1HD1      LEU  34  -2.682  -3.863  -6.653
  266   HD12  LEU  34          2HD1      LEU  34  -3.784  -5.242  -6.613
  267   HD13  LEU  34          3HD1      LEU  34  -2.087  -5.450  -6.169
  268   HD21  LEU  34          3HD2      LEU  34  -4.566  -3.135  -3.541
  269   HD22  LEU  34          1HD2      LEU  34  -5.320  -3.855  -4.964
  270   HD23  LEU  34          2HD2      LEU  34  -4.153  -2.543  -5.148
  271    H    LEU  35           H        LEU  35  -5.739  -7.078  -1.920
  272    HA   LEU  35           HA       LEU  35  -4.402  -9.433  -1.060
  273    HB2  LEU  35           2HB      LEU  35  -7.047  -8.232  -0.158
  274    HB3  LEU  35           1HB      LEU  35  -6.407  -9.699   0.560
  275    HG   LEU  35           HG       LEU  35  -5.923  -7.830   2.003
  276   HD11  LEU  35          1HD1      LEU  35  -4.222  -9.594   1.948
  277   HD12  LEU  35          2HD1      LEU  35  -3.499  -8.025   2.278
  278   HD13  LEU  35          3HD1      LEU  35  -3.350  -8.740   0.670
  279   HD21  LEU  35          3HD2      LEU  35  -5.999  -6.002   0.405
  280   HD22  LEU  35          1HD2      LEU  35  -4.472  -6.527  -0.312
  281   HD23  LEU  35          2HD2      LEU  35  -4.519  -5.940   1.352
  282    H    GLU  36           H        GLU  36  -7.584  -8.930  -2.459
  283    HA   GLU  36           HA       GLU  36  -8.508 -11.582  -2.451
  284    HB2  GLU  36           2HB      GLU  36  -9.988  -9.593  -2.647
  285    HB3  GLU  36           1HB      GLU  36  -9.336  -9.267  -4.251
  286    HG2  GLU  36           2HG      GLU  36 -10.261 -11.446  -5.031
  287    HG3  GLU  36           1HG      GLU  36 -10.952 -11.694  -3.428
  288    H    TRP  37           H        TRP  37  -6.508  -9.783  -4.697
  289    HA   TRP  37           HA       TRP  37  -6.667 -11.892  -6.768
  290    HB2  TRP  37           2HB      TRP  37  -5.452  -9.100  -6.742
  291    HB3  TRP  37           1HB      TRP  37  -5.151 -10.240  -8.050
  292    HD1  TRP  37           HD1      TRP  37  -8.635  -9.661  -6.407
  293    HE1  TRP  37           HE1      TRP  37 -10.223  -8.780  -8.204
  294    HE3  TRP  37           HE3      TRP  37  -5.320  -9.196 -10.290
  295    HZ2  TRP  37           HZ2      TRP  37 -10.120  -7.986 -10.904
  296    HZ3  TRP  37           HZ3      TRP  37  -6.163  -8.360 -12.454
  297    HH2  TRP  37           HH2      TRP  37  -8.513  -7.770 -12.754
  298    H    GLY  38           H        GLY  38  -5.148 -11.842  -3.987
  299    HA2  GLY  38           2HA      GLY  38  -3.361 -12.969  -3.125
  300    HA3  GLY  38           1HA      GLY  38  -3.268 -13.820  -4.656
  301    H    ILE  39           H        ILE  39  -2.903 -10.382  -4.571
  302    HA   ILE  39           HA       ILE  39  -0.219 -10.496  -5.672
  303    HB   ILE  39           HB       ILE  39  -2.115  -8.160  -5.121
  304   HG12  ILE  39          2HG1      ILE  39  -1.319  -9.488  -7.756
  305   HG13  ILE  39          1HG1      ILE  39  -2.849  -9.748  -6.933
  306   HG21  ILE  39          1HG2      ILE  39   0.220  -7.360  -5.007
  307   HG22  ILE  39          2HG2      ILE  39  -0.596  -6.728  -6.435
  308   HG23  ILE  39          3HG2      ILE  39   0.544  -8.065  -6.595
  309   HD11  ILE  39          3HD1      ILE  39  -3.111  -8.257  -8.807
  310   HD12  ILE  39          1HD1      ILE  39  -1.883  -7.172  -8.158
  311   HD13  ILE  39          2HD1      ILE  39  -3.413  -7.383  -7.303
  312    H    LEU  40           H        LEU  40  -1.846  -9.543  -2.701
  313    HA   LEU  40           HA       LEU  40   0.721  -8.826  -1.415
  314    HB2  LEU  40           2HB      LEU  40  -2.122  -8.243  -0.509
  315    HB3  LEU  40           1HB      LEU  40  -0.650  -7.703   0.284
  316    HG   LEU  40           HG       LEU  40  -1.680  -6.816  -2.421
  317   HD11  LEU  40          1HD1      LEU  40  -1.334  -5.318   0.186
  318   HD12  LEU  40          2HD1      LEU  40  -2.855  -5.773  -0.601
  319   HD13  LEU  40          3HD1      LEU  40  -1.788  -4.600  -1.363
  320   HD21  LEU  40          3HD2      LEU  40   0.942  -6.089  -1.090
  321   HD22  LEU  40          1HD2      LEU  40   0.265  -5.295  -2.516
  322   HD23  LEU  40          2HD2      LEU  40   0.729  -6.992  -2.596
  323    H    ASN  41           H        ASN  41  -0.800  -9.248   1.264
  324    HA   ASN  41           HA       ASN  41  -0.939 -10.702   2.906
  325    HB2  ASN  41           2HB      ASN  41  -1.075 -12.801   0.707
  326    HB3  ASN  41           1HB      ASN  41  -1.080 -13.241   2.412
  327   HD21  ASN  41          1HD2      ASN  41  -3.174 -13.311   0.148
  328   HD22  ASN  41          2HD2      ASN  41  -4.570 -12.622   0.894
  329    H    SER  42           H        SER  42   0.792 -10.431   4.053
  330    HA   SER  42           HA       SER  42   2.869 -10.316   4.832
  331    HB2  SER  42           3HB      SER  42   2.833 -13.133   3.750
  332    HB3  SER  42           2HB      SER  42   4.287 -12.512   4.499
  333    H    MET  43           H        MET  43   3.605 -12.148   1.872
  334    HA   MET  43           HA       MET  43   6.138 -11.668   1.375
  335    HB2  MET  43           2HB      MET  43   4.049 -11.518  -0.848
  336    HB3  MET  43           1HB      MET  43   5.736 -11.978  -1.040
  337    HG2  MET  43           2HG      MET  43   5.394 -14.013   0.153
  338    HG3  MET  43           1HG      MET  43   3.762 -13.529   0.626
  339    HE1  MET  43           3HE      MET  43   2.659 -12.176  -2.128
  340    HE2  MET  43           1HE      MET  43   1.736 -13.254  -1.083
  341    HE3  MET  43           2HE      MET  43   1.850 -13.590  -2.810
  342    H    ASN  44           H        ASN  44   3.677  -9.560  -0.062
  343    HA   ASN  44           HA       ASN  44   5.668  -7.596  -0.899
  344    HB2  ASN  44           2HB      ASN  44   2.644  -7.634  -1.290
  345    HB3  ASN  44           1HB      ASN  44   3.755  -6.498  -2.049
  346   HD21  ASN  44          1HD2      ASN  44   3.175  -7.120  -4.144
  347   HD22  ASN  44          2HD2      ASN  44   3.576  -8.652  -4.822
  348    H    ILE  45           H        ILE  45   3.033  -7.923   1.360
  349    HA   ILE  45           HA       ILE  45   2.456  -5.290   2.014
  350    HB   ILE  45           HB       ILE  45   1.867  -7.987   3.127
  351   HG12  ILE  45          2HG1      ILE  45   0.137  -5.530   2.630
  352   HG13  ILE  45          1HG1      ILE  45   0.385  -6.853   1.497
  353   HG21  ILE  45          1HG2      ILE  45   0.840  -7.251   5.230
  354   HG22  ILE  45          2HG2      ILE  45   1.452  -5.615   4.964
  355   HG23  ILE  45          3HG2      ILE  45   2.583  -6.950   5.227
  356   HD11  ILE  45          3HD1      ILE  45  -1.754  -7.051   2.534
  357   HD12  ILE  45          1HD1      ILE  45  -1.036  -6.973   4.143
  358   HD13  ILE  45          2HD1      ILE  45  -0.722  -8.367   3.100
  359    H    VAL  46           H        VAL  46   4.933  -7.388   3.415
  360    HA   VAL  46           HA       VAL  46   5.426  -5.844   5.756
  361    HB   VAL  46           HB       VAL  46   7.268  -7.844   4.382
  362   HG11  VAL  46          1HG1      VAL  46   7.327  -6.758   7.228
  363   HG12  VAL  46          2HG1      VAL  46   8.486  -6.361   5.956
  364   HG13  VAL  46          3HG1      VAL  46   8.397  -8.009   6.588
  365   HG21  VAL  46          3HG2      VAL  46   5.092  -8.852   5.026
  366   HG22  VAL  46          1HG2      VAL  46   5.311  -8.273   6.679
  367   HG23  VAL  46          2HG2      VAL  46   6.406  -9.489   6.016
  368    H    LYS  47           H        LYS  47   6.529  -5.650   2.481
  369    HA   LYS  47           HA       LYS  47   8.772  -3.901   2.978
  370    HB2  LYS  47           2HB      LYS  47   7.418  -4.780   0.406
  371    HB3  LYS  47           1HB      LYS  47   8.770  -3.656   0.443
  372    HG2  LYS  47           2HG      LYS  47   9.607  -5.830  -0.096
  373    HG3  LYS  47           1HG      LYS  47  10.165  -5.405   1.523
  374    HD2  LYS  47           2HD      LYS  47   8.580  -6.900   2.551
  375    HD3  LYS  47           1HD      LYS  47   7.722  -7.135   1.029
  376    HE2  LYS  47           2HE      LYS  47   9.053  -9.098   1.516
  377    HE3  LYS  47           1HE      LYS  47   9.722  -8.279   0.107
  378    HZ1  LYS  47           3HZ      LYS  47  11.384  -9.057   1.683
  379    HZ2  LYS  47           1HZ      LYS  47  10.766  -8.016   2.859
  380    HZ3  LYS  47           2HZ      LYS  47  11.445  -7.389   1.452
  381    H    LEU  48           H        LEU  48   5.360  -3.575   2.211
  382    HA   LEU  48           HA       LEU  48   5.391  -0.775   1.644
  383    HB2  LEU  48           2HB      LEU  48   3.148  -2.631   2.506
  384    HB3  LEU  48           1HB      LEU  48   2.885  -0.902   2.352
  385    HG   LEU  48           HG       LEU  48   2.102  -1.927   0.325
  386   HD11  LEU  48          1HD1      LEU  48   3.435  -0.797  -1.407
  387   HD12  LEU  48          2HD1      LEU  48   4.783  -0.609  -0.285
  388   HD13  LEU  48          3HD1      LEU  48   3.261   0.235   0.011
  389   HD21  LEU  48          3HD2      LEU  48   4.818  -3.238  -0.031
  390   HD22  LEU  48          1HD2      LEU  48   3.462  -3.316  -1.159
  391   HD23  LEU  48          2HD2      LEU  48   3.326  -4.062   0.429
  392    H    MET  49           H        MET  49   5.278  -2.659   4.607
  393    HA   MET  49           HA       MET  49   4.460  -0.719   6.472
  394    HB2  MET  49           2HB      MET  49   6.556  -2.890   6.963
  395    HB3  MET  49           1HB      MET  49   5.628  -2.045   8.195
  396    HG2  MET  49           2HG      MET  49   3.581  -3.123   7.446
  397    HG3  MET  49           1HG      MET  49   4.457  -3.906   6.120
  398    HE1  MET  49           3HE      MET  49   3.858  -7.021   8.451
  399    HE2  MET  49           1HE      MET  49   3.904  -6.479   6.772
  400    HE3  MET  49           2HE      MET  49   2.758  -5.762   7.898
  401    H    VAL  50           H        VAL  50   7.784  -1.658   5.539
  402    HA   VAL  50           HA       VAL  50   9.040   0.550   6.851
  403    HB   VAL  50           HB       VAL  50  10.267  -1.543   6.503
  404   HG11  VAL  50          1HG1      VAL  50   9.377  -2.239   4.314
  405   HG12  VAL  50          2HG1      VAL  50  11.141  -2.230   4.297
  406   HG13  VAL  50          3HG1      VAL  50  10.249  -0.916   3.527
  407   HG21  VAL  50          3HG2      VAL  50  12.435  -0.614   5.666
  408   HG22  VAL  50          1HG2      VAL  50  11.630   0.462   6.812
  409   HG23  VAL  50          2HG2      VAL  50  11.574   0.817   5.083
  410    H    TYR  51           H        TYR  51   7.769   0.111   3.588
  411    HA   TYR  51           HA       TYR  51   9.218   2.115   2.226
  412    HB2  TYR  51           2HB      TYR  51   7.675   0.346   1.168
  413    HB3  TYR  51           1HB      TYR  51   6.328   1.385   1.589
  414    HD1  TYR  51           HD1      TYR  51   9.554   1.363  -0.319
  415    HD2  TYR  51           HD2      TYR  51   5.710   3.189   0.096
  416    HE1  TYR  51           HE1      TYR  51   9.911   2.591  -2.412
  417    HE2  TYR  51           HE2      TYR  51   6.069   4.411  -2.000
  418    HH   TYR  51           HH       TYR  51   8.510   3.691  -4.192
  419    H    ILE  52           H        ILE  52   6.004   2.193   3.632
  420    HA   ILE  52           HA       ILE  52   5.441   4.945   3.209
  421    HB   ILE  52           HB       ILE  52   4.146   2.890   5.060
  422   HG12  ILE  52          2HG1      ILE  52   3.178   3.757   2.301
  423   HG13  ILE  52          1HG1      ILE  52   4.279   2.401   2.507
  424   HG21  ILE  52          1HG2      ILE  52   2.127   4.311   5.027
  425   HG22  ILE  52          2HG2      ILE  52   2.985   5.516   4.066
  426   HG23  ILE  52          3HG2      ILE  52   3.495   5.183   5.722
  427   HD11  ILE  52          3HD1      ILE  52   1.504   2.608   3.649
  428   HD12  ILE  52          1HD1      ILE  52   2.618   1.251   3.849
  429   HD13  ILE  52          2HD1      ILE  52   2.008   1.663   2.246
  430    H    ARG  53           H        ARG  53   6.974   3.145   5.771
  431    HA   ARG  53           HA       ARG  53   6.930   4.981   7.885
  432    HB2  ARG  53           2HB      ARG  53   7.611   2.636   8.139
  433    HB3  ARG  53           1HB      ARG  53   9.061   2.938   7.191
  434    HG2  ARG  53           2HG      ARG  53   9.931   4.433   8.941
  435    HG3  ARG  53           1HG      ARG  53   8.442   4.241   9.870
  436    HD2  ARG  53           2HD      ARG  53   8.921   1.842  10.152
  437    HD3  ARG  53           1HD      ARG  53  10.406   2.018   9.210
  438    HE   ARG  53           HE       ARG  53  10.282   3.765  11.502
  439   HH11  ARG  53          1HH1      ARG  53  11.160   0.549  10.447
  440   HH12  ARG  53          2HH1      ARG  53  12.264   0.276  11.755
  441   HH21  ARG  53          1HH2      ARG  53  11.739   3.416  13.220
  442   HH22  ARG  53          2HH2      ARG  53  12.596   1.908  13.334
  443    H    ASP  54           H        ASP  54   9.293   4.611   5.262
  444    HA   ASP  54           HA       ASP  54  10.870   6.905   6.036
  445    HB2  ASP  54           2HB      ASP  54  10.865   5.052   3.611
  446    HB3  ASP  54           1HB      ASP  54  11.940   6.435   3.729
  447    H    GLU  55           H        GLU  55   8.612   6.116   3.431
  448    HA   GLU  55           HA       GLU  55   9.030   8.464   1.916
  449    HB2  GLU  55           2HB      GLU  55   8.361   6.185   1.070
  450    HB3  GLU  55           1HB      GLU  55   6.756   6.453   1.735
  451    HG2  GLU  55           2HG      GLU  55   6.780   6.820  -0.660
  452    HG3  GLU  55           1HG      GLU  55   6.415   8.324   0.186
  453    H    MET  56           H        MET  56   6.114   7.434   3.778
  454    HA   MET  56           HA       MET  56   5.112  10.213   3.734
  455    HB2  MET  56           2HB      MET  56   3.829   7.557   4.348
  456    HB3  MET  56           1HB      MET  56   3.133   8.996   5.081
  457    HG2  MET  56           2HG      MET  56   1.988   8.406   3.000
  458    HG3  MET  56           1HG      MET  56   2.762   9.986   2.891
  459    HE1  MET  56           3HE      MET  56   4.316   6.355   2.569
  460    HE2  MET  56           1HE      MET  56   4.301   6.164   0.815
  461    HE3  MET  56           2HE      MET  56   2.781   6.255   1.705
  462    H    GLY  57           H        GLY  57   7.091   8.366   5.694
  463    HA2  GLY  57           2HA      GLY  57   8.036   8.815   7.737
  464    HA3  GLY  57           1HA      GLY  57   7.086  10.292   7.829
  465    H    VAL  58           H        VAL  58   5.501   7.194   7.310
  466    HA   VAL  58           HA       VAL  58   4.839   6.941  10.171
  467    HB   VAL  58           HB       VAL  58   2.967   8.280   9.306
  468   HG11  VAL  58          1HG1      VAL  58   1.458   7.503   7.510
  469   HG12  VAL  58          2HG1      VAL  58   2.513   6.117   7.225
  470   HG13  VAL  58          3HG1      VAL  58   3.098   7.751   6.902
  471   HG21  VAL  58          3HG2      VAL  58   2.104   5.403   9.712
  472   HG22  VAL  58          1HG2      VAL  58   1.080   6.828   9.913
  473   HG23  VAL  58          2HG2      VAL  58   2.448   6.562  10.998
  474    H    SER  59           H        SER  59   5.402   4.923  10.675
  475    HA   SER  59           HA       SER  59   5.505   2.730   8.818
  476    HB2  SER  59           2HB      SER  59   5.960   1.439  11.012
  477    HB3  SER  59           1HB      SER  59   7.091   2.731  10.620
  478    HG   SER  59           HG       SER  59   4.868   3.014  12.371
  479    H    ILE  60           H        ILE  60   3.884   1.265   8.406
  480    HA   ILE  60           HA       ILE  60   1.332   1.405   9.762
  481    HB   ILE  60           HB       ILE  60   2.263  -0.909   8.002
  482   HG12  ILE  60          2HG1      ILE  60   2.434   1.374   6.803
  483   HG13  ILE  60          1HG1      ILE  60   1.422   0.158   6.030
  484   HG21  ILE  60          1HG2      ILE  60  -0.182  -1.223   7.645
  485   HG22  ILE  60          2HG2      ILE  60  -0.517   0.114   8.747
  486   HG23  ILE  60          3HG2      ILE  60   0.257  -1.353   9.346
  487   HD11  ILE  60          3HD1      ILE  60   0.476   2.505   7.667
  488   HD12  ILE  60          1HD1      ILE  60  -0.579   1.252   6.999
  489   HD13  ILE  60          2HD1      ILE  60   0.350   2.301   5.921
  490    HA   PRO  61           HA       PRO  61   3.111  -1.225  13.086
  491    HB2  PRO  61           2HB      PRO  61   1.095  -0.908  14.896
  492    HB3  PRO  61           1HB      PRO  61   2.257   0.394  14.566
  493    HG2  PRO  61           2HG      PRO  61  -0.505   0.034  13.440
  494    HG3  PRO  61           1HG      PRO  61   0.236   1.488  14.149
  495    HD2  PRO  61           2HD      PRO  61   0.101   1.103  11.471
  496    HD3  PRO  61           1HD      PRO  61   1.462   1.961  12.228
  497    H    SER  62           H        SER  62   2.324  -3.161  14.249
  498    HA   SER  62           HA       SER  62   1.314  -5.072  12.472
  499    HB2  SER  62           2HB      SER  62   1.378  -6.572  14.508
  500    HB3  SER  62           1HB      SER  62   2.873  -5.684  14.202
  501    HG   SER  62           HG       SER  62   1.633  -5.719  16.440
  502    H    THR  63           H        THR  63  -0.344  -3.073  14.817
  503    HA   THR  63           HA       THR  63  -2.785  -4.554  14.967
  504    HB   THR  63           HB       THR  63  -2.076  -2.969  16.747
  505    HG1  THR  63           HG1      THR  63  -4.281  -3.514  16.494
  506   HG21  THR  63          3HG2      THR  63  -2.369  -0.543  16.479
  507   HG22  THR  63          1HG2      THR  63  -2.764  -0.763  14.773
  508   HG23  THR  63          2HG2      THR  63  -1.145  -1.145  15.361
  509    H    HIS  64           H        HIS  64  -1.518  -2.104  12.796
  510    HA   HIS  64           HA       HIS  64  -4.090  -1.866  11.355
  511    HB2  HIS  64           2HB      HIS  64  -1.612  -0.131  11.421
  512    HB3  HIS  64           1HB      HIS  64  -2.803   0.024  10.126
  513    HD1  HIS  64           HD1      HIS  64  -2.121   1.249  13.490
  514    HD2  HIS  64           HD2      HIS  64  -5.508   0.572  11.188
  515    HE1  HIS  64           HE1      HIS  64  -3.966   2.506  14.625
  516    HE2  HIS  64           HE2      HIS  64  -6.030   1.971  13.286
  517    H    ILE  65           H        ILE  65  -1.669  -3.997  11.283
  518    HA   ILE  65           HA       ILE  65  -1.515  -4.245   8.384
  519    HB   ILE  65           HB       ILE  65  -0.658  -6.304  10.469
  520   HG12  ILE  65          2HG1      ILE  65   0.641  -4.221  10.754
  521   HG13  ILE  65          1HG1      ILE  65   1.658  -5.493  10.092
  522   HG21  ILE  65          1HG2      ILE  65  -1.040  -7.264   8.232
  523   HG22  ILE  65          2HG2      ILE  65   0.681  -7.260   8.608
  524   HG23  ILE  65          3HG2      ILE  65   0.017  -6.052   7.503
  525   HD11  ILE  65          3HD1      ILE  65   1.474  -4.523   7.886
  526   HD12  ILE  65          1HD1      ILE  65   2.053  -3.337   9.058
  527   HD13  ILE  65          2HD1      ILE  65   0.378  -3.284   8.504
  528    H    THR  66           H        THR  66  -3.582  -4.461   7.691
  529    HA   THR  66           HA       THR  66  -4.836  -7.027   8.096
  530    HB   THR  66           HB       THR  66  -5.955  -5.877   9.879
  531    HG1  THR  66           HG1      THR  66  -7.331  -7.036   8.375
  532   HG21  THR  66          3HG2      THR  66  -6.530  -3.598   7.963
  533   HG22  THR  66          1HG2      THR  66  -5.368  -3.561   9.294
  534   HG23  THR  66          2HG2      THR  66  -7.095  -3.716   9.631
  535    H    GLY  67           H        GLY  67  -6.179  -7.611   6.415
  536    HA2  GLY  67           2HA      GLY  67  -5.491  -6.698   3.857
  537    HA3  GLY  67           1HA      GLY  67  -6.816  -7.781   4.245
  538    H    LYS  68           H        LYS  68  -8.178  -5.800   5.964
  539    HA   LYS  68           HA       LYS  68  -9.867  -4.692   3.961
  540    HB2  LYS  68           2HB      LYS  68 -11.169  -3.744   5.815
  541    HB3  LYS  68           1HB      LYS  68 -10.778  -5.435   6.087
  542    HG2  LYS  68           2HG      LYS  68  -9.068  -4.856   7.694
  543    HG3  LYS  68           1HG      LYS  68  -9.256  -3.133   7.349
  544    HD2  LYS  68           2HD      LYS  68 -11.467  -3.106   8.331
  545    HD3  LYS  68           1HD      LYS  68 -11.492  -4.868   8.462
  546    HE2  LYS  68           2HE      LYS  68  -9.584  -3.044   9.959
  547    HE3  LYS  68           1HE      LYS  68 -11.049  -3.753  10.639
  548    HZ1  LYS  68           3HZ      LYS  68  -8.756  -5.307   9.574
  549    HZ2  LYS  68           1HZ      LYS  68 -10.132  -5.939  10.315
  550    HZ3  LYS  68           2HZ      LYS  68  -9.048  -5.006  11.203
  551    H    TYR  69           H        TYR  69  -7.201  -3.303   5.790
  552    HA   TYR  69           HA       TYR  69  -7.801  -0.585   4.827
  553    HB2  TYR  69           2HB      TYR  69  -5.651  -1.656   6.685
  554    HB3  TYR  69           1HB      TYR  69  -5.735   0.028   6.167
  555    HD1  TYR  69           HD2      TYR  69  -8.994  -0.076   6.314
  556    HD2  TYR  69           HD1      TYR  69  -5.817  -0.904   9.060
  557    HE1  TYR  69           HE2      TYR  69 -10.480   0.444   8.192
  558    HE2  TYR  69           HE1      TYR  69  -7.309  -0.379  10.929
  559    HH   TYR  69           HH       TYR  69  -9.369   0.912  11.362
  560    H    PHE  70           H        PHE  70  -5.980  -3.305   3.865
  561    HA   PHE  70           HA       PHE  70  -4.176  -1.725   2.136
  562    HB2  PHE  70           2HB      PHE  70  -4.042  -4.559   3.205
  563    HB3  PHE  70           1HB      PHE  70  -3.103  -4.104   1.793
  564    HD1  PHE  70           HD2      PHE  70  -3.583  -3.331   5.426
  565    HD2  PHE  70           HD1      PHE  70  -1.036  -2.931   2.010
  566    HE1  PHE  70           HE2      PHE  70  -1.763  -2.543   6.866
  567    HE2  PHE  70           HE1      PHE  70   0.781  -2.136   3.463
  568    HZ   PHE  70           HZ       PHE  70   0.423  -1.946   5.894
  569    H    LYS  71           H        LYS  71  -7.207  -2.831   1.800
  570    HA   LYS  71           HA       LYS  71  -7.392  -4.881  -0.023
  571    HB2  LYS  71           2HB      LYS  71  -9.155  -2.399   0.007
  572    HB3  LYS  71           1HB      LYS  71  -9.546  -3.896  -0.842
  573    HG2  LYS  71           2HG      LYS  71  -9.530  -5.072   1.366
  574    HG3  LYS  71           1HG      LYS  71  -9.299  -3.503   2.133
  575    HD2  LYS  71           2HD      LYS  71 -11.698  -4.312   0.439
  576    HD3  LYS  71           1HD      LYS  71 -11.667  -4.187   2.196
  577    HE2  LYS  71           2HE      LYS  71 -12.711  -2.180   1.516
  578    HE3  LYS  71           1HE      LYS  71 -11.046  -1.687   1.809
  579    HZ1  LYS  71           3HZ      LYS  71 -12.112  -2.379  -0.874
  580    HZ2  LYS  71           1HZ      LYS  71 -10.622  -1.670  -0.519
  581    HZ3  LYS  71           2HZ      LYS  71 -12.045  -0.804  -0.268
  582    H    ASP  72           H        ASP  72  -7.095  -1.468  -0.794
  583    HA   ASP  72           HA       ASP  72  -6.134  -1.922  -3.469
  584    HB2  ASP  72           2HB      ASP  72  -7.984  -0.883  -4.665
  585    HB3  ASP  72           1HB      ASP  72  -8.652  -2.191  -3.697
  586    H    LEU  73           H        LEU  73  -6.304   0.538  -4.511
  587    HA   LEU  73           HA       LEU  73  -4.289   1.805  -2.951
  588    HB2  LEU  73           2HB      LEU  73  -4.320   1.784  -5.444
  589    HB3  LEU  73           1HB      LEU  73  -5.654   2.932  -5.412
  590    HG   LEU  73           HG       LEU  73  -4.220   4.641  -4.354
  591   HD11  LEU  73          1HD1      LEU  73  -2.838   3.148  -2.943
  592   HD12  LEU  73          2HD1      LEU  73  -1.827   4.218  -3.902
  593   HD13  LEU  73          3HD1      LEU  73  -2.019   2.533  -4.383
  594   HD21  LEU  73          3HD2      LEU  73  -2.583   5.016  -6.171
  595   HD22  LEU  73          1HD2      LEU  73  -4.155   4.537  -6.812
  596   HD23  LEU  73          2HD2      LEU  73  -2.837   3.365  -6.744
  597    H    ASN  74           H        ASN  74  -7.689   2.407  -3.429
  598    HA   ASN  74           HA       ASN  74  -7.803   5.005  -2.236
  599    HB2  ASN  74           2HB      ASN  74  -9.988   2.913  -2.634
  600    HB3  ASN  74           1HB      ASN  74 -10.266   4.583  -2.139
  601   HD21  ASN  74          1HD2      ASN  74  -9.351   2.491  -4.791
  602   HD22  ASN  74          2HD2      ASN  74  -9.527   3.686  -6.032
  603    H    ALA  75           H        ALA  75  -8.288   1.670  -1.019
  604    HA   ALA  75           HA       ALA  75  -9.085   2.205   1.605
  605    HB1  ALA  75           3HB      ALA  75  -9.109  -0.041   0.609
  606    HB2  ALA  75           1HB      ALA  75  -8.247  -0.049   2.153
  607    HB3  ALA  75           2HB      ALA  75  -7.346  -0.086   0.634
  608    H    ILE  76           H        ILE  76  -5.797   1.974   0.295
  609    HA   ILE  76           HA       ILE  76  -4.426   2.365   2.789
  610    HB   ILE  76           HB       ILE  76  -3.429   2.424  -0.087
  611   HG12  ILE  76          2HG1      ILE  76  -3.156   0.377   2.154
  612   HG13  ILE  76          1HG1      ILE  76  -4.188   0.204   0.737
  613   HG21  ILE  76          1HG2      ILE  76  -1.738   2.564   2.454
  614   HG22  ILE  76          2HG2      ILE  76  -1.951   3.879   1.299
  615   HG23  ILE  76          3HG2      ILE  76  -1.107   2.410   0.807
  616   HD11  ILE  76          3HD1      ILE  76  -2.168   0.130  -0.668
  617   HD12  ILE  76          1HD1      ILE  76  -2.230  -1.152   0.544
  618   HD13  ILE  76          2HD1      ILE  76  -1.177   0.242   0.794
  619    H    SER  77           H        SER  77  -5.231   4.510   0.025
  620    HA   SER  77           HA       SER  77  -3.733   6.734   0.958
  621    HB2  SER  77           2HB      SER  77  -5.058   8.057  -0.685
  622    HB3  SER  77           1HB      SER  77  -4.409   6.573  -1.374
  623    HG   SER  77           HG       SER  77  -6.795   6.021  -0.383
  624    H    ARG  78           H        ARG  78  -6.790   5.495   1.985
  625    HA   ARG  78           HA       ARG  78  -7.540   7.933   3.404
  626    HB2  ARG  78           2HB      ARG  78  -8.801   5.165   3.511
  627    HB3  ARG  78           1HB      ARG  78  -9.466   6.627   4.243
  628    HG2  ARG  78           2HG      ARG  78  -9.117   6.075   1.284
  629    HG3  ARG  78           1HG      ARG  78 -10.633   6.169   2.173
  630    HD2  ARG  78           2HD      ARG  78 -10.290   8.554   2.574
  631    HD3  ARG  78           1HD      ARG  78  -8.703   8.486   1.796
  632    HE   ARG  78           HE       ARG  78 -10.320   7.581  -0.148
  633   HH11  ARG  78          1HH1      ARG  78 -10.469  10.462   1.836
  634   HH12  ARG  78          2HH1      ARG  78 -11.275  11.396   0.619
  635   HH21  ARG  78          1HH2      ARG  78 -11.389   8.793  -1.709
  636   HH22  ARG  78          2HH2      ARG  78 -11.796  10.449  -1.394
  637    H    THR  79           H        THR  79  -6.452   4.629   4.211
  638    HA   THR  79           HA       THR  79  -6.486   4.885   7.012
  639    HB   THR  79           HB       THR  79  -4.748   3.040   5.316
  640    HG1  THR  79           HG1      THR  79  -6.566   2.042   4.944
  641   HG21  THR  79          3HG2      THR  79  -3.972   3.089   7.682
  642   HG22  THR  79          1HG2      THR  79  -4.733   1.543   7.291
  643   HG23  THR  79          2HG2      THR  79  -5.618   2.750   8.224
  644    H    VAL  80           H        VAL  80  -3.978   5.631   4.663
  645    HA   VAL  80           HA       VAL  80  -1.815   5.901   6.497
  646    HB   VAL  80           HB       VAL  80  -1.579   5.422   4.015
  647   HG11  VAL  80          1HG1      VAL  80  -2.094   8.400   3.653
  648   HG12  VAL  80          2HG1      VAL  80  -3.163   7.094   3.126
  649   HG13  VAL  80          3HG1      VAL  80  -1.563   7.277   2.400
  650   HG21  VAL  80          3HG2      VAL  80   0.497   6.724   3.706
  651   HG22  VAL  80          1HG2      VAL  80   0.385   6.062   5.339
  652   HG23  VAL  80          2HG2      VAL  80   0.047   7.772   5.054
  653    H    GLU  81           H        GLU  81  -4.258   8.125   5.228
  654    HA   GLU  81           HA       GLU  81  -3.192  10.550   6.310
  655    HB2  GLU  81           2HB      GLU  81  -6.025   9.757   5.539
  656    HB3  GLU  81           1HB      GLU  81  -5.591  11.382   6.058
  657    HG2  GLU  81           2HG      GLU  81  -4.535   9.948   3.605
  658    HG3  GLU  81           1HG      GLU  81  -5.748  11.224   3.615
  659    H    GLN  82           H        GLN  82  -5.470   8.111   7.473
  660    HA   GLN  82           HA       GLN  82  -6.259   9.310   9.900
  661    HB2  GLN  82           2HB      GLN  82  -6.011   6.346   9.251
  662    HB3  GLN  82           1HB      GLN  82  -6.915   7.016  10.605
  663    HG2  GLN  82           2HG      GLN  82  -7.533   7.419   7.669
  664    HG3  GLN  82           1HG      GLN  82  -8.396   6.366   8.784
  665   HE21  GLN  82          1HE2      GLN  82  -9.689   7.303  10.403
  666   HE22  GLN  82          2HE2      GLN  82 -10.267   8.927  10.282
  667    H    LEU  83           H        LEU  83  -3.590   7.161   9.109
  668    HA   LEU  83           HA       LEU  83  -2.624   6.799  11.760
  669    HB2  LEU  83           2HB      LEU  83  -1.243   6.361   9.097
  670    HB3  LEU  83           1HB      LEU  83  -0.595   5.861  10.655
  671    HG   LEU  83           HG       LEU  83  -3.138   4.811   9.363
  672   HD11  LEU  83          1HD1      LEU  83  -0.490   3.460   9.907
  673   HD12  LEU  83          2HD1      LEU  83  -1.092   3.978   8.331
  674   HD13  LEU  83          3HD1      LEU  83  -1.928   2.700   9.213
  675   HD21  LEU  83          3HD2      LEU  83  -1.911   4.081  12.048
  676   HD22  LEU  83          1HD2      LEU  83  -3.263   3.243  11.272
  677   HD23  LEU  83          2HD2      LEU  83  -3.448   4.913  11.794
  678    H    LYS  84           H        LYS  84  -1.723   9.052   9.149
  679    HA   LYS  84           HA       LYS  84   0.398  10.285  10.651
  680    HB2  LYS  84           2HB      LYS  84  -1.162  11.302   8.242
  681    HB3  LYS  84           1HB      LYS  84   0.232  12.135   8.932
  682    HG2  LYS  84           2HG      LYS  84   1.611  10.098   8.497
  683    HG3  LYS  84           1HG      LYS  84   0.224   9.363   7.701
  684    HD2  LYS  84           2HD      LYS  84   1.549  11.944   6.786
  685    HD3  LYS  84           1HD      LYS  84   1.937  10.352   6.142
  686    HE2  LYS  84           2HE      LYS  84   0.429  11.272   4.569
  687    HE3  LYS  84           1HE      LYS  84  -0.564  10.176   5.527
  688    HZ1  LYS  84           3HZ      LYS  84  -1.614  12.335   5.086
  689    HZ2  LYS  84           1HZ      LYS  84  -0.398  13.107   5.969
  690    HZ3  LYS  84           2HZ      LYS  84  -1.441  12.030   6.737
  691    H    ALA  85           H        ALA  85  -3.051  10.664  10.624
  692    HA   ALA  85           HA       ALA  85  -3.188  13.169  12.021
  693    HB1  ALA  85           3HB      ALA  85  -5.552  12.611  12.345
  694    HB2  ALA  85           1HB      ALA  85  -5.254  10.946  11.840
  695    HB3  ALA  85           2HB      ALA  85  -5.072  12.267  10.679
  696    H    GLU  86           H        GLU  86  -3.260   9.742  12.969
  697    HA   GLU  86           HA       GLU  86  -3.620  10.153  15.780
  698    HB2  GLU  86           2HB      GLU  86  -2.556   7.778  14.198
  699    HB3  GLU  86           1HB      GLU  86  -2.904   7.727  15.923
  700    HG2  GLU  86           2HG      GLU  86  -4.911   8.179  13.690
  701    HG3  GLU  86           1HG      GLU  86  -4.723   6.719  14.652
  702    H    SER  87           H        SER  87  -0.819   9.447  13.767
  703    HA   SER  87           HA       SER  87   1.148   9.450  15.838
  704    HB2  SER  87           2HB      SER  87   1.379   8.145  13.737
  705    HB3  SER  87           1HB      SER  87   1.446   9.640  12.807
  706    HG   SER  87           HG       SER  87   3.338  10.150  13.943
  707    H    ALA  88           H        ALA  88  -0.466  11.950  14.166
  708    HA   ALA  88           HA       ALA  88  -0.351  14.178  14.072
  709    HB1  ALA  88           3HB      ALA  88   1.982  13.996  15.998
  710    HB2  ALA  88           1HB      ALA  88   0.281  14.142  16.436
  711    HB3  ALA  88           2HB      ALA  88   1.087  15.465  15.594
  712    H    LEU  89           H        LEU  89   0.278  15.227  12.304
  713    HA   LEU  89           HA       LEU  89   2.681  14.254  10.917
  714    HB2  LEU  89           2HB      LEU  89   1.658  15.228   8.837
  715    HB3  LEU  89           1HB      LEU  89   0.766  13.920   9.557
  716    HG   LEU  89           HG       LEU  89  -0.694  15.687   8.534
  717   HD11  LEU  89          1HD1      LEU  89  -2.320  15.903  10.384
  718   HD12  LEU  89          2HD1      LEU  89  -1.085  15.351  11.521
  719   HD13  LEU  89          3HD1      LEU  89  -1.669  14.269  10.254
  720   HD21  LEU  89          3HD2      LEU  89   0.263  17.507  10.762
  721   HD22  LEU  89          1HD2      LEU  89  -1.004  17.874   9.587
  722   HD23  LEU  89          2HD2      LEU  89   0.666  17.682   9.052
  723    H    GLU  90           H        GLU  90   2.427  16.529  13.039
  724    HA   GLU  90           HA       GLU  90   3.335  18.903  11.712
  725    HB2  GLU  90           2HB      GLU  90   3.391  18.061  14.648
  726    HB3  GLU  90           1HB      GLU  90   3.970  19.624  14.079
  727    HG2  GLU  90           2HG      GLU  90   1.715  19.785  15.009
  728    HG3  GLU  90           1HG      GLU  90   1.749  20.229  13.307
  729   H281  4EM 101          2H28      PYA 142   1.911 -10.673   8.265
  730   H283  4EM 101          3H28      PYA 142   1.758 -12.405   8.534
  731   H303  4EM 101          3H30      PYA 142  -1.561  -9.806   9.196
  732   H301  4EM 101          1H30      PYA 142  -0.999 -10.184   7.561
  733   H302  4EM 101          2H30      PYA 142  -0.024  -9.163   8.628
  734   H312  4EM 101          2H31      PYA 142  -0.383 -10.862  11.196
  735   H313  4EM 101          3H31      PYA 142   1.015 -11.901  10.921
  736   H311  4EM 101          1H31      PYA 142   1.134 -10.165  10.607
  737    H32  4EM 101           H32      PYA 142  -1.284 -12.585   8.023
  738    H33  4EM 101           H33      PYA 142   0.403 -13.894   8.716
  739    H36  4EM 101           H36      PYA 142  -1.631 -13.905  10.996
  740   H373  4EM 101          3H37      PYA 142  -3.486 -14.305  12.278
  741   H372  4EM 101          2H37      PYA 142  -3.079 -12.686  12.820
  742   H382  4EM 101          2H38      PYA 142  -4.713 -11.732  11.251
  743   H383  4EM 101          3H38      PYA 142  -5.482 -12.868  12.356
  744    H41  4EM 101           H41      PYA 142  -4.967 -12.002   9.116
  745   H423  4EM 101          3H42      PYA 142  -6.746 -14.043   8.094
  746   H422  4EM 101          2H42      PYA 142  -5.081 -14.140   7.507
  747   H433  4EM 101          3H43      PYA 142  -6.876 -11.718   7.240
  748   H432  4EM 101          2H43      PYA 142  -6.564 -12.897   5.962
  749    H44  4EM 101           H44      PYA 142  -4.293 -12.361   6.155
  750    H49  4EM 101           H49      PYA 142  -3.472  -8.158   7.212
  751    H51  4EM 101           H51      PYA 142  -1.172  -8.055   5.973
  752    H50  4EM 101           H50      PYA 142  -0.861 -10.286   4.682
  753    H48  4EM 101           H48      PYA 142  -3.029 -11.628   4.989
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1   2.173  18.220  -4.416
    2    H2   MET   1           2H       MET   1   1.734  19.637  -3.614
    3    H3   MET   1           3H       MET   1   0.578  18.444  -3.920
    4    HA   MET   1           HA       MET   1   2.935  18.157  -2.172
    5    HB2  MET   1           2HB      MET   1   1.318  18.106  -0.306
    6    HB3  MET   1           1HB      MET   1   1.246  19.627  -1.172
    7    HG2  MET   1           2HG      MET   1  -0.817  18.854  -2.321
    8    HG3  MET   1           1HG      MET   1  -0.756  17.362  -1.376
    9    HE1  MET   1           3HE      MET   1  -3.272  19.458  -1.473
   10    HE2  MET   1           1HE      MET   1  -3.745  19.512   0.228
   11    HE3  MET   1           2HE      MET   1  -3.346  17.970  -0.528
   12    H    ASP   2           H        ASP   2   2.322  16.231  -0.588
   13    HA   ASP   2           HA       ASP   2   2.094  13.831  -2.169
   14    HB2  ASP   2           2HB      ASP   2   2.498  12.650  -0.068
   15    HB3  ASP   2           1HB      ASP   2   3.616  14.001  -0.199
   16    H    GLY   3           H        GLY   3   0.661  12.193  -0.251
   17    HA2  GLY   3           2HA      GLY   3  -1.470  11.654   0.489
   18    HA3  GLY   3           1HA      GLY   3  -2.058  13.211  -0.091
   19    H    GLU   4           H        GLU   4  -1.833  13.427  -2.573
   20    HA   GLU   4           HA       GLU   4  -3.121  11.140  -3.865
   21    HB2  GLU   4           2HB      GLU   4  -2.498  13.912  -4.962
   22    HB3  GLU   4           1HB      GLU   4  -3.464  12.686  -5.775
   23    HG2  GLU   4           2HG      GLU   4  -5.100  12.771  -3.896
   24    HG3  GLU   4           1HG      GLU   4  -4.160  14.082  -3.178
   25    H    GLU   5           H        GLU   5  -0.178  13.039  -4.150
   26    HA   GLU   5           HA       GLU   5   0.982  12.050  -6.471
   27    HB2  GLU   5           2HB      GLU   5   1.820  14.014  -5.327
   28    HB3  GLU   5           1HB      GLU   5   2.221  13.078  -3.890
   29    HG2  GLU   5           2HG      GLU   5   3.938  11.852  -5.232
   30    HG3  GLU   5           1HG      GLU   5   3.559  12.895  -6.601
   31    H    VAL   6           H        VAL   6   1.163  10.810  -3.191
   32    HA   VAL   6           HA       VAL   6   3.178   8.869  -3.749
   33    HB   VAL   6           HB       VAL   6   2.936   9.983  -1.542
   34   HG11  VAL   6          1HG1      VAL   6   1.245   9.221   0.086
   35   HG12  VAL   6          2HG1      VAL   6   0.471   8.250  -1.165
   36   HG13  VAL   6          3HG1      VAL   6   0.492  10.010  -1.304
   37   HG21  VAL   6          3HG2      VAL   6   2.776   6.963  -1.431
   38   HG22  VAL   6          1HG2      VAL   6   3.444   8.008  -0.178
   39   HG23  VAL   6          2HG2      VAL   6   4.227   7.914  -1.757
   40    H    LYS   7           H        LYS   7  -0.306   8.849  -3.842
   41    HA   LYS   7           HA       LYS   7  -1.006   6.244  -3.226
   42    HB2  LYS   7           2HB      LYS   7  -2.209   8.038  -5.387
   43    HB3  LYS   7           1HB      LYS   7  -2.961   6.564  -4.796
   44    HG2  LYS   7           2HG      LYS   7  -2.969   7.627  -2.501
   45    HG3  LYS   7           1HG      LYS   7  -2.475   9.121  -3.293
   46    HD2  LYS   7           2HD      LYS   7  -5.043   7.586  -3.850
   47    HD3  LYS   7           1HD      LYS   7  -4.911   9.059  -2.899
   48    HE2  LYS   7           2HE      LYS   7  -5.682   9.843  -4.958
   49    HE3  LYS   7           1HE      LYS   7  -3.951  10.106  -5.094
   50    HZ1  LYS   7           3HZ      LYS   7  -3.763   8.137  -6.429
   51    HZ2  LYS   7           1HZ      LYS   7  -4.945   9.139  -7.090
   52    HZ3  LYS   7           2HZ      LYS   7  -5.397   7.767  -6.214
   53    H    GLU   8           H        GLU   8  -0.262   7.493  -6.460
   54    HA   GLU   8           HA       GLU   8  -0.365   4.967  -7.765
   55    HB2  GLU   8           2HB      GLU   8   0.610   6.217  -9.713
   56    HB3  GLU   8           1HB      GLU   8  -0.847   6.935  -9.039
   57    HG2  GLU   8           2HG      GLU   8   0.560   8.591  -7.818
   58    HG3  GLU   8           1HG      GLU   8   1.993   7.900  -8.583
   59    H    LYS   9           H        LYS   9   2.275   6.755  -6.223
   60    HA   LYS   9           HA       LYS   9   4.405   5.208  -7.319
   61    HB2  LYS   9           2HB      LYS   9   4.382   6.683  -4.661
   62    HB3  LYS   9           1HB      LYS   9   5.805   6.112  -5.525
   63    HG2  LYS   9           2HG      LYS   9   5.150   7.680  -7.417
   64    HG3  LYS   9           1HG      LYS   9   3.941   8.359  -6.322
   65    HD2  LYS   9           2HD      LYS   9   6.957   8.361  -5.979
   66    HD3  LYS   9           1HD      LYS   9   5.911   9.753  -6.229
   67    HE2  LYS   9           2HE      LYS   9   4.916   9.425  -4.006
   68    HE3  LYS   9           1HE      LYS   9   5.915   7.991  -3.753
   69    HZ1  LYS   9           3HZ      LYS   9   6.858   9.897  -2.661
   70    HZ2  LYS   9           1HZ      LYS   9   6.925  10.764  -4.114
   71    HZ3  LYS   9           2HZ      LYS   9   7.883   9.384  -3.898
   72    H    ILE  10           H        ILE  10   2.177   4.689  -4.668
   73    HA   ILE  10           HA       ILE  10   3.464   2.489  -3.414
   74    HB   ILE  10           HB       ILE  10   0.460   2.962  -3.682
   75   HG12  ILE  10          2HG1      ILE  10   1.467   4.912  -2.631
   76   HG13  ILE  10          1HG1      ILE  10   0.618   3.991  -1.399
   77   HG21  ILE  10          1HG2      ILE  10   0.937   0.665  -2.982
   78   HG22  ILE  10          2HG2      ILE  10   0.253   1.574  -1.633
   79   HG23  ILE  10          3HG2      ILE  10   1.987   1.250  -1.689
   80   HD11  ILE  10          3HD1      ILE  10   2.724   4.841  -0.554
   81   HD12  ILE  10          1HD1      ILE  10   3.607   4.032  -1.849
   82   HD13  ILE  10          2HD1      ILE  10   2.771   3.078  -0.616
   83    H    ARG  11           H        ARG  11   1.141   2.706  -6.116
   84    HA   ARG  11           HA       ARG  11   0.956  -0.033  -6.745
   85    HB2  ARG  11           2HB      ARG  11   0.651   2.399  -8.529
   86    HB3  ARG  11           1HB      ARG  11   0.410   0.760  -9.126
   87    HG2  ARG  11           2HG      ARG  11  -1.217   2.219  -7.041
   88    HG3  ARG  11           1HG      ARG  11  -1.742   1.656  -8.628
   89    HD2  ARG  11           2HD      ARG  11  -1.160  -0.722  -7.726
   90    HD3  ARG  11           1HD      ARG  11  -1.172   0.038  -6.137
   91    HE   ARG  11           HE       ARG  11  -3.535   0.377  -7.819
   92   HH11  ARG  11          1HH1      ARG  11  -2.067  -1.257  -5.120
   93   HH12  ARG  11          2HH1      ARG  11  -3.573  -1.843  -4.492
   94   HH21  ARG  11          1HH2      ARG  11  -5.506  -0.421  -7.028
   95   HH22  ARG  11          2HH2      ARG  11  -5.538  -1.373  -5.577
   96    H    ARG  12           H        ARG  12   3.177   2.428  -8.029
   97    HA   ARG  12           HA       ARG  12   4.555   0.804  -9.870
   98    HB2  ARG  12           2HB      ARG  12   5.196   3.412  -8.483
   99    HB3  ARG  12           1HB      ARG  12   6.488   2.594  -9.349
  100    HG2  ARG  12           2HG      ARG  12   5.512   4.242 -10.818
  101    HG3  ARG  12           1HG      ARG  12   5.095   2.639 -11.419
  102    HD2  ARG  12           2HD      ARG  12   2.858   2.867 -10.379
  103    HD3  ARG  12           1HD      ARG  12   3.285   4.490  -9.842
  104    HE   ARG  12           HE       ARG  12   2.945   3.638 -12.655
  105   HH11  ARG  12          1HH1      ARG  12   2.939   6.196 -10.259
  106   HH12  ARG  12          2HH1      ARG  12   2.337   7.394 -11.360
  107   HH21  ARG  12          1HH2      ARG  12   2.117   5.202 -14.072
  108   HH22  ARG  12          2HH2      ARG  12   1.873   6.827 -13.516
  109    H    TYR  13           H        TYR  13   5.188   1.453  -6.463
  110    HA   TYR  13           HA       TYR  13   7.616   0.031  -6.174
  111    HB2  TYR  13           2HB      TYR  13   6.911   1.612  -4.485
  112    HB3  TYR  13           1HB      TYR  13   5.435   0.710  -4.177
  113    HD1  TYR  13           HD1      TYR  13   9.163   0.069  -4.172
  114    HD2  TYR  13           HD2      TYR  13   5.423  -0.560  -2.198
  115    HE1  TYR  13           HE1      TYR  13  10.326  -1.085  -2.360
  116    HE2  TYR  13           HE2      TYR  13   6.601  -1.718  -0.373
  117    HH   TYR  13           HH       TYR  13   9.862  -1.526   0.139
  118    H    ILE  14           H        ILE  14   4.245  -1.002  -5.711
  119    HA   ILE  14           HA       ILE  14   4.760  -3.631  -4.796
  120    HB   ILE  14           HB       ILE  14   2.283  -2.462  -6.144
  121   HG12  ILE  14          2HG1      ILE  14   2.843  -3.044  -3.198
  122   HG13  ILE  14          1HG1      ILE  14   2.958  -1.449  -3.928
  123   HG21  ILE  14          1HG2      ILE  14   2.265  -4.912  -6.409
  124   HG22  ILE  14          2HG2      ILE  14   1.041  -4.420  -5.241
  125   HG23  ILE  14          3HG2      ILE  14   2.562  -5.119  -4.683
  126   HD11  ILE  14          3HD1      ILE  14   0.905  -1.674  -2.715
  127   HD12  ILE  14          1HD1      ILE  14   0.468  -3.115  -3.629
  128   HD13  ILE  14          2HD1      ILE  14   0.549  -1.546  -4.437
  129    H    MET  15           H        MET  15   4.134  -2.337  -8.053
  130    HA   MET  15           HA       MET  15   4.093  -4.858  -9.391
  131    HB2  MET  15           2HB      MET  15   4.657  -2.069 -10.515
  132    HB3  MET  15           1HB      MET  15   4.285  -3.499 -11.475
  133    HG2  MET  15           2HG      MET  15   2.445  -2.188  -9.476
  134    HG3  MET  15           1HG      MET  15   2.340  -2.044 -11.228
  135    HE1  MET  15           3HE      MET  15   1.265  -5.588 -12.335
  136    HE2  MET  15           1HE      MET  15   2.880  -4.885 -12.313
  137    HE3  MET  15           2HE      MET  15   1.500  -3.910 -12.819
  138    H    GLU  16           H        GLU  16   6.718  -2.435  -8.945
  139    HA   GLU  16           HA       GLU  16   8.472  -3.897 -10.720
  140    HB2  GLU  16           2HB      GLU  16   8.999  -1.463  -8.986
  141    HB3  GLU  16           1HB      GLU  16  10.143  -2.125 -10.145
  142    HG2  GLU  16           2HG      GLU  16   7.464  -0.851 -10.730
  143    HG3  GLU  16           1HG      GLU  16   9.061  -0.234 -11.144
  144    H    ASP  17           H        ASP  17   8.159  -3.551  -7.222
  145    HA   ASP  17           HA       ASP  17  10.603  -5.142  -6.761
  146    HB2  ASP  17           2HB      ASP  17  10.288  -3.042  -5.450
  147    HB3  ASP  17           1HB      ASP  17   8.810  -3.702  -4.761
  148    H    LEU  18           H        LEU  18   7.188  -5.111  -5.652
  149    HA   LEU  18           HA       LEU  18   7.450  -7.598  -4.274
  150    HB2  LEU  18           2HB      LEU  18   5.032  -5.898  -4.914
  151    HB3  LEU  18           1HB      LEU  18   4.912  -7.399  -4.026
  152    HG   LEU  18           HG       LEU  18   6.395  -6.425  -2.246
  153   HD11  LEU  18          1HD1      LEU  18   6.065  -3.798  -3.726
  154   HD12  LEU  18          2HD1      LEU  18   7.576  -4.691  -3.561
  155   HD13  LEU  18          3HD1      LEU  18   6.794  -4.011  -2.134
  156   HD21  LEU  18          3HD2      LEU  18   4.679  -4.987  -1.261
  157   HD22  LEU  18          1HD2      LEU  18   3.956  -6.412  -2.004
  158   HD23  LEU  18          2HD2      LEU  18   3.875  -4.850  -2.828
  159    H    ILE  19           H        ILE  19   5.918  -6.741  -7.402
  160    HA   ILE  19           HA       ILE  19   5.364  -9.535  -8.032
  161    HB   ILE  19           HB       ILE  19   5.086  -7.012  -9.721
  162   HG12  ILE  19          2HG1      ILE  19   2.652  -7.577  -9.761
  163   HG13  ILE  19          1HG1      ILE  19   2.969  -8.952  -8.732
  164   HG21  ILE  19          1HG2      ILE  19   4.513  -9.868 -10.586
  165   HG22  ILE  19          2HG2      ILE  19   5.780  -8.818 -11.224
  166   HG23  ILE  19          3HG2      ILE  19   4.084  -8.424 -11.509
  167   HD11  ILE  19          3HD1      ILE  19   3.605  -7.465  -6.927
  168   HD12  ILE  19          1HD1      ILE  19   1.975  -7.146  -7.517
  169   HD13  ILE  19          2HD1      ILE  19   3.301  -6.075  -7.976
  170    H    GLY  20           H        GLY  20   7.482  -6.954  -9.249
  171    HA2  GLY  20           2HA      GLY  20   9.884  -7.362  -9.513
  172    HA3  GLY  20           1HA      GLY  20   9.494  -8.967 -10.122
  173    HA   PRO  21           HA       PRO  21  10.039  -6.279 -13.902
  174    HB2  PRO  21           2HB      PRO  21  11.582  -8.041 -15.320
  175    HB3  PRO  21           1HB      PRO  21  12.261  -6.958 -14.090
  176    HG2  PRO  21           2HG      PRO  21  11.518  -9.852 -13.821
  177    HG3  PRO  21           1HG      PRO  21  12.998  -9.012 -13.300
  178    HD2  PRO  21           2HD      PRO  21  10.986  -9.551 -11.568
  179    HD3  PRO  21           1HD      PRO  21  11.992  -8.094 -11.422
  180    H    SER  22           H        SER  22   8.496  -9.198 -13.147
  181    HA   SER  22           HA       SER  22   7.262  -9.578 -15.789
  182    HB2  SER  22           2HB      SER  22   6.802 -11.075 -13.177
  183    HB3  SER  22           1HB      SER  22   6.234 -11.574 -14.776
  184    HG   SER  22           HG       SER  22   8.842 -11.517 -13.726
  185    H    ALA  23           H        ALA  23   6.868  -7.152 -14.013
  186    HA   ALA  23           HA       ALA  23   4.343  -7.062 -12.823
  187    HB1  ALA  23           3HB      ALA  23   4.546  -4.615 -12.999
  188    HB2  ALA  23           1HB      ALA  23   5.904  -4.811 -14.110
  189    HB3  ALA  23           2HB      ALA  23   6.043  -5.367 -12.437
  190    H    LYS  24           H        LYS  24   2.387  -7.304 -13.705
  191    HA   LYS  24           HA       LYS  24   1.989  -6.935 -16.590
  192    HB2  LYS  24           2HB      LYS  24   0.524  -8.579 -14.500
  193    HB3  LYS  24           1HB      LYS  24  -0.076  -8.370 -16.143
  194    HG2  LYS  24           2HG      LYS  24   1.753  -9.558 -17.077
  195    HG3  LYS  24           1HG      LYS  24   2.678  -9.494 -15.582
  196    HD2  LYS  24           2HD      LYS  24   0.034 -10.961 -15.748
  197    HD3  LYS  24           1HD      LYS  24   1.547 -11.724 -16.234
  198    HE2  LYS  24           2HE      LYS  24   1.083 -12.349 -13.949
  199    HE3  LYS  24           1HE      LYS  24   2.468 -11.261 -13.965
  200    HZ1  LYS  24           3HZ      LYS  24  -0.314 -10.479 -13.288
  201    HZ2  LYS  24           1HZ      LYS  24   1.039  -9.469 -13.237
  202    HZ3  LYS  24           2HZ      LYS  24   0.914 -10.770 -12.174
  203    H    GLU  25           H        GLU  25   1.255  -4.934 -16.987
  204    HA   GLU  25           HA       GLU  25  -0.368  -3.152 -15.718
  205    HB2  GLU  25           2HB      GLU  25  -1.316  -2.611 -18.013
  206    HB3  GLU  25           1HB      GLU  25   0.434  -2.710 -17.952
  207    HG2  GLU  25           2HG      GLU  25   0.377  -4.976 -18.878
  208    HG3  GLU  25           1HG      GLU  25  -1.385  -4.927 -18.911
  209    H    ASP  26           H        ASP  26  -1.342  -6.235 -17.023
  210    HA   ASP  26           HA       ASP  26  -4.062  -6.110 -17.268
  211    HB2  ASP  26           2HB      ASP  26  -2.417  -8.471 -16.255
  212    HB3  ASP  26           1HB      ASP  26  -4.035  -8.578 -16.939
  213    H    GLU  27           H        GLU  27  -2.144  -6.606 -14.334
  214    HA   GLU  27           HA       GLU  27  -4.535  -7.067 -12.681
  215    HB2  GLU  27           2HB      GLU  27  -3.059  -7.714 -10.930
  216    HB3  GLU  27           1HB      GLU  27  -2.393  -8.399 -12.402
  217    HG2  GLU  27           2HG      GLU  27  -0.883  -6.273 -12.419
  218    HG3  GLU  27           1HG      GLU  27  -1.341  -6.124 -10.728
  219    H    LEU  28           H        LEU  28  -2.504  -4.424 -13.610
  220    HA   LEU  28           HA       LEU  28  -2.671  -3.058 -11.086
  221    HB2  LEU  28           2HB      LEU  28  -0.634  -3.144 -12.698
  222    HB3  LEU  28           1HB      LEU  28  -1.444  -1.878 -13.597
  223    HG   LEU  28           HG       LEU  28   0.343  -1.117 -11.927
  224   HD11  LEU  28          1HD1      LEU  28  -1.319   0.504 -12.780
  225   HD12  LEU  28          2HD1      LEU  28  -0.839   0.859 -11.123
  226   HD13  LEU  28          3HD1      LEU  28  -2.394   0.090 -11.444
  227   HD21  LEU  28          3HD2      LEU  28  -0.178  -1.022  -9.557
  228   HD22  LEU  28          1HD2      LEU  28  -0.248  -2.697 -10.095
  229   HD23  LEU  28          2HD2      LEU  28  -1.741  -1.795  -9.819
  230    H    ASP  29           H        ASP  29  -4.284  -1.893 -10.523
  231    HA   ASP  29           HA       ASP  29  -5.112   0.418 -12.067
  232    HB2  ASP  29           2HB      ASP  29  -6.861  -1.385 -12.619
  233    HB3  ASP  29           1HB      ASP  29  -7.221  -1.433 -10.897
  234    H    ASP  30           H        ASP  30  -6.302   1.927 -10.559
  235    HA   ASP  30           HA       ASP  30  -4.901   1.924  -8.044
  236    HB2  ASP  30           2HB      ASP  30  -5.689   4.126  -7.678
  237    HB3  ASP  30           1HB      ASP  30  -5.407   4.023  -9.407
  238    H    GLN  31           H        GLN  31  -8.134   1.144  -9.099
  239    HA   GLN  31           HA       GLN  31  -9.080   0.774  -6.342
  240    HB2  GLN  31           2HB      GLN  31 -10.515   0.506  -9.009
  241    HB3  GLN  31           1HB      GLN  31 -11.277   0.322  -7.434
  242    HG2  GLN  31           2HG      GLN  31 -10.757   2.677  -6.907
  243    HG3  GLN  31           1HG      GLN  31 -10.005   2.870  -8.493
  244   HE21  GLN  31          1HE2      GLN  31 -11.355   2.889 -10.361
  245   HE22  GLN  31          2HE2      GLN  31 -13.051   3.196 -10.239
  246    H    THR  32           H        THR  32  -7.339  -1.123  -8.524
  247    HA   THR  32           HA       THR  32  -8.611  -3.623  -8.346
  248    HB   THR  32           HB       THR  32  -5.677  -2.998  -8.694
  249    HG1  THR  32           HG1      THR  32  -6.347  -4.098 -10.790
  250   HG21  THR  32          3HG2      THR  32  -5.727  -5.181  -7.601
  251   HG22  THR  32          1HG2      THR  32  -5.401  -5.420  -9.317
  252   HG23  THR  32          2HG2      THR  32  -7.016  -5.738  -8.674
  253    HA   PRO  33           HA       PRO  33  -7.882  -4.325  -3.904
  254    HB2  PRO  33           2HB      PRO  33  -9.385  -6.607  -3.731
  255    HB3  PRO  33           1HB      PRO  33 -10.103  -4.982  -3.788
  256    HG2  PRO  33           2HG      PRO  33  -9.850  -7.009  -5.962
  257    HG3  PRO  33           1HG      PRO  33 -11.190  -5.904  -5.601
  258    HD2  PRO  33           2HD      PRO  33  -9.328  -5.465  -7.571
  259    HD3  PRO  33           1HD      PRO  33 -10.245  -4.169  -6.773
  260    H    LEU  34           H        LEU  34  -5.855  -4.893  -3.649
  261    HA   LEU  34           HA       LEU  34  -4.308  -6.738  -5.018
  262    HB2  LEU  34           2HB      LEU  34  -3.906  -5.615  -2.233
  263    HB3  LEU  34           1HB      LEU  34  -2.656  -6.329  -3.241
  264    HG   LEU  34           HG       LEU  34  -4.191  -3.835  -4.050
  265   HD11  LEU  34          1HD1      LEU  34  -2.999  -3.359  -1.974
  266   HD12  LEU  34          2HD1      LEU  34  -2.254  -2.528  -3.337
  267   HD13  LEU  34          3HD1      LEU  34  -1.497  -3.981  -2.673
  268   HD21  LEU  34          3HD2      LEU  34  -1.594  -5.023  -5.104
  269   HD22  LEU  34          1HD2      LEU  34  -2.320  -3.503  -5.632
  270   HD23  LEU  34          2HD2      LEU  34  -3.150  -5.026  -5.937
  271    H    LEU  35           H        LEU  35  -5.843  -7.094  -1.779
  272    HA   LEU  35           HA       LEU  35  -4.866  -9.702  -1.234
  273    HB2  LEU  35           2HB      LEU  35  -7.313  -8.249  -0.190
  274    HB3  LEU  35           1HB      LEU  35  -6.926  -9.885   0.315
  275    HG   LEU  35           HG       LEU  35  -6.172  -8.384   2.017
  276   HD11  LEU  35          1HD1      LEU  35  -3.791  -8.928   2.214
  277   HD12  LEU  35          2HD1      LEU  35  -3.717  -9.371   0.507
  278   HD13  LEU  35          3HD1      LEU  35  -4.700 -10.320   1.627
  279   HD21  LEU  35          3HD2      LEU  35  -6.022  -6.321   0.723
  280   HD22  LEU  35          1HD2      LEU  35  -4.556  -6.900  -0.072
  281   HD23  LEU  35          2HD2      LEU  35  -4.559  -6.587   1.665
  282    H    GLU  36           H        GLU  36  -7.762  -8.574  -2.883
  283    HA   GLU  36           HA       GLU  36  -9.015 -11.149  -3.082
  284    HB2  GLU  36           2HB      GLU  36  -9.589  -8.650  -4.698
  285    HB3  GLU  36           1HB      GLU  36 -10.656 -10.034  -4.489
  286    HG2  GLU  36           2HG      GLU  36  -9.809  -8.059  -2.363
  287    HG3  GLU  36           1HG      GLU  36 -11.395  -8.187  -3.103
  288    H    TRP  37           H        TRP  37  -6.676  -9.401  -4.986
  289    HA   TRP  37           HA       TRP  37  -6.948 -11.312  -7.252
  290    HB2  TRP  37           2HB      TRP  37  -5.413  -8.714  -6.912
  291    HB3  TRP  37           1HB      TRP  37  -5.136  -9.793  -8.276
  292    HD1  TRP  37           HD1      TRP  37  -8.476  -8.454  -6.718
  293    HE1  TRP  37           HE1      TRP  37  -9.903  -7.502  -8.618
  294    HE3  TRP  37           HE3      TRP  37  -5.248  -9.244 -10.609
  295    HZ2  TRP  37           HZ2      TRP  37  -9.691  -7.121 -11.416
  296    HZ3  TRP  37           HZ3      TRP  37  -5.941  -8.557 -12.871
  297    HH2  TRP  37           HH2      TRP  37  -8.116  -7.520 -13.266
  298    H    GLY  38           H        GLY  38  -5.366 -11.172  -4.325
  299    HA2  GLY  38           2HA      GLY  38  -3.824 -12.597  -3.387
  300    HA3  GLY  38           1HA      GLY  38  -3.770 -13.478  -4.908
  301    H    ILE  39           H        ILE  39  -3.143 -10.092  -4.877
  302    HA   ILE  39           HA       ILE  39  -0.511 -10.342  -5.978
  303    HB   ILE  39           HB       ILE  39  -2.144  -7.919  -5.085
  304   HG12  ILE  39          2HG1      ILE  39  -1.582  -9.008  -7.883
  305   HG13  ILE  39          1HG1      ILE  39  -3.103  -9.185  -7.021
  306   HG21  ILE  39          1HG2      ILE  39   0.459  -7.898  -6.647
  307   HG22  ILE  39          2HG2      ILE  39   0.243  -7.346  -4.985
  308   HG23  ILE  39          3HG2      ILE  39  -0.552  -6.492  -6.307
  309   HD11  ILE  39          3HD1      ILE  39  -3.257  -7.474  -8.715
  310   HD12  ILE  39          1HD1      ILE  39  -1.895  -6.605  -8.014
  311   HD13  ILE  39          2HD1      ILE  39  -3.410  -6.740  -7.118
  312    H    LEU  40           H        LEU  40  -1.911  -9.757  -2.835
  313    HA   LEU  40           HA       LEU  40   0.730  -9.247  -1.635
  314    HB2  LEU  40           2HB      LEU  40  -2.033  -8.820  -0.452
  315    HB3  LEU  40           1HB      LEU  40  -0.508  -8.439   0.339
  316    HG   LEU  40           HG       LEU  40  -1.663  -7.090  -2.121
  317   HD11  LEU  40          1HD1      LEU  40  -1.174  -6.073   0.687
  318   HD12  LEU  40          2HD1      LEU  40  -2.734  -6.368  -0.097
  319   HD13  LEU  40          3HD1      LEU  40  -1.686  -5.082  -0.684
  320   HD21  LEU  40          3HD2      LEU  40   0.289  -5.584  -2.066
  321   HD22  LEU  40          1HD2      LEU  40   0.746  -7.249  -2.427
  322   HD23  LEU  40          2HD2      LEU  40   1.024  -6.585  -0.813
  323    H    ASN  41           H        ASN  41   1.656 -10.677  -0.463
  324    HA   ASN  41           HA       ASN  41   0.133 -12.552   1.241
  325    HB2  ASN  41           2HB      ASN  41   2.944 -12.952   0.073
  326    HB3  ASN  41           1HB      ASN  41   2.132 -14.042   1.191
  327   HD21  ASN  41          1HD2      ASN  41   2.181 -12.821  -2.085
  328   HD22  ASN  41          2HD2      ASN  41   1.242 -14.095  -2.778
  329    H    SER  42           H        SER  42   1.429 -12.895   3.390
  330    HA   SER  42           HA       SER  42   1.803 -10.324   4.518
  331    HB2  SER  42           3HB      SER  42   2.301 -11.462   6.573
  332    HB3  SER  42           2HB      SER  42   1.040 -12.374   5.731
  333    H    MET  43           H        MET  43   4.080 -12.691   3.324
  334    HA   MET  43           HA       MET  43   6.480 -11.657   4.299
  335    HB2  MET  43           2HB      MET  43   7.525 -12.968   2.440
  336    HB3  MET  43           1HB      MET  43   6.397 -13.877   3.427
  337    HG2  MET  43           2HG      MET  43   4.858 -12.850   1.281
  338    HG3  MET  43           1HG      MET  43   6.364 -13.430   0.573
  339    HE1  MET  43           3HE      MET  43   3.410 -16.084   2.983
  340    HE2  MET  43           1HE      MET  43   3.205 -14.354   2.715
  341    HE3  MET  43           2HE      MET  43   4.453 -14.933   3.823
  342    H    ASN  44           H        ASN  44   4.710 -10.789   1.269
  343    HA   ASN  44           HA       ASN  44   6.693  -8.635   0.832
  344    HB2  ASN  44           2HB      ASN  44   5.717  -8.292  -1.401
  345    HB3  ASN  44           1HB      ASN  44   6.322  -9.924  -1.178
  346   HD21  ASN  44          1HD2      ASN  44   4.244  -8.674  -2.999
  347   HD22  ASN  44          2HD2      ASN  44   2.865  -9.700  -2.819
  348    H    ILE  45           H        ILE  45   3.922  -8.990   2.499
  349    HA   ILE  45           HA       ILE  45   2.744  -6.386   2.028
  350    HB   ILE  45           HB       ILE  45   1.895  -8.732   3.385
  351   HG12  ILE  45          2HG1      ILE  45   0.493  -6.024   3.385
  352   HG13  ILE  45          1HG1      ILE  45   0.462  -7.170   2.052
  353   HG21  ILE  45          1HG2      ILE  45   2.973  -7.978   5.482
  354   HG22  ILE  45          2HG2      ILE  45   1.218  -8.089   5.631
  355   HG23  ILE  45          3HG2      ILE  45   1.986  -6.512   5.444
  356   HD11  ILE  45          3HD1      ILE  45  -0.671  -8.806   3.517
  357   HD12  ILE  45          1HD1      ILE  45  -1.587  -7.308   3.307
  358   HD13  ILE  45          2HD1      ILE  45  -0.696  -7.591   4.803
  359    H    VAL  46           H        VAL  46   5.277  -7.728   4.000
  360    HA   VAL  46           HA       VAL  46   5.568  -5.661   5.922
  361    HB   VAL  46           HB       VAL  46   7.727  -7.544   4.881
  362   HG11  VAL  46          1HG1      VAL  46   8.642  -5.689   6.203
  363   HG12  VAL  46          2HG1      VAL  46   8.765  -7.195   7.111
  364   HG13  VAL  46          3HG1      VAL  46   7.497  -6.031   7.504
  365   HG21  VAL  46          3HG2      VAL  46   5.791  -7.976   7.195
  366   HG22  VAL  46          1HG2      VAL  46   7.132  -9.039   6.765
  367   HG23  VAL  46          2HG2      VAL  46   5.774  -8.838   5.661
  368    H    LYS  47           H        LYS  47   6.488  -5.975   2.612
  369    HA   LYS  47           HA       LYS  47   8.518  -4.044   2.359
  370    HB2  LYS  47           2HB      LYS  47   6.510  -5.207   0.421
  371    HB3  LYS  47           1HB      LYS  47   7.516  -3.857  -0.085
  372    HG2  LYS  47           2HG      LYS  47   8.443  -6.017  -0.799
  373    HG3  LYS  47           1HG      LYS  47   9.537  -5.155   0.287
  374    HD2  LYS  47           2HD      LYS  47   8.825  -6.592   2.160
  375    HD3  LYS  47           1HD      LYS  47   7.686  -7.417   1.091
  376    HE2  LYS  47           2HE      LYS  47   9.770  -8.715   1.456
  377    HE3  LYS  47           1HE      LYS  47   9.525  -8.304  -0.239
  378    HZ1  LYS  47           3HZ      LYS  47  11.339  -6.885   1.639
  379    HZ2  LYS  47           1HZ      LYS  47  11.113  -6.510   0.004
  380    HZ3  LYS  47           2HZ      LYS  47  11.803  -7.984   0.439
  381    H    LEU  48           H        LEU  48   4.979  -3.746   2.313
  382    HA   LEU  48           HA       LEU  48   4.914  -0.945   1.729
  383    HB2  LEU  48           2HB      LEU  48   2.810  -2.692   3.065
  384    HB3  LEU  48           1HB      LEU  48   2.562  -1.010   2.637
  385    HG   LEU  48           HG       LEU  48   1.482  -2.309   0.962
  386   HD11  LEU  48          1HD1      LEU  48   2.655  -0.340   0.068
  387   HD12  LEU  48          2HD1      LEU  48   2.614  -1.636  -1.122
  388   HD13  LEU  48          3HD1      LEU  48   4.101  -1.312  -0.230
  389   HD21  LEU  48          3HD2      LEU  48   4.046  -3.872   0.537
  390   HD22  LEU  48          1HD2      LEU  48   2.553  -4.048  -0.388
  391   HD23  LEU  48          2HD2      LEU  48   2.584  -4.473   1.322
  392    H    MET  49           H        MET  49   5.044  -2.809   4.753
  393    HA   MET  49           HA       MET  49   4.408  -0.820   6.633
  394    HB2  MET  49           2HB      MET  49   6.481  -3.022   7.046
  395    HB3  MET  49           1HB      MET  49   5.623  -2.150   8.306
  396    HG2  MET  49           2HG      MET  49   3.530  -3.230   7.661
  397    HG3  MET  49           1HG      MET  49   4.361  -4.064   6.337
  398    HE1  MET  49           3HE      MET  49   4.013  -7.164   8.678
  399    HE2  MET  49           1HE      MET  49   4.023  -6.613   7.002
  400    HE3  MET  49           2HE      MET  49   2.824  -5.987   8.126
  401    H    VAL  50           H        VAL  50   7.599  -1.857   5.460
  402    HA   VAL  50           HA       VAL  50   9.084   0.190   6.804
  403    HB   VAL  50           HB       VAL  50  10.153  -1.946   6.307
  404   HG11  VAL  50          1HG1      VAL  50   8.989  -2.552   4.234
  405   HG12  VAL  50          2HG1      VAL  50  10.736  -2.656   4.014
  406   HG13  VAL  50          3HG1      VAL  50   9.847  -1.278   3.356
  407   HG21  VAL  50          3HG2      VAL  50  11.666  -0.002   6.441
  408   HG22  VAL  50          1HG2      VAL  50  11.500   0.258   4.703
  409   HG23  VAL  50          2HG2      VAL  50  12.286  -1.202   5.307
  410    H    TYR  51           H        TYR  51   7.651  -0.076   3.601
  411    HA   TYR  51           HA       TYR  51   9.084   1.953   2.235
  412    HB2  TYR  51           2HB      TYR  51   7.520   0.233   1.152
  413    HB3  TYR  51           1HB      TYR  51   6.179   1.207   1.715
  414    HD1  TYR  51           HD1      TYR  51   9.346   1.553  -0.293
  415    HD2  TYR  51           HD2      TYR  51   5.329   2.906   0.276
  416    HE1  TYR  51           HE1      TYR  51   9.531   2.956  -2.301
  417    HE2  TYR  51           HE2      TYR  51   5.522   4.293  -1.734
  418    HH   TYR  51           HH       TYR  51   7.377   5.410  -3.040
  419    H    ILE  52           H        ILE  52   5.881   2.005   3.677
  420    HA   ILE  52           HA       ILE  52   5.249   4.728   3.249
  421    HB   ILE  52           HB       ILE  52   4.141   2.655   5.195
  422   HG12  ILE  52          2HG1      ILE  52   2.971   3.580   2.536
  423   HG13  ILE  52          1HG1      ILE  52   4.086   2.224   2.643
  424   HG21  ILE  52          1HG2      ILE  52   2.921   5.307   4.404
  425   HG22  ILE  52          2HG2      ILE  52   3.521   4.867   6.000
  426   HG23  ILE  52          3HG2      ILE  52   2.106   4.048   5.339
  427   HD11  ILE  52          3HD1      ILE  52   1.396   2.391   3.977
  428   HD12  ILE  52          1HD1      ILE  52   2.517   1.025   4.039
  429   HD13  ILE  52          2HD1      ILE  52   1.792   1.504   2.504
  430    H    ARG  53           H        ARG  53   6.754   3.040   5.934
  431    HA   ARG  53           HA       ARG  53   6.978   5.139   7.792
  432    HB2  ARG  53           2HB      ARG  53   7.370   2.800   8.403
  433    HB3  ARG  53           1HB      ARG  53   8.748   2.711   7.315
  434    HG2  ARG  53           2HG      ARG  53   9.391   2.875   9.713
  435    HG3  ARG  53           1HG      ARG  53  10.045   4.185   8.726
  436    HD2  ARG  53           2HD      ARG  53   8.375   5.727   9.566
  437    HD3  ARG  53           1HD      ARG  53   7.526   4.429  10.406
  438    HE   ARG  53           HE       ARG  53  10.267   4.805  11.247
  439   HH11  ARG  53          1HH1      ARG  53   6.957   5.829  11.778
  440   HH12  ARG  53          2HH1      ARG  53   7.258   6.394  13.387
  441   HH21  ARG  53          1HH2      ARG  53  10.669   5.559  13.322
  442   HH22  ARG  53          2HH2      ARG  53   9.384   6.241  14.277
  443    H    ASP  54           H        ASP  54   9.003   4.244   5.041
  444    HA   ASP  54           HA       ASP  54  11.053   6.261   5.618
  445    HB2  ASP  54           2HB      ASP  54  11.544   3.876   4.776
  446    HB3  ASP  54           1HB      ASP  54  10.879   4.373   3.227
  447    H    GLU  55           H        GLU  55   8.197   5.965   3.748
  448    HA   GLU  55           HA       GLU  55   8.963   7.873   1.647
  449    HB2  GLU  55           2HB      GLU  55   7.817   5.783   1.015
  450    HB3  GLU  55           1HB      GLU  55   6.483   6.163   2.091
  451    HG2  GLU  55           2HG      GLU  55   5.835   6.533  -0.195
  452    HG3  GLU  55           1HG      GLU  55   5.861   8.067   0.665
  453    H    MET  56           H        MET  56   6.239   7.448   3.914
  454    HA   MET  56           HA       MET  56   5.625  10.348   3.764
  455    HB2  MET  56           2HB      MET  56   3.882   7.902   4.269
  456    HB3  MET  56           1HB      MET  56   3.309   9.536   4.577
  457    HG2  MET  56           2HG      MET  56   3.359  10.113   2.297
  458    HG3  MET  56           1HG      MET  56   4.387   8.745   1.874
  459    HE1  MET  56           3HE      MET  56   2.044   5.736   1.739
  460    HE2  MET  56           1HE      MET  56   3.301   6.170   2.901
  461    HE3  MET  56           2HE      MET  56   3.555   6.442   1.174
  462    H    GLY  57           H        GLY  57   7.386   8.486   5.641
  463    HA2  GLY  57           2HA      GLY  57   8.216   8.701   7.756
  464    HA3  GLY  57           1HA      GLY  57   7.414  10.262   7.827
  465    H    VAL  58           H        VAL  58   5.639   7.264   7.372
  466    HA   VAL  58           HA       VAL  58   4.701   7.316  10.168
  467    HB   VAL  58           HB       VAL  58   3.008   8.623   8.990
  468   HG11  VAL  58          1HG1      VAL  58   1.731   7.783   7.049
  469   HG12  VAL  58          2HG1      VAL  58   2.771   6.355   6.993
  470   HG13  VAL  58          3HG1      VAL  58   3.450   7.953   6.674
  471   HG21  VAL  58          3HG2      VAL  58   2.158   7.052  10.678
  472   HG22  VAL  58          1HG2      VAL  58   1.953   5.818   9.432
  473   HG23  VAL  58          2HG2      VAL  58   0.983   7.292   9.383
  474    H    SER  59           H        SER  59   4.885   5.326  10.999
  475    HA   SER  59           HA       SER  59   5.449   3.024   9.349
  476    HB2  SER  59           2HB      SER  59   6.584   3.457  11.553
  477    HB3  SER  59           1HB      SER  59   5.043   3.187  12.371
  478    HG   SER  59           HG       SER  59   5.954   1.227  12.399
  479    H    ILE  60           H        ILE  60   4.064   1.301   8.965
  480    HA   ILE  60           HA       ILE  60   1.338   1.319  10.024
  481    HB   ILE  60           HB       ILE  60   2.681  -0.829   8.314
  482   HG12  ILE  60          2HG1      ILE  60   2.391   1.461   7.153
  483   HG13  ILE  60          1HG1      ILE  60   1.635   0.084   6.357
  484   HG21  ILE  60          1HG2      ILE  60  -0.243  -0.395   9.059
  485   HG22  ILE  60          2HG2      ILE  60   0.810  -1.688   9.634
  486   HG23  ILE  60          3HG2      ILE  60   0.358  -1.618   7.934
  487   HD11  ILE  60          3HD1      ILE  60   0.212   2.111   8.088
  488   HD12  ILE  60          1HD1      ILE  60  -0.547   0.734   7.283
  489   HD13  ILE  60          2HD1      ILE  60   0.178   2.032   6.330
  490    HA   PRO  61           HA       PRO  61   3.161  -1.027  13.523
  491    HB2  PRO  61           2HB      PRO  61   0.955  -0.885  15.148
  492    HB3  PRO  61           1HB      PRO  61   2.071   0.477  14.933
  493    HG2  PRO  61           2HG      PRO  61  -0.582   0.007  13.628
  494    HG3  PRO  61           1HG      PRO  61   0.076   1.499  14.336
  495    HD2  PRO  61           2HD      PRO  61   0.099   1.009  11.661
  496    HD3  PRO  61           1HD      PRO  61   1.351   1.978  12.459
  497    H    SER  62           H        SER  62   2.529  -3.076  14.665
  498    HA   SER  62           HA       SER  62   1.705  -5.013  12.741
  499    HB2  SER  62           2HB      SER  62   2.225  -5.407  15.708
  500    HB3  SER  62           1HB      SER  62   2.136  -6.682  14.484
  501    HG   SER  62           HG       SER  62   3.958  -5.896  13.527
  502    H    THR  63           H        THR  63  -0.010  -3.301  15.215
  503    HA   THR  63           HA       THR  63  -2.320  -5.001  15.358
  504    HB   THR  63           HB       THR  63  -1.712  -3.441  17.186
  505    HG1  THR  63           HG1      THR  63  -3.992  -4.071  16.731
  506   HG21  THR  63          3HG2      THR  63  -2.127  -1.027  16.991
  507   HG22  THR  63          1HG2      THR  63  -2.533  -1.221  15.285
  508   HG23  THR  63          2HG2      THR  63  -0.890  -1.541  15.841
  509    H    HIS  64           H        HIS  64  -1.173  -2.904  12.968
  510    HA   HIS  64           HA       HIS  64  -3.833  -2.527  11.720
  511    HB2  HIS  64           2HB      HIS  64  -1.365  -0.771  11.720
  512    HB3  HIS  64           1HB      HIS  64  -2.623  -0.605  10.491
  513    HD1  HIS  64           HD1      HIS  64  -4.351  -1.497  13.528
  514    HD2  HIS  64           HD2      HIS  64  -2.733   2.006  11.968
  515    HE1  HIS  64           HE1      HIS  64  -5.502   0.363  14.748
  516    HE2  HIS  64           HE2      HIS  64  -4.566   2.475  13.733
  517    H    ILE  65           H        ILE  65  -1.588  -4.724  11.572
  518    HA   ILE  65           HA       ILE  65  -1.277  -4.800   8.666
  519    HB   ILE  65           HB       ILE  65  -0.499  -6.968  10.657
  520   HG12  ILE  65          2HG1      ILE  65   0.712  -4.934  11.238
  521   HG13  ILE  65          1HG1      ILE  65   1.824  -6.043  10.439
  522   HG21  ILE  65          1HG2      ILE  65   0.981  -7.762   8.847
  523   HG22  ILE  65          2HG2      ILE  65   0.406  -6.469   7.790
  524   HG23  ILE  65          3HG2      ILE  65  -0.700  -7.737   8.316
  525   HD11  ILE  65          3HD1      ILE  65   1.568  -4.773   8.352
  526   HD12  ILE  65          1HD1      ILE  65   2.156  -3.773   9.681
  527   HD13  ILE  65          2HD1      ILE  65   0.470  -3.663   9.176
  528    H    THR  66           H        THR  66  -3.294  -4.929   7.917
  529    HA   THR  66           HA       THR  66  -4.672  -7.457   8.129
  530    HB   THR  66           HB       THR  66  -5.791  -6.319   9.942
  531    HG1  THR  66           HG1      THR  66  -7.535  -7.125   9.062
  532   HG21  THR  66          3HG2      THR  66  -6.253  -3.945   8.088
  533   HG22  THR  66          1HG2      THR  66  -5.114  -3.980   9.439
  534   HG23  THR  66          2HG2      THR  66  -6.850  -4.097   9.741
  535    H    GLY  67           H        GLY  67  -6.004  -7.860   6.344
  536    HA2  GLY  67           2HA      GLY  67  -5.359  -6.624   3.884
  537    HA3  GLY  67           1HA      GLY  67  -6.677  -7.748   4.173
  538    H    LYS  68           H        LYS  68  -7.758  -5.850   6.294
  539    HA   LYS  68           HA       LYS  68  -9.647  -4.414   4.785
  540    HB2  LYS  68           2HB      LYS  68 -10.099  -4.985   7.096
  541    HB3  LYS  68           1HB      LYS  68  -8.698  -4.073   7.651
  542    HG2  LYS  68           2HG      LYS  68  -9.775  -1.962   6.952
  543    HG3  LYS  68           1HG      LYS  68 -11.186  -2.861   6.384
  544    HD2  LYS  68           2HD      LYS  68 -11.677  -3.593   8.668
  545    HD3  LYS  68           1HD      LYS  68 -10.204  -2.824   9.266
  546    HE2  LYS  68           2HE      LYS  68 -11.088  -0.610   8.739
  547    HE3  LYS  68           1HE      LYS  68 -12.509  -1.320   7.967
  548    HZ1  LYS  68           3HZ      LYS  68 -13.084  -2.273  10.174
  549    HZ2  LYS  68           1HZ      LYS  68 -13.104  -0.581  10.142
  550    HZ3  LYS  68           2HZ      LYS  68 -11.808  -1.401  10.850
  551    H    TYR  69           H        TYR  69  -6.513  -3.419   6.111
  552    HA   TYR  69           HA       TYR  69  -6.843  -0.637   5.248
  553    HB2  TYR  69           2HB      TYR  69  -4.640  -2.085   6.751
  554    HB3  TYR  69           1HB      TYR  69  -4.495  -0.403   6.238
  555    HD1  TYR  69           HD2      TYR  69  -7.927  -0.894   7.095
  556    HD2  TYR  69           HD1      TYR  69  -4.069  -0.415   8.902
  557    HE1  TYR  69           HE2      TYR  69  -8.987  -0.142   9.162
  558    HE2  TYR  69           HE1      TYR  69  -5.162   0.336  10.958
  559    HH   TYR  69           HH       TYR  69  -8.379  -0.055  11.628
  560    H    PHE  70           H        PHE  70  -5.188  -3.534   4.311
  561    HA   PHE  70           HA       PHE  70  -3.559  -2.166   2.299
  562    HB2  PHE  70           2HB      PHE  70  -3.540  -5.004   3.384
  563    HB3  PHE  70           1HB      PHE  70  -2.546  -4.503   2.023
  564    HD1  PHE  70           HD2      PHE  70  -3.157  -3.833   5.657
  565    HD2  PHE  70           HD1      PHE  70  -0.449  -3.403   2.379
  566    HE1  PHE  70           HE2      PHE  70  -1.410  -3.088   7.194
  567    HE2  PHE  70           HE1      PHE  70   1.291  -2.654   3.938
  568    HZ   PHE  70           HZ       PHE  70   0.823  -2.488   6.333
  569    H    LYS  71           H        LYS  71  -6.638  -2.816   2.148
  570    HA   LYS  71           HA       LYS  71  -7.287  -4.828   0.384
  571    HB2  LYS  71           2HB      LYS  71  -8.490  -2.058   0.534
  572    HB3  LYS  71           1HB      LYS  71  -9.170  -3.321  -0.481
  573    HG2  LYS  71           2HG      LYS  71  -9.863  -4.605   1.366
  574    HG3  LYS  71           1HG      LYS  71  -8.805  -3.732   2.484
  575    HD2  LYS  71           2HD      LYS  71 -11.158  -3.091   2.784
  576    HD3  LYS  71           1HD      LYS  71 -10.178  -1.722   2.268
  577    HE2  LYS  71           2HE      LYS  71 -11.017  -2.140  -0.088
  578    HE3  LYS  71           1HE      LYS  71 -12.131  -3.331   0.588
  579    HZ1  LYS  71           3HZ      LYS  71 -13.101  -1.575   1.952
  580    HZ2  LYS  71           1HZ      LYS  71 -13.187  -1.187   0.306
  581    HZ3  LYS  71           2HZ      LYS  71 -12.026  -0.446   1.282
  582    H    ASP  72           H        ASP  72  -6.332  -1.529  -0.468
  583    HA   ASP  72           HA       ASP  72  -5.140  -2.213  -2.964
  584    HB2  ASP  72           2HB      ASP  72  -6.733  -1.229  -4.498
  585    HB3  ASP  72           1HB      ASP  72  -7.584  -2.432  -3.545
  586    H    LEU  73           H        LEU  73  -5.322   0.212  -4.279
  587    HA   LEU  73           HA       LEU  73  -3.481   1.829  -2.861
  588    HB2  LEU  73           2HB      LEU  73  -3.413   1.779  -5.247
  589    HB3  LEU  73           1HB      LEU  73  -5.094   2.217  -5.385
  590    HG   LEU  73           HG       LEU  73  -3.115   4.229  -4.283
  591   HD11  LEU  73          1HD1      LEU  73  -3.674   3.690  -7.217
  592   HD12  LEU  73          2HD1      LEU  73  -2.138   3.437  -6.385
  593   HD13  LEU  73          3HD1      LEU  73  -2.774   5.069  -6.582
  594   HD21  LEU  73          3HD2      LEU  73  -5.497   4.821  -4.114
  595   HD22  LEU  73          1HD2      LEU  73  -5.710   4.531  -5.841
  596   HD23  LEU  73          2HD2      LEU  73  -4.691   5.862  -5.283
  597    H    ASN  74           H        ASN  74  -6.958   2.131  -3.518
  598    HA   ASN  74           HA       ASN  74  -7.245   4.740  -2.390
  599    HB2  ASN  74           2HB      ASN  74  -9.336   2.588  -2.905
  600    HB3  ASN  74           1HB      ASN  74  -9.716   4.232  -2.401
  601   HD21  ASN  74          1HD2      ASN  74  -8.561   2.228  -5.020
  602   HD22  ASN  74          2HD2      ASN  74  -8.723   3.433  -6.263
  603    H    ALA  75           H        ALA  75  -7.634   1.457  -1.077
  604    HA   ALA  75           HA       ALA  75  -8.567   2.179   1.494
  605    HB1  ALA  75           3HB      ALA  75  -7.819  -0.058   2.194
  606    HB2  ALA  75           1HB      ALA  75  -6.899  -0.219   0.696
  607    HB3  ALA  75           2HB      ALA  75  -8.660  -0.116   0.640
  608    H    ILE  76           H        ILE  76  -5.252   1.564   0.353
  609    HA   ILE  76           HA       ILE  76  -3.916   2.069   2.806
  610    HB   ILE  76           HB       ILE  76  -2.898   2.000  -0.061
  611   HG12  ILE  76          2HG1      ILE  76  -2.605   0.067   2.272
  612   HG13  ILE  76          1HG1      ILE  76  -3.622  -0.186   0.859
  613   HG21  ILE  76          1HG2      ILE  76  -1.184   2.265   2.439
  614   HG22  ILE  76          2HG2      ILE  76  -1.410   3.515   1.216
  615   HG23  ILE  76          3HG2      ILE  76  -0.579   2.016   0.798
  616   HD11  ILE  76          3HD1      ILE  76  -1.648  -1.537   0.716
  617   HD12  ILE  76          1HD1      ILE  76  -0.609  -0.134   0.952
  618   HD13  ILE  76          2HD1      ILE  76  -1.563  -0.288  -0.529
  619    H    SER  77           H        SER  77  -4.851   4.223   0.139
  620    HA   SER  77           HA       SER  77  -3.260   6.433   1.036
  621    HB2  SER  77           2HB      SER  77  -4.618   7.779  -0.553
  622    HB3  SER  77           1HB      SER  77  -4.014   6.303  -1.296
  623    HG   SER  77           HG       SER  77  -6.013   5.422  -1.178
  624    H    ARG  78           H        ARG  78  -6.705   5.593   1.393
  625    HA   ARG  78           HA       ARG  78  -7.464   7.793   2.996
  626    HB2  ARG  78           2HB      ARG  78  -8.624   4.992   2.842
  627    HB3  ARG  78           1HB      ARG  78  -9.376   6.308   3.738
  628    HG2  ARG  78           2HG      ARG  78  -8.886   6.271   0.747
  629    HG3  ARG  78           1HG      ARG  78 -10.430   5.975   1.546
  630    HD2  ARG  78           2HD      ARG  78  -8.862   8.578   1.554
  631    HD3  ARG  78           1HD      ARG  78 -10.359   8.248   0.679
  632    HE   ARG  78           HE       ARG  78 -11.329   7.864   3.017
  633   HH11  ARG  78          1HH1      ARG  78  -8.825  10.201   2.333
  634   HH12  ARG  78          2HH1      ARG  78  -9.276  11.268   3.626
  635   HH21  ARG  78          1HH2      ARG  78 -11.933   9.260   4.716
  636   HH22  ARG  78          2HH2      ARG  78 -11.046  10.725   4.982
  637    H    THR  79           H        THR  79  -6.011   4.704   3.818
  638    HA   THR  79           HA       THR  79  -6.281   4.992   6.663
  639    HB   THR  79           HB       THR  79  -4.567   3.069   5.039
  640    HG1  THR  79           HG1      THR  79  -7.209   3.177   5.566
  641   HG21  THR  79          3HG2      THR  79  -5.291   2.993   8.000
  642   HG22  THR  79          1HG2      THR  79  -3.680   3.291   7.342
  643   HG23  THR  79          2HG2      THR  79  -4.448   1.718   7.123
  644    H    VAL  80           H        VAL  80  -3.668   5.606   4.304
  645    HA   VAL  80           HA       VAL  80  -1.663   5.967   6.334
  646    HB   VAL  80           HB       VAL  80  -1.151   5.224   3.964
  647   HG11  VAL  80          1HG1      VAL  80  -1.464   8.159   3.240
  648   HG12  VAL  80          2HG1      VAL  80  -2.499   6.836   2.694
  649   HG13  VAL  80          3HG1      VAL  80  -0.804   6.890   2.204
  650   HG21  VAL  80          3HG2      VAL  80   0.421   7.606   4.982
  651   HG22  VAL  80          1HG2      VAL  80   1.002   6.383   3.853
  652   HG23  VAL  80          2HG2      VAL  80   0.606   5.933   5.511
  653    H    GLU  81           H        GLU  81  -3.859   8.093   4.558
  654    HA   GLU  81           HA       GLU  81  -2.813  10.552   5.534
  655    HB2  GLU  81           2HB      GLU  81  -5.621   9.936   4.571
  656    HB3  GLU  81           1HB      GLU  81  -4.987  11.547   4.882
  657    HG2  GLU  81           2HG      GLU  81  -4.113   9.615   2.733
  658    HG3  GLU  81           1HG      GLU  81  -4.945  11.148   2.516
  659    H    GLN  82           H        GLN  82  -5.308   8.317   6.756
  660    HA   GLN  82           HA       GLN  82  -6.113  10.005   8.914
  661    HB2  GLN  82           2HB      GLN  82  -7.525   8.301   9.652
  662    HB3  GLN  82           1HB      GLN  82  -7.417   7.974   7.932
  663    HG2  GLN  82           2HG      GLN  82  -5.833   6.157   8.363
  664    HG3  GLN  82           1HG      GLN  82  -5.869   6.504  10.085
  665   HE21  GLN  82          1HE2      GLN  82  -7.798   5.995  11.264
  666   HE22  GLN  82          2HE2      GLN  82  -8.910   4.825  10.654
  667    H    LEU  83           H        LEU  83  -3.605   7.551   8.536
  668    HA   LEU  83           HA       LEU  83  -2.997   7.210  11.297
  669    HB2  LEU  83           2HB      LEU  83  -1.332   6.693   8.819
  670    HB3  LEU  83           1HB      LEU  83  -0.798   6.272  10.440
  671    HG   LEU  83           HG       LEU  83  -3.262   5.124   9.077
  672   HD11  LEU  83          1HD1      LEU  83  -1.950   3.056   8.924
  673   HD12  LEU  83          2HD1      LEU  83  -0.540   3.889   9.589
  674   HD13  LEU  83          3HD1      LEU  83  -1.191   4.366   8.019
  675   HD21  LEU  83          3HD2      LEU  83  -3.320   3.557  10.972
  676   HD22  LEU  83          1HD2      LEU  83  -3.517   5.218  11.526
  677   HD23  LEU  83          2HD2      LEU  83  -1.965   4.395  11.729
  678    H    LYS  84           H        LYS  84  -1.703   9.400   8.836
  679    HA   LYS  84           HA       LYS  84   0.255  10.629  10.511
  680    HB2  LYS  84           2HB      LYS  84  -1.164  11.686   8.037
  681    HB3  LYS  84           1HB      LYS  84   0.202  12.489   8.812
  682    HG2  LYS  84           2HG      LYS  84   1.647  10.572   8.329
  683    HG3  LYS  84           1HG      LYS  84   0.290   9.704   7.607
  684    HD2  LYS  84           2HD      LYS  84   1.477  12.309   6.580
  685    HD3  LYS  84           1HD      LYS  84   1.759  10.710   5.895
  686    HE2  LYS  84           2HE      LYS  84  -0.612  10.520   5.296
  687    HE3  LYS  84           1HE      LYS  84  -0.948  12.079   6.046
  688    HZ1  LYS  84           3HZ      LYS  84  -0.740  12.162   3.613
  689    HZ2  LYS  84           1HZ      LYS  84   0.883  11.711   3.735
  690    HZ3  LYS  84           2HZ      LYS  84   0.364  13.171   4.402
  691    H    ALA  85           H        ALA  85  -3.169  10.899  10.328
  692    HA   ALA  85           HA       ALA  85  -3.344  13.379  11.858
  693    HB1  ALA  85           3HB      ALA  85  -5.756  13.073  11.659
  694    HB2  ALA  85           1HB      ALA  85  -5.524  11.451  10.998
  695    HB3  ALA  85           2HB      ALA  85  -4.995  12.868  10.079
  696    H    GLU  86           H        GLU  86  -3.608   9.905  12.381
  697    HA   GLU  86           HA       GLU  86  -4.698   9.996  15.029
  698    HB2  GLU  86           2HB      GLU  86  -3.160   7.755  13.645
  699    HB3  GLU  86           1HB      GLU  86  -4.094   7.580  15.123
  700    HG2  GLU  86           2HG      GLU  86  -5.273   8.332  12.438
  701    HG3  GLU  86           1HG      GLU  86  -5.205   6.699  13.056
  702    H    SER  87           H        SER  87  -1.465   9.719  13.659
  703    HA   SER  87           HA       SER  87  -0.157   9.357  16.239
  704    HB2  SER  87           2HB      SER  87   0.563   8.155  14.136
  705    HB3  SER  87           1HB      SER  87   1.099   9.701  13.482
  706    HG   SER  87           HG       SER  87   2.202   9.495  15.858
  707    H    ALA  88           H        ALA  88  -1.079  12.043  14.249
  708    HA   ALA  88           HA       ALA  88   0.783  13.853  15.698
  709    HB1  ALA  88           3HB      ALA  88   0.396  15.486  13.913
  710    HB2  ALA  88           1HB      ALA  88  -0.735  14.385  13.118
  711    HB3  ALA  88           2HB      ALA  88   0.973  13.962  13.239
  712    H    LEU  89           H        LEU  89  -0.456  16.189  15.488
  713    HA   LEU  89           HA       LEU  89  -2.515  16.010  17.546
  714    HB2  LEU  89           2HB      LEU  89  -2.142  18.472  17.662
  715    HB3  LEU  89           1HB      LEU  89  -0.702  17.508  17.906
  716    HG   LEU  89           HG       LEU  89  -0.411  18.012  15.239
  717   HD11  LEU  89          1HD1      LEU  89  -0.994  20.346  14.737
  718   HD12  LEU  89          2HD1      LEU  89  -1.880  20.458  16.259
  719   HD13  LEU  89          3HD1      LEU  89  -2.425  19.351  14.996
  720   HD21  LEU  89          3HD2      LEU  89   1.163  19.795  15.819
  721   HD22  LEU  89          1HD2      LEU  89   1.295  18.444  16.944
  722   HD23  LEU  89          2HD2      LEU  89   0.458  19.918  17.432
  723    H    GLU  90           H        GLU  90  -2.848  15.682  14.350
  724    HA   GLU  90           HA       GLU  90  -4.463  17.799  13.414
  725    HB2  GLU  90           2HB      GLU  90  -4.440  14.940  12.381
  726    HB3  GLU  90           1HB      GLU  90  -4.975  16.357  11.497
  727    HG2  GLU  90           2HG      GLU  90  -2.149  15.622  12.289
  728    HG3  GLU  90           1HG      GLU  90  -2.818  15.723  10.663
  729   H281  4EM 101          2H28      PYA 142   2.639 -12.294   8.316
  730   H283  4EM 101          3H28      PYA 142   3.131 -13.203   9.736
  731   H303  4EM 101          3H30      PYA 142   0.227 -12.000   7.775
  732   H301  4EM 101          1H30      PYA 142  -1.020 -12.850   8.720
  733   H302  4EM 101          2H30      PYA 142   0.039 -13.739   7.626
  734   H312  4EM 101          2H31      PYA 142   1.115 -11.007   9.825
  735   H313  4EM 101          3H31      PYA 142  -0.114 -11.851  10.762
  736   H311  4EM 101          1H31      PYA 142   1.591 -12.012  11.205
  737    H32  4EM 101           H32      PYA 142   0.862 -15.281   9.609
  738    H33  4EM 101           H33      PYA 142   1.362 -15.358  11.842
  739    H36  4EM 101           H36      PYA 142  -1.235 -15.427   9.093
  740   H373  4EM 101          3H37      PYA 142  -3.302 -15.586  10.921
  741   H372  4EM 101          2H37      PYA 142  -3.439 -14.002  10.149
  742   H382  4EM 101          2H38      PYA 142  -3.598 -16.750   8.893
  743   H383  4EM 101          3H38      PYA 142  -3.201 -15.341   7.907
  744    H41  4EM 101           H41      PYA 142  -4.456 -13.658   7.965
  745   H423  4EM 101          3H42      PYA 142  -7.369 -13.905   8.071
  746   H422  4EM 101          2H42      PYA 142  -6.429 -12.969   6.901
  747   H433  4EM 101          3H43      PYA 142  -6.658 -12.445   9.884
  748   H432  4EM 101          2H43      PYA 142  -7.283 -11.424   8.582
  749    H44  4EM 101           H44      PYA 142  -4.786 -11.491   9.636
  750    H49  4EM 101           H49      PYA 142  -2.929 -10.129   5.821
  751    H51  4EM 101           H51      PYA 142  -0.668  -9.482   6.978
  752    H50  4EM 101           H50      PYA 142  -1.002  -9.673   9.559
  753    H48  4EM 101           H48      PYA 142  -3.425 -10.431   9.935
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1   3.304  15.810   3.348
    2    H2   MET   1           2H       MET   1   2.076  16.963   3.297
    3    H3   MET   1           3H       MET   1   3.642  17.418   3.738
    4    HA   MET   1           HA       MET   1   3.070  18.080   1.482
    5    HB2  MET   1           2HB      MET   1   5.441  17.668   2.162
    6    HB3  MET   1           1HB      MET   1   5.286  15.994   1.652
    7    HG2  MET   1           2HG      MET   1   4.978  16.711  -0.672
    8    HG3  MET   1           1HG      MET   1   5.056  18.401  -0.178
    9    HE1  MET   1           3HE      MET   1   8.824  18.799   0.860
   10    HE2  MET   1           1HE      MET   1   7.459  18.493   1.934
   11    HE3  MET   1           2HE      MET   1   7.291  19.632   0.598
   12    H    ASP   2           H        ASP   2   1.094  17.395   0.719
   13    HA   ASP   2           HA       ASP   2  -0.454  16.326  -0.498
   14    HB2  ASP   2           2HB      ASP   2   2.060  15.241  -1.816
   15    HB3  ASP   2           1HB      ASP   2   0.476  14.728  -2.374
   16    H    GLY   3           H        GLY   3  -0.786  13.767  -1.522
   17    HA2  GLY   3           2HA      GLY   3  -0.274  11.774   0.501
   18    HA3  GLY   3           1HA      GLY   3  -1.927  12.372   0.493
   19    H    GLU   4           H        GLU   4  -2.808  12.501  -1.892
   20    HA   GLU   4           HA       GLU   4  -3.041   9.780  -2.696
   21    HB2  GLU   4           2HB      GLU   4  -4.101  12.303  -4.012
   22    HB3  GLU   4           1HB      GLU   4  -4.544  10.664  -4.494
   23    HG2  GLU   4           2HG      GLU   4  -5.243  10.352  -1.997
   24    HG3  GLU   4           1HG      GLU   4  -5.204  12.111  -1.919
   25    H    GLU   5           H        GLU   5  -0.741  12.118  -3.664
   26    HA   GLU   5           HA       GLU   5   0.054  10.997  -6.151
   27    HB2  GLU   5           2HB      GLU   5   0.846  13.217  -5.502
   28    HB3  GLU   5           1HB      GLU   5   1.657  12.551  -4.087
   29    HG2  GLU   5           2HG      GLU   5   3.185  11.288  -5.578
   30    HG3  GLU   5           1HG      GLU   5   2.378  11.985  -6.976
   31    H    VAL   6           H        VAL   6   0.820  10.144  -2.762
   32    HA   VAL   6           HA       VAL   6   3.010   8.416  -3.404
   33    HB   VAL   6           HB       VAL   6   3.039   7.604  -1.192
   34   HG11  VAL   6          1HG1      VAL   6   3.742   9.914  -1.317
   35   HG12  VAL   6          2HG1      VAL   6   2.944   9.623   0.228
   36   HG13  VAL   6          3HG1      VAL   6   2.084  10.474  -1.060
   37   HG21  VAL   6          3HG2      VAL   6   1.229   7.863   0.486
   38   HG22  VAL   6          1HG2      VAL   6   0.723   6.874  -0.882
   39   HG23  VAL   6          2HG2      VAL   6   0.184   8.542  -0.757
   40    H    LYS   7           H        LYS   7  -0.403   8.068  -3.539
   41    HA   LYS   7           HA       LYS   7  -0.734   5.307  -3.498
   42    HB2  LYS   7           2HB      LYS   7  -2.256   7.438  -5.032
   43    HB3  LYS   7           1HB      LYS   7  -2.778   5.765  -4.918
   44    HG2  LYS   7           2HG      LYS   7  -2.696   6.133  -2.339
   45    HG3  LYS   7           1HG      LYS   7  -2.654   7.852  -2.740
   46    HD2  LYS   7           2HD      LYS   7  -4.841   5.848  -3.369
   47    HD3  LYS   7           1HD      LYS   7  -4.945   7.274  -2.345
   48    HE2  LYS   7           2HE      LYS   7  -4.637   8.703  -4.366
   49    HE3  LYS   7           1HE      LYS   7  -4.647   7.247  -5.363
   50    HZ1  LYS   7           3HZ      LYS   7  -6.884   6.764  -4.572
   51    HZ2  LYS   7           1HZ      LYS   7  -6.817   8.279  -5.310
   52    HZ3  LYS   7           2HZ      LYS   7  -6.881   8.168  -3.628
   53    H    GLU   8           H        GLU   8  -0.197   7.346  -6.455
   54    HA   GLU   8           HA       GLU   8  -0.014   5.155  -8.262
   55    HB2  GLU   8           2HB      GLU   8   0.934   6.726  -9.881
   56    HB3  GLU   8           1HB      GLU   8  -0.410   7.479  -9.033
   57    HG2  GLU   8           2HG      GLU   8   1.206   8.702  -7.592
   58    HG3  GLU   8           1HG      GLU   8   2.539   7.978  -8.485
   59    H    LYS   9           H        LYS   9   2.264   6.672  -6.146
   60    HA   LYS   9           HA       LYS   9   4.676   5.547  -7.148
   61    HB2  LYS   9           2HB      LYS   9   3.976   6.764  -4.457
   62    HB3  LYS   9           1HB      LYS   9   5.614   6.331  -4.947
   63    HG2  LYS   9           2HG      LYS   9   5.635   7.986  -6.677
   64    HG3  LYS   9           1HG      LYS   9   3.900   8.268  -6.520
   65    HD2  LYS   9           2HD      LYS   9   5.338  10.071  -5.534
   66    HD3  LYS   9           1HD      LYS   9   4.181   9.366  -4.412
   67    HE2  LYS   9           2HE      LYS   9   5.937   8.068  -3.348
   68    HE3  LYS   9           1HE      LYS   9   7.126   8.619  -4.533
   69    HZ1  LYS   9           3HZ      LYS   9   6.828  10.879  -3.682
   70    HZ2  LYS   9           1HZ      LYS   9   7.315   9.820  -2.464
   71    HZ3  LYS   9           2HZ      LYS   9   5.708  10.315  -2.547
   72    H    ILE  10           H        ILE  10   2.276   4.479  -4.776
   73    HA   ILE  10           HA       ILE  10   3.813   2.209  -3.841
   74    HB   ILE  10           HB       ILE  10   0.847   2.840  -3.500
   75   HG12  ILE  10          2HG1      ILE  10   2.153   4.495  -2.314
   76   HG13  ILE  10          1HG1      ILE  10   1.499   3.393  -1.121
   77   HG21  ILE  10          1HG2      ILE  10   2.471   0.689  -2.099
   78   HG22  ILE  10          2HG2      ILE  10   1.186   0.422  -3.276
   79   HG23  ILE  10          3HG2      ILE  10   0.805   1.132  -1.708
   80   HD11  ILE  10          3HD1      ILE  10   3.770   4.003  -0.589
   81   HD12  ILE  10          1HD1      ILE  10   4.334   3.432  -2.156
   82   HD13  ILE  10          2HD1      ILE  10   3.701   2.282  -0.970
   83    H    ARG  11           H        ARG  11   1.308   2.811  -6.287
   84    HA   ARG  11           HA       ARG  11   0.660   0.173  -7.056
   85    HB2  ARG  11           2HB      ARG  11   0.828   2.693  -8.774
   86    HB3  ARG  11           1HB      ARG  11   0.153   1.168  -9.346
   87    HG2  ARG  11           2HG      ARG  11  -1.643   1.296  -7.706
   88    HG3  ARG  11           1HG      ARG  11  -0.930   2.749  -7.003
   89    HD2  ARG  11           2HD      ARG  11  -2.791   3.399  -8.403
   90    HD3  ARG  11           1HD      ARG  11  -1.300   3.942  -9.167
   91    HE   ARG  11           HE       ARG  11  -1.804   1.536 -10.377
   92   HH11  ARG  11          1HH1      ARG  11  -3.723   4.468  -9.965
   93   HH12  ARG  11          2HH1      ARG  11  -4.613   4.237 -11.435
   94   HH21  ARG  11          1HH2      ARG  11  -2.986   1.247 -12.306
   95   HH22  ARG  11          2HH2      ARG  11  -4.195   2.407 -12.766
   96    H    ARG  12           H        ARG  12   3.225   2.340  -8.053
   97    HA   ARG  12           HA       ARG  12   4.445   0.535  -9.892
   98    HB2  ARG  12           2HB      ARG  12   5.279   3.190  -8.715
   99    HB3  ARG  12           1HB      ARG  12   6.348   2.289  -9.782
  100    HG2  ARG  12           2HG      ARG  12   3.620   3.458 -10.431
  101    HG3  ARG  12           1HG      ARG  12   5.174   3.891 -11.149
  102    HD2  ARG  12           2HD      ARG  12   5.310   1.613 -12.162
  103    HD3  ARG  12           1HD      ARG  12   3.731   1.226 -11.463
  104    HE   ARG  12           HE       ARG  12   3.221   3.422 -12.974
  105   HH11  ARG  12          1HH1      ARG  12   4.740   0.327 -13.678
  106   HH12  ARG  12          2HH1      ARG  12   4.206   0.315 -15.333
  107   HH21  ARG  12          1HH2      ARG  12   2.466   3.348 -15.119
  108   HH22  ARG  12          2HH2      ARG  12   2.917   2.022 -16.147
  109    H    TYR  13           H        TYR  13   5.323   1.605  -6.589
  110    HA   TYR  13           HA       TYR  13   7.671   0.146  -6.290
  111    HB2  TYR  13           2HB      TYR  13   7.080   1.721  -4.578
  112    HB3  TYR  13           1HB      TYR  13   5.560   0.907  -4.251
  113    HD1  TYR  13           HD1      TYR  13   9.234   0.013  -4.300
  114    HD2  TYR  13           HD2      TYR  13   5.519  -0.341  -2.215
  115    HE1  TYR  13           HE1      TYR  13  10.347  -1.291  -2.551
  116    HE2  TYR  13           HE2      TYR  13   6.641  -1.640  -0.455
  117    HH   TYR  13           HH       TYR  13   8.782  -3.137  -0.374
  118    H    ILE  14           H        ILE  14   4.342  -0.975  -5.839
  119    HA   ILE  14           HA       ILE  14   4.909  -3.609  -4.987
  120    HB   ILE  14           HB       ILE  14   2.448  -2.466  -6.377
  121   HG12  ILE  14          2HG1      ILE  14   2.903  -3.195  -3.445
  122   HG13  ILE  14          1HG1      ILE  14   2.960  -1.554  -4.078
  123   HG21  ILE  14          1HG2      ILE  14   2.787  -5.195  -5.075
  124   HG22  ILE  14          2HG2      ILE  14   2.533  -4.886  -6.794
  125   HG23  ILE  14          3HG2      ILE  14   1.254  -4.520  -5.640
  126   HD11  ILE  14          3HD1      ILE  14   0.862  -1.943  -2.994
  127   HD12  ILE  14          1HD1      ILE  14   0.559  -3.373  -3.979
  128   HD13  ILE  14          2HD1      ILE  14   0.583  -1.772  -4.727
  129    H    MET  15           H        MET  15   4.026  -2.384  -8.291
  130    HA   MET  15           HA       MET  15   4.309  -4.962  -9.511
  131    HB2  MET  15           2HB      MET  15   4.263  -2.196 -10.810
  132    HB3  MET  15           1HB      MET  15   4.095  -3.725 -11.674
  133    HG2  MET  15           2HG      MET  15   2.188  -2.461  -9.719
  134    HG3  MET  15           1HG      MET  15   1.897  -2.912 -11.395
  135    HE1  MET  15           3HE      MET  15   1.042  -6.636 -11.224
  136    HE2  MET  15           1HE      MET  15   2.258  -5.673 -12.072
  137    HE3  MET  15           2HE      MET  15   0.590  -5.096 -11.945
  138    H    GLU  16           H        GLU  16   6.388  -2.075  -9.759
  139    HA   GLU  16           HA       GLU  16   8.364  -3.150 -11.401
  140    HB2  GLU  16           2HB      GLU  16   8.797  -0.955  -9.349
  141    HB3  GLU  16           1HB      GLU  16   9.756  -1.245 -10.792
  142    HG2  GLU  16           2HG      GLU  16   6.996  -0.069 -10.551
  143    HG3  GLU  16           1HG      GLU  16   8.423   0.612 -11.316
  144    H    ASP  17           H        ASP  17   8.120  -3.247  -7.852
  145    HA   ASP  17           HA       ASP  17  10.781  -4.555  -7.673
  146    HB2  ASP  17           2HB      ASP  17   9.210  -3.174  -5.460
  147    HB3  ASP  17           1HB      ASP  17  10.808  -3.893  -5.295
  148    H    LEU  18           H        LEU  18   7.610  -4.742  -5.936
  149    HA   LEU  18           HA       LEU  18   8.196  -7.197  -4.650
  150    HB2  LEU  18           2HB      LEU  18   5.566  -5.764  -5.094
  151    HB3  LEU  18           1HB      LEU  18   5.622  -7.308  -4.275
  152    HG   LEU  18           HG       LEU  18   5.500  -5.530  -2.621
  153   HD11  LEU  18          1HD1      LEU  18   7.402  -6.035  -1.198
  154   HD12  LEU  18          2HD1      LEU  18   8.302  -6.694  -2.564
  155   HD13  LEU  18          3HD1      LEU  18   6.839  -7.498  -1.993
  156   HD21  LEU  18          3HD2      LEU  18   7.222  -3.819  -2.312
  157   HD22  LEU  18          1HD2      LEU  18   6.443  -3.656  -3.882
  158   HD23  LEU  18          2HD2      LEU  18   8.055  -4.365  -3.769
  159    H    ILE  19           H        ILE  19   6.312  -6.600  -7.632
  160    HA   ILE  19           HA       ILE  19   6.131  -9.446  -8.236
  161    HB   ILE  19           HB       ILE  19   5.461  -7.020  -9.981
  162   HG12  ILE  19          2HG1      ILE  19   3.092  -7.847  -9.827
  163   HG13  ILE  19          1HG1      ILE  19   3.621  -9.092  -8.721
  164   HG21  ILE  19          1HG2      ILE  19   6.241  -8.830 -11.437
  165   HG22  ILE  19          2HG2      ILE  19   4.496  -8.634 -11.618
  166   HG23  ILE  19          3HG2      ILE  19   5.138  -9.966 -10.654
  167   HD11  ILE  19          3HD1      ILE  19   2.513  -7.311  -7.575
  168   HD12  ILE  19          1HD1      ILE  19   3.666  -6.143  -8.218
  169   HD13  ILE  19          2HD1      ILE  19   4.207  -7.389  -7.089
  170    H    GLY  20           H        GLY  20   7.938  -6.621  -9.447
  171    HA2  GLY  20           2HA      GLY  20  10.303  -6.701  -9.868
  172    HA3  GLY  20           1HA      GLY  20  10.148  -8.381 -10.366
  173    HA   PRO  21           HA       PRO  21  10.402  -5.855 -14.291
  174    HB2  PRO  21           2HB      PRO  21  11.978  -7.632 -15.676
  175    HB3  PRO  21           1HB      PRO  21  12.644  -6.477 -14.507
  176    HG2  PRO  21           2HG      PRO  21  11.983  -9.376 -14.103
  177    HG3  PRO  21           1HG      PRO  21  13.453  -8.481 -13.647
  178    HD2  PRO  21           2HD      PRO  21  11.504  -9.001 -11.845
  179    HD3  PRO  21           1HD      PRO  21  12.445  -7.492 -11.789
  180    H    SER  22           H        SER  22   8.775  -8.656 -13.450
  181    HA   SER  22           HA       SER  22   7.618  -9.060 -16.152
  182    HB2  SER  22           2HB      SER  22   7.760 -11.001 -13.798
  183    HB3  SER  22           1HB      SER  22   7.055 -11.354 -15.377
  184    HG   SER  22           HG       SER  22   9.036 -11.304 -16.295
  185    H    ALA  23           H        ALA  23   6.802  -6.888 -14.691
  186    HA   ALA  23           HA       ALA  23   4.440  -7.552 -13.095
  187    HB1  ALA  23           3HB      ALA  23   5.726  -4.888 -13.740
  188    HB2  ALA  23           1HB      ALA  23   6.007  -5.862 -12.296
  189    HB3  ALA  23           2HB      ALA  23   4.417  -5.158 -12.585
  190    H    LYS  24           H        LYS  24   2.432  -7.577 -13.885
  191    HA   LYS  24           HA       LYS  24   1.790  -6.419 -16.505
  192    HB2  LYS  24           2HB      LYS  24   0.133  -8.231 -14.705
  193    HB3  LYS  24           1HB      LYS  24  -0.312  -7.715 -16.332
  194    HG2  LYS  24           2HG      LYS  24   1.698  -8.890 -17.228
  195    HG3  LYS  24           1HG      LYS  24   2.067  -9.455 -15.596
  196    HD2  LYS  24           2HD      LYS  24  -0.121 -10.658 -15.549
  197    HD3  LYS  24           1HD      LYS  24  -0.431 -10.119 -17.200
  198    HE2  LYS  24           2HE      LYS  24   1.557 -11.375 -17.978
  199    HE3  LYS  24           1HE      LYS  24   1.858 -11.922 -16.330
  200    HZ1  LYS  24           3HZ      LYS  24   0.733 -13.617 -17.594
  201    HZ2  LYS  24           1HZ      LYS  24  -0.534 -12.561 -17.975
  202    HZ3  LYS  24           2HZ      LYS  24  -0.294 -13.051 -16.377
  203    H    GLU  25           H        GLU  25   2.184  -4.333 -15.511
  204    HA   GLU  25           HA       GLU  25   0.804  -3.060 -13.484
  205    HB2  GLU  25           2HB      GLU  25   1.393  -0.938 -14.656
  206    HB3  GLU  25           1HB      GLU  25   2.733  -2.064 -14.572
  207    HG2  GLU  25           2HG      GLU  25   2.369  -2.735 -16.905
  208    HG3  GLU  25           1HG      GLU  25   0.979  -1.658 -17.003
  209    H    ASP  26           H        ASP  26  -0.306  -3.780 -16.699
  210    HA   ASP  26           HA       ASP  26  -2.415  -2.010 -17.037
  211    HB2  ASP  26           2HB      ASP  26  -1.584  -3.360 -18.902
  212    HB3  ASP  26           1HB      ASP  26  -1.997  -4.851 -18.061
  213    H    GLU  27           H        GLU  27  -2.248  -5.102 -15.357
  214    HA   GLU  27           HA       GLU  27  -5.096  -5.352 -14.910
  215    HB2  GLU  27           2HB      GLU  27  -2.793  -6.966 -13.749
  216    HB3  GLU  27           1HB      GLU  27  -4.498  -7.390 -13.642
  217    HG2  GLU  27           2HG      GLU  27  -4.509  -7.439 -16.194
  218    HG3  GLU  27           1HG      GLU  27  -2.748  -7.334 -16.107
  219    H    LEU  28           H        LEU  28  -2.356  -4.054 -13.107
  220    HA   LEU  28           HA       LEU  28  -3.858  -3.848 -10.650
  221    HB2  LEU  28           2HB      LEU  28  -1.316  -4.074 -10.791
  222    HB3  LEU  28           1HB      LEU  28  -1.260  -2.412 -11.333
  223    HG   LEU  28           HG       LEU  28  -2.578  -3.085  -8.692
  224   HD11  LEU  28          1HD1      LEU  28  -0.344  -4.130  -8.623
  225   HD12  LEU  28          2HD1      LEU  28  -0.532  -2.814  -7.467
  226   HD13  LEU  28          3HD1      LEU  28   0.374  -2.550  -8.961
  227   HD21  LEU  28          3HD2      LEU  28  -1.098  -0.606  -9.619
  228   HD22  LEU  28          1HD2      LEU  28  -1.898  -0.805  -8.054
  229   HD23  LEU  28          2HD2      LEU  28  -2.848  -0.788  -9.537
  230    H    ASP  29           H        ASP  29  -5.029  -2.190  -9.997
  231    HA   ASP  29           HA       ASP  29  -4.821   0.501 -11.151
  232    HB2  ASP  29           2HB      ASP  29  -6.825  -0.702 -12.192
  233    HB3  ASP  29           1HB      ASP  29  -7.484  -0.859 -10.564
  234    H    ASP  30           H        ASP  30  -5.997   2.054  -9.645
  235    HA   ASP  30           HA       ASP  30  -5.035   1.682  -7.006
  236    HB2  ASP  30           2HB      ASP  30  -5.960   3.938  -6.571
  237    HB3  ASP  30           1HB      ASP  30  -4.978   3.879  -8.029
  238    H    GLN  31           H        GLN  31  -8.059   0.970  -8.496
  239    HA   GLN  31           HA       GLN  31  -9.393   0.574  -5.878
  240    HB2  GLN  31           2HB      GLN  31 -10.592   0.537  -8.679
  241    HB3  GLN  31           1HB      GLN  31 -11.490   0.473  -7.166
  242    HG2  GLN  31           2HG      GLN  31 -10.677   2.764  -6.626
  243    HG3  GLN  31           1HG      GLN  31  -9.853   2.821  -8.183
  244   HE21  GLN  31          1HE2      GLN  31 -11.907   4.595  -7.183
  245   HE22  GLN  31          2HE2      GLN  31 -13.228   4.528  -8.295
  246    H    THR  32           H        THR  32  -7.616  -1.162  -8.176
  247    HA   THR  32           HA       THR  32  -8.973  -3.679  -8.140
  248    HB   THR  32           HB       THR  32  -6.077  -2.986  -8.718
  249    HG1  THR  32           HG1      THR  32  -8.093  -3.849 -10.512
  250   HG21  THR  32          3HG2      THR  32  -6.170  -5.355  -7.977
  251   HG22  THR  32          1HG2      THR  32  -5.830  -5.242  -9.706
  252   HG23  THR  32          2HG2      THR  32  -7.448  -5.676  -9.150
  253    HA   PRO  33           HA       PRO  33  -7.796  -4.627  -3.863
  254    HB2  PRO  33           2HB      PRO  33  -8.975  -7.118  -3.718
  255    HB3  PRO  33           1HB      PRO  33  -9.884  -5.595  -3.604
  256    HG2  PRO  33           2HG      PRO  33  -9.561  -7.415  -5.950
  257    HG3  PRO  33           1HG      PRO  33 -11.005  -6.550  -5.391
  258    HD2  PRO  33           2HD      PRO  33  -9.477  -5.672  -7.465
  259    HD3  PRO  33           1HD      PRO  33 -10.393  -4.575  -6.412
  260    H    LEU  34           H        LEU  34  -5.653  -4.945  -3.690
  261    HA   LEU  34           HA       LEU  34  -4.057  -6.642  -5.293
  262    HB2  LEU  34           2HB      LEU  34  -3.445  -5.276  -2.645
  263    HB3  LEU  34           1HB      LEU  34  -2.253  -6.138  -3.591
  264    HG   LEU  34           HG       LEU  34  -1.852  -3.854  -3.996
  265   HD11  LEU  34          1HD1      LEU  34  -3.423  -4.818  -6.391
  266   HD12  LEU  34          2HD1      LEU  34  -1.724  -5.151  -6.044
  267   HD13  LEU  34          3HD1      LEU  34  -2.244  -3.504  -6.381
  268   HD21  LEU  34          3HD2      LEU  34  -3.888  -2.857  -3.150
  269   HD22  LEU  34          1HD2      LEU  34  -4.767  -3.380  -4.588
  270   HD23  LEU  34          2HD2      LEU  34  -3.472  -2.187  -4.726
  271    H    LEU  35           H        LEU  35  -5.391  -7.042  -1.988
  272    HA   LEU  35           HA       LEU  35  -4.176  -9.498  -1.296
  273    HB2  LEU  35           2HB      LEU  35  -6.907  -8.408  -0.543
  274    HB3  LEU  35           1HB      LEU  35  -6.227  -9.862   0.167
  275    HG   LEU  35           HG       LEU  35  -5.022  -7.081   0.450
  276   HD11  LEU  35          1HD1      LEU  35  -7.189  -7.276   1.596
  277   HD12  LEU  35          2HD1      LEU  35  -5.861  -7.164   2.745
  278   HD13  LEU  35          3HD1      LEU  35  -6.622  -8.727   2.432
  279   HD21  LEU  35          3HD2      LEU  35  -4.310  -9.671   1.877
  280   HD22  LEU  35          1HD2      LEU  35  -3.595  -8.083   2.171
  281   HD23  LEU  35          2HD2      LEU  35  -3.332  -8.896   0.631
  282    H    GLU  36           H        GLU  36  -7.283  -8.834  -2.897
  283    HA   GLU  36           HA       GLU  36  -8.206 -11.461  -3.227
  284    HB2  GLU  36           2HB      GLU  36  -9.670  -9.510  -3.512
  285    HB3  GLU  36           1HB      GLU  36  -8.734  -8.985  -4.905
  286    HG2  GLU  36           2HG      GLU  36 -10.849  -9.959  -5.607
  287    HG3  GLU  36           1HG      GLU  36  -9.503 -10.930  -6.191
  288    H    TRP  37           H        TRP  37  -6.074  -9.470  -5.254
  289    HA   TRP  37           HA       TRP  37  -6.104 -11.438  -7.446
  290    HB2  TRP  37           2HB      TRP  37  -4.757  -8.746  -7.054
  291    HB3  TRP  37           1HB      TRP  37  -4.330  -9.789  -8.409
  292    HD1  TRP  37           HD1      TRP  37  -7.724  -8.471  -6.950
  293    HE1  TRP  37           HE1      TRP  37  -9.203  -7.756  -8.913
  294    HE3  TRP  37           HE3      TRP  37  -4.564  -9.665 -10.797
  295    HZ2  TRP  37           HZ2      TRP  37  -9.054  -7.711 -11.740
  296    HZ3  TRP  37           HZ3      TRP  37  -5.319  -9.260 -13.107
  297    HH2  TRP  37           HH2      TRP  37  -7.520  -8.305 -13.564
  298    H    GLY  38           H        GLY  38  -4.711 -11.551  -4.524
  299    HA2  GLY  38           2HA      GLY  38  -3.175 -12.992  -3.648
  300    HA3  GLY  38           1HA      GLY  38  -2.903 -13.645  -5.256
  301    H    ILE  39           H        ILE  39  -2.520 -10.263  -4.828
  302    HA   ILE  39           HA       ILE  39   0.266 -10.331  -5.569
  303    HB   ILE  39           HB       ILE  39  -1.666  -8.046  -4.941
  304   HG12  ILE  39          2HG1      ILE  39  -0.615  -9.092  -7.607
  305   HG13  ILE  39          1HG1      ILE  39  -2.239  -9.327  -6.997
  306   HG21  ILE  39          1HG2      ILE  39   0.625  -7.305  -4.462
  307   HG22  ILE  39          2HG2      ILE  39  -0.018  -6.488  -5.884
  308   HG23  ILE  39          3HG2      ILE  39   1.141  -7.807  -6.077
  309   HD11  ILE  39          3HD1      ILE  39  -0.997  -6.714  -7.837
  310   HD12  ILE  39          1HD1      ILE  39  -2.630  -6.909  -7.194
  311   HD13  ILE  39          2HD1      ILE  39  -2.189  -7.658  -8.728
  312    H    LEU  40           H        LEU  40  -1.700  -9.487  -2.754
  313    HA   LEU  40           HA       LEU  40   0.712  -9.253  -1.035
  314    HB2  LEU  40           2HB      LEU  40  -2.114  -8.251  -0.559
  315    HB3  LEU  40           1HB      LEU  40  -0.731  -7.970   0.478
  316    HG   LEU  40           HG       LEU  40  -1.163  -6.821  -2.300
  317   HD11  LEU  40          1HD1      LEU  40  -2.544  -5.749  -0.617
  318   HD12  LEU  40          2HD1      LEU  40  -1.255  -4.656  -1.124
  319   HD13  LEU  40          3HD1      LEU  40  -1.137  -5.490   0.430
  320   HD21  LEU  40          3HD2      LEU  40   1.215  -6.457  -0.456
  321   HD22  LEU  40          1HD2      LEU  40   0.914  -5.553  -1.944
  322   HD23  LEU  40          2HD2      LEU  40   1.202  -7.290  -2.016
  323    H    ASN  41           H        ASN  41   1.066 -10.893   0.367
  324    HA   ASN  41           HA       ASN  41  -1.111 -11.996   1.950
  325    HB2  ASN  41           2HB      ASN  41   0.209 -13.656  -0.163
  326    HB3  ASN  41           1HB      ASN  41   0.200 -14.421   1.416
  327   HD21  ASN  41          1HD2      ASN  41  -1.814 -13.269  -1.218
  328   HD22  ASN  41          2HD2      ASN  41  -3.258 -14.079  -0.723
  329    H    SER  42           H        SER  42   0.295 -10.452   3.206
  330    HA   SER  42           HA       SER  42   1.330 -10.149   5.164
  331    HB2  SER  42           3HB      SER  42   0.446 -12.333   5.866
  332    HB3  SER  42           2HB      SER  42   1.851 -13.141   5.172
  333    H    MET  43           H        MET  43   3.399 -12.562   3.498
  334    HA   MET  43           HA       MET  43   5.837 -11.826   4.488
  335    HB2  MET  43           2HB      MET  43   5.328 -12.786   1.644
  336    HB3  MET  43           1HB      MET  43   6.825 -12.964   2.547
  337    HG2  MET  43           2HG      MET  43   4.201 -14.314   3.236
  338    HG3  MET  43           1HG      MET  43   5.523 -15.064   2.353
  339    HE1  MET  43           3HE      MET  43   5.244 -14.400   6.892
  340    HE2  MET  43           1HE      MET  43   3.906 -14.499   5.747
  341    HE3  MET  43           2HE      MET  43   4.924 -13.058   5.786
  342    H    ASN  44           H        ASN  44   4.472 -10.685   1.412
  343    HA   ASN  44           HA       ASN  44   6.638  -8.768   1.017
  344    HB2  ASN  44           2HB      ASN  44   5.746  -8.388  -1.153
  345    HB3  ASN  44           1HB      ASN  44   5.633 -10.112  -0.852
  346   HD21  ASN  44          1HD2      ASN  44   4.103  -8.075  -2.585
  347   HD22  ASN  44          2HD2      ASN  44   2.442  -8.459  -2.297
  348    H    ILE  45           H        ILE  45   3.649  -8.710   2.566
  349    HA   ILE  45           HA       ILE  45   2.789  -6.028   2.138
  350    HB   ILE  45           HB       ILE  45   2.102  -8.277   4.003
  351   HG12  ILE  45          2HG1      ILE  45   0.405  -6.446   2.276
  352   HG13  ILE  45          1HG1      ILE  45   0.967  -8.050   1.825
  353   HG21  ILE  45          1HG2      ILE  45   0.587  -6.942   5.414
  354   HG22  ILE  45          2HG2      ILE  45   1.196  -5.470   4.658
  355   HG23  ILE  45          3HG2      ILE  45   2.284  -6.473   5.632
  356   HD11  ILE  45          3HD1      ILE  45  -1.348  -8.100   2.450
  357   HD12  ILE  45          1HD1      ILE  45  -0.983  -7.377   4.019
  358   HD13  ILE  45          2HD1      ILE  45  -0.393  -9.001   3.633
  359    H    VAL  46           H        VAL  46   4.993  -7.568   4.360
  360    HA   VAL  46           HA       VAL  46   5.203  -5.498   6.304
  361    HB   VAL  46           HB       VAL  46   7.245  -7.640   5.643
  362   HG11  VAL  46          1HG1      VAL  46   6.695  -6.145   8.230
  363   HG12  VAL  46          2HG1      VAL  46   8.102  -5.921   7.187
  364   HG13  VAL  46          3HG1      VAL  46   7.872  -7.448   8.040
  365   HG21  VAL  46          3HG2      VAL  46   5.033  -8.664   5.977
  366   HG22  VAL  46          1HG2      VAL  46   4.877  -7.838   7.525
  367   HG23  VAL  46          2HG2      VAL  46   6.121  -9.068   7.302
  368    H    LYS  47           H        LYS  47   6.599  -5.994   3.200
  369    HA   LYS  47           HA       LYS  47   8.743  -4.167   3.204
  370    HB2  LYS  47           2HB      LYS  47   6.947  -5.250   1.020
  371    HB3  LYS  47           1HB      LYS  47   8.122  -3.999   0.657
  372    HG2  LYS  47           2HG      LYS  47   8.999  -6.187   0.087
  373    HG3  LYS  47           1HG      LYS  47   9.946  -5.440   1.371
  374    HD2  LYS  47           2HD      LYS  47   8.775  -6.863   3.042
  375    HD3  LYS  47           1HD      LYS  47   7.863  -7.621   1.732
  376    HE2  LYS  47           2HE      LYS  47   9.839  -8.962   2.513
  377    HE3  LYS  47           1HE      LYS  47   9.881  -8.571   0.793
  378    HZ1  LYS  47           3HZ      LYS  47  12.027  -8.247   1.825
  379    HZ2  LYS  47           1HZ      LYS  47  11.380  -7.155   2.937
  380    HZ3  LYS  47           2HZ      LYS  47  11.420  -6.766   1.292
  381    H    LEU  48           H        LEU  48   5.255  -3.747   2.666
  382    HA   LEU  48           HA       LEU  48   5.321  -0.982   1.983
  383    HB2  LEU  48           2HB      LEU  48   3.081  -2.738   3.076
  384    HB3  LEU  48           1HB      LEU  48   2.844  -1.032   2.732
  385    HG   LEU  48           HG       LEU  48   1.957  -2.304   0.881
  386   HD11  LEU  48          1HD1      LEU  48   3.046  -0.191   0.248
  387   HD12  LEU  48          2HD1      LEU  48   3.180  -1.382  -1.040
  388   HD13  LEU  48          3HD1      LEU  48   4.576  -1.038  -0.016
  389   HD21  LEU  48          3HD2      LEU  48   3.186  -4.415   1.139
  390   HD22  LEU  48          1HD2      LEU  48   4.661  -3.649   0.542
  391   HD23  LEU  48          2HD2      LEU  48   3.265  -3.838  -0.523
  392    H    MET  49           H        MET  49   5.107  -2.687   5.103
  393    HA   MET  49           HA       MET  49   4.381  -0.543   6.789
  394    HB2  MET  49           2HB      MET  49   6.241  -2.833   7.567
  395    HB3  MET  49           1HB      MET  49   5.310  -1.827   8.665
  396    HG2  MET  49           2HG      MET  49   3.231  -2.824   7.870
  397    HG3  MET  49           1HG      MET  49   4.128  -3.784   6.683
  398    HE1  MET  49           3HE      MET  49   3.429  -6.773   9.062
  399    HE2  MET  49           1HE      MET  49   3.565  -6.237   7.389
  400    HE3  MET  49           2HE      MET  49   2.307  -5.575   8.428
  401    H    VAL  50           H        VAL  50   7.611  -1.745   5.880
  402    HA   VAL  50           HA       VAL  50   9.037   0.340   7.287
  403    HB   VAL  50           HB       VAL  50  10.050  -1.885   7.077
  404   HG11  VAL  50          1HG1      VAL  50   9.174  -2.591   4.896
  405   HG12  VAL  50          2HG1      VAL  50  10.929  -2.756   4.937
  406   HG13  VAL  50          3HG1      VAL  50  10.194  -1.399   4.079
  407   HG21  VAL  50          3HG2      VAL  50  11.612   0.001   7.317
  408   HG22  VAL  50          1HG2      VAL  50  11.701   0.170   5.563
  409   HG23  VAL  50          2HG2      VAL  50  12.331  -1.281   6.345
  410    H    TYR  51           H        TYR  51   7.846  -0.111   4.009
  411    HA   TYR  51           HA       TYR  51   9.592   1.688   2.645
  412    HB2  TYR  51           2HB      TYR  51   8.110  -0.038   1.484
  413    HB3  TYR  51           1HB      TYR  51   6.746   1.020   1.783
  414    HD1  TYR  51           HD1      TYR  51  10.215   1.219   0.320
  415    HD2  TYR  51           HD2      TYR  51   6.159   2.559   0.052
  416    HE1  TYR  51           HE1      TYR  51  10.763   2.469  -1.717
  417    HE2  TYR  51           HE2      TYR  51   6.717   3.798  -1.994
  418    HH   TYR  51           HH       TYR  51   8.686   4.775  -3.093
  419    H    ILE  52           H        ILE  52   6.242   2.013   3.650
  420    HA   ILE  52           HA       ILE  52   5.816   4.724   2.932
  421    HB   ILE  52           HB       ILE  52   4.377   2.910   4.938
  422   HG12  ILE  52          2HG1      ILE  52   3.597   3.484   2.041
  423   HG13  ILE  52          1HG1      ILE  52   4.618   2.122   2.487
  424   HG21  ILE  52          1HG2      ILE  52   2.409   4.350   4.671
  425   HG22  ILE  52          2HG2      ILE  52   3.321   5.415   3.602
  426   HG23  ILE  52          3HG2      ILE  52   3.773   5.278   5.297
  427   HD11  ILE  52          3HD1      ILE  52   2.835   1.199   3.828
  428   HD12  ILE  52          1HD1      ILE  52   2.326   1.461   2.161
  429   HD13  ILE  52          2HD1      ILE  52   1.796   2.574   3.424
  430    H    ARG  53           H        ARG  53   7.050   3.182   5.858
  431    HA   ARG  53           HA       ARG  53   7.173   5.452   7.559
  432    HB2  ARG  53           2HB      ARG  53   7.400   3.132   8.385
  433    HB3  ARG  53           1HB      ARG  53   8.952   2.987   7.563
  434    HG2  ARG  53           2HG      ARG  53   9.870   4.799   8.991
  435    HG3  ARG  53           1HG      ARG  53   8.319   4.917   9.826
  436    HD2  ARG  53           2HD      ARG  53   9.950   3.626  11.125
  437    HD3  ARG  53           1HD      ARG  53   8.571   2.636  10.661
  438    HE   ARG  53           HE       ARG  53   9.980   1.262   9.533
  439   HH11  ARG  53          1HH1      ARG  53  11.717   4.291   9.917
  440   HH12  ARG  53          2HH1      ARG  53  13.190   3.663   9.260
  441   HH21  ARG  53          1HH2      ARG  53  11.923   0.455   8.731
  442   HH22  ARG  53          2HH2      ARG  53  13.302   1.492   8.593
  443    H    ASP  54           H        ASP  54   9.435   4.168   5.157
  444    HA   ASP  54           HA       ASP  54  11.519   6.129   5.774
  445    HB2  ASP  54           2HB      ASP  54  12.086   3.744   5.246
  446    HB3  ASP  54           1HB      ASP  54  11.422   3.951   3.636
  447    H    GLU  55           H        GLU  55   8.844   5.841   3.646
  448    HA   GLU  55           HA       GLU  55   9.906   7.584   1.536
  449    HB2  GLU  55           2HB      GLU  55   8.402   5.447   1.236
  450    HB3  GLU  55           1HB      GLU  55   7.065   6.474   1.700
  451    HG2  GLU  55           2HG      GLU  55   8.837   6.801  -0.736
  452    HG3  GLU  55           1HG      GLU  55   7.188   6.199  -0.721
  453    H    MET  56           H        MET  56   6.982   7.506   3.597
  454    HA   MET  56           HA       MET  56   6.740  10.456   3.386
  455    HB2  MET  56           2HB      MET  56   4.347  10.183   3.247
  456    HB3  MET  56           1HB      MET  56   5.078   9.153   2.039
  457    HG2  MET  56           2HG      MET  56   4.840   7.317   3.900
  458    HG3  MET  56           1HG      MET  56   3.651   8.433   4.559
  459    HE1  MET  56           3HE      MET  56   3.345   6.114   0.580
  460    HE2  MET  56           1HE      MET  56   4.499   5.800   1.873
  461    HE3  MET  56           2HE      MET  56   4.668   7.242   0.871
  462    H    GLY  57           H        GLY  57   7.546   8.107   5.503
  463    HA2  GLY  57           2HA      GLY  57   8.075   8.328   7.728
  464    HA3  GLY  57           1HA      GLY  57   7.272   9.885   7.749
  465    H    VAL  58           H        VAL  58   5.737   6.813   6.817
  466    HA   VAL  58           HA       VAL  58   4.171   6.802   9.356
  467    HB   VAL  58           HB       VAL  58   3.138   6.379   6.512
  468   HG11  VAL  58          1HG1      VAL  58   1.604   6.071   9.113
  469   HG12  VAL  58          2HG1      VAL  58   2.002   4.782   7.969
  470   HG13  VAL  58          3HG1      VAL  58   0.886   6.069   7.498
  471   HG21  VAL  58          3HG2      VAL  58   1.699   8.319   6.966
  472   HG22  VAL  58          1HG2      VAL  58   3.411   8.739   7.074
  473   HG23  VAL  58          2HG2      VAL  58   2.457   8.519   8.548
  474    H    SER  59           H        SER  59   4.857   4.964  10.382
  475    HA   SER  59           HA       SER  59   5.275   2.458   8.931
  476    HB2  SER  59           2HB      SER  59   5.665   1.572  11.297
  477    HB3  SER  59           1HB      SER  59   6.757   2.866  10.809
  478    HG   SER  59           HG       SER  59   4.441   3.132  12.443
  479    H    ILE  60           H        ILE  60   3.529   1.127   8.467
  480    HA   ILE  60           HA       ILE  60   0.964   1.460   9.760
  481    HB   ILE  60           HB       ILE  60   1.828  -0.961   8.114
  482   HG12  ILE  60          2HG1      ILE  60   2.010   1.241   6.807
  483   HG13  ILE  60          1HG1      ILE  60   0.918   0.042   6.122
  484   HG21  ILE  60          1HG2      ILE  60  -0.626  -1.262   7.797
  485   HG22  ILE  60          2HG2      ILE  60  -0.934   0.100   8.874
  486   HG23  ILE  60          3HG2      ILE  60  -0.158  -1.361   9.491
  487   HD11  ILE  60          3HD1      ILE  60   0.120   2.486   7.706
  488   HD12  ILE  60          1HD1      ILE  60  -1.004   1.254   7.105
  489   HD13  ILE  60          2HD1      ILE  60  -0.063   2.232   5.971
  490    HA   PRO  61           HA       PRO  61   2.461  -1.111  13.245
  491    HB2  PRO  61           2HB      PRO  61   0.431  -0.560  14.971
  492    HB3  PRO  61           1HB      PRO  61   1.674   0.648  14.589
  493    HG2  PRO  61           2HG      PRO  61  -1.090   0.390  13.453
  494    HG3  PRO  61           1HG      PRO  61  -0.255   1.840  14.055
  495    HD2  PRO  61           2HD      PRO  61  -0.410   1.216  11.410
  496    HD3  PRO  61           1HD      PRO  61   0.962   2.106  12.106
  497    H    SER  62           H        SER  62   1.625  -3.012  14.433
  498    HA   SER  62           HA       SER  62   0.445  -4.869  12.698
  499    HB2  SER  62           2HB      SER  62   0.513  -6.440  14.603
  500    HB3  SER  62           1HB      SER  62   2.022  -5.536  14.453
  501    HG   SER  62           HG       SER  62   0.947  -5.757  16.631
  502    H    THR  63           H        THR  63  -1.015  -2.756  15.077
  503    HA   THR  63           HA       THR  63  -3.548  -4.029  15.286
  504    HB   THR  63           HB       THR  63  -2.779  -2.439  16.978
  505    HG1  THR  63           HG1      THR  63  -5.109  -2.691  16.414
  506   HG21  THR  63          3HG2      THR  63  -1.560  -0.835  15.573
  507   HG22  THR  63          1HG2      THR  63  -2.748  -0.014  16.588
  508   HG23  THR  63          2HG2      THR  63  -3.082  -0.275  14.875
  509    H    HIS  64           H        HIS  64  -2.233  -1.645  13.002
  510    HA   HIS  64           HA       HIS  64  -4.755  -1.482  11.505
  511    HB2  HIS  64           2HB      HIS  64  -2.179   0.071  11.410
  512    HB3  HIS  64           1HB      HIS  64  -3.188   0.022   9.964
  513    HD1  HIS  64           HD1      HIS  64  -2.926   1.653  13.273
  514    HD2  HIS  64           HD2      HIS  64  -5.819   1.140  10.332
  515    HE1  HIS  64           HE1      HIS  64  -4.751   3.280  13.824
  516    HE2  HIS  64           HE2      HIS  64  -6.472   2.993  12.005
  517    H    ILE  65           H        ILE  65  -2.349  -3.739  11.626
  518    HA   ILE  65           HA       ILE  65  -2.391  -4.413   8.802
  519    HB   ILE  65           HB       ILE  65  -1.451  -6.110  11.158
  520   HG12  ILE  65          2HG1      ILE  65  -0.079  -4.089  10.959
  521   HG13  ILE  65          1HG1      ILE  65   0.852  -5.485  10.434
  522   HG21  ILE  65          1HG2      ILE  65  -1.999  -7.524   9.248
  523   HG22  ILE  65          2HG2      ILE  65  -0.248  -7.450   9.432
  524   HG23  ILE  65          3HG2      ILE  65  -1.041  -6.509   8.164
  525   HD11  ILE  65          3HD1      ILE  65   1.190  -3.523   9.042
  526   HD12  ILE  65          1HD1      ILE  65  -0.519  -3.527   8.606
  527   HD13  ILE  65          2HD1      ILE  65   0.520  -4.876   8.124
  528    H    THR  66           H        THR  66  -4.488  -4.609   8.256
  529    HA   THR  66           HA       THR  66  -5.779  -7.103   8.931
  530    HB   THR  66           HB       THR  66  -6.899  -5.785  10.595
  531    HG1  THR  66           HG1      THR  66  -8.739  -6.565   9.921
  532   HG21  THR  66          3HG2      THR  66  -7.946  -3.608  10.193
  533   HG22  THR  66          1HG2      THR  66  -7.437  -3.647   8.502
  534   HG23  THR  66          2HG2      THR  66  -6.230  -3.529   9.786
  535    H    GLY  67           H        GLY  67  -7.322  -7.728   7.353
  536    HA2  GLY  67           2HA      GLY  67  -6.482  -7.266   4.735
  537    HA3  GLY  67           1HA      GLY  67  -7.939  -8.120   5.197
  538    H    LYS  68           H        LYS  68  -9.272  -5.921   6.470
  539    HA   LYS  68           HA       LYS  68 -10.627  -4.799   4.263
  540    HB2  LYS  68           2HB      LYS  68 -11.819  -3.436   5.957
  541    HB3  LYS  68           1HB      LYS  68 -11.711  -5.134   6.408
  542    HG2  LYS  68           2HG      LYS  68  -9.806  -4.605   7.926
  543    HG3  LYS  68           1HG      LYS  68  -9.978  -2.893   7.521
  544    HD2  LYS  68           2HD      LYS  68 -12.236  -2.868   8.492
  545    HD3  LYS  68           1HD      LYS  68 -12.136  -4.600   8.814
  546    HE2  LYS  68           2HE      LYS  68 -10.215  -4.162  10.356
  547    HE3  LYS  68           1HE      LYS  68 -10.439  -2.431  10.095
  548    HZ1  LYS  68           3HZ      LYS  68 -12.668  -2.631  11.008
  549    HZ2  LYS  68           1HZ      LYS  68 -11.505  -3.160  12.122
  550    HZ3  LYS  68           2HZ      LYS  68 -12.435  -4.285  11.266
  551    H    TYR  69           H        TYR  69  -7.930  -3.589   6.157
  552    HA   TYR  69           HA       TYR  69  -7.986  -0.935   4.903
  553    HB2  TYR  69           2HB      TYR  69  -6.348  -2.098   7.179
  554    HB3  TYR  69           1HB      TYR  69  -6.031  -0.506   6.488
  555    HD1  TYR  69           HD2      TYR  69  -9.257  -0.089   6.071
  556    HD2  TYR  69           HD1      TYR  69  -6.718  -0.966   9.406
  557    HE1  TYR  69           HE2      TYR  69 -10.884   0.946   7.582
  558    HE2  TYR  69           HE1      TYR  69  -8.352   0.078  10.906
  559    HH   TYR  69           HH       TYR  69 -10.202   1.774  10.752
  560    H    PHE  70           H        PHE  70  -6.586  -3.958   4.325
  561    HA   PHE  70           HA       PHE  70  -4.465  -2.777   2.611
  562    HB2  PHE  70           2HB      PHE  70  -4.538  -5.341   4.218
  563    HB3  PHE  70           1HB      PHE  70  -3.560  -5.290   2.758
  564    HD1  PHE  70           HD2      PHE  70  -3.985  -3.770   6.135
  565    HD2  PHE  70           HD1      PHE  70  -1.475  -4.088   2.683
  566    HE1  PHE  70           HE2      PHE  70  -2.157  -2.675   7.349
  567    HE2  PHE  70           HE1      PHE  70   0.347  -2.985   3.909
  568    HZ   PHE  70           HZ       PHE  70   0.010  -2.279   6.245
  569    H    LYS  71           H        LYS  71  -7.501  -3.685   2.243
  570    HA   LYS  71           HA       LYS  71  -7.765  -5.753   0.428
  571    HB2  LYS  71           2HB      LYS  71  -9.252  -3.124   0.611
  572    HB3  LYS  71           1HB      LYS  71  -9.687  -4.321  -0.607
  573    HG2  LYS  71           2HG      LYS  71 -10.264  -5.931   1.119
  574    HG3  LYS  71           1HG      LYS  71  -9.717  -4.817   2.381
  575    HD2  LYS  71           2HD      LYS  71 -12.175  -4.795   2.145
  576    HD3  LYS  71           1HD      LYS  71 -11.472  -3.221   1.779
  577    HE2  LYS  71           2HE      LYS  71 -11.615  -3.888  -0.693
  578    HE3  LYS  71           1HE      LYS  71 -12.580  -5.268  -0.175
  579    HZ1  LYS  71           3HZ      LYS  71 -13.240  -2.405   0.218
  580    HZ2  LYS  71           1HZ      LYS  71 -14.175  -3.692   0.796
  581    HZ3  LYS  71           2HZ      LYS  71 -13.978  -3.467  -0.869
  582    H    ASP  72           H        ASP  72  -7.256  -2.358  -0.306
  583    HA   ASP  72           HA       ASP  72  -5.918  -2.851  -2.833
  584    HB2  ASP  72           2HB      ASP  72  -7.487  -1.445  -4.157
  585    HB3  ASP  72           1HB      ASP  72  -8.330  -2.846  -3.509
  586    H    LEU  73           H        LEU  73  -5.719  -0.443  -3.825
  587    HA   LEU  73           HA       LEU  73  -3.854   0.797  -2.107
  588    HB2  LEU  73           2HB      LEU  73  -3.633   0.723  -4.546
  589    HB3  LEU  73           1HB      LEU  73  -5.063   1.730  -4.715
  590    HG   LEU  73           HG       LEU  73  -3.794   3.552  -3.441
  591   HD11  LEU  73          1HD1      LEU  73  -2.060   2.169  -2.396
  592   HD12  LEU  73          2HD1      LEU  73  -1.329   3.403  -3.419
  593   HD13  LEU  73          3HD1      LEU  73  -1.420   1.735  -3.984
  594   HD21  LEU  73          3HD2      LEU  73  -4.126   3.807  -5.761
  595   HD22  LEU  73          1HD2      LEU  73  -2.908   2.595  -6.157
  596   HD23  LEU  73          2HD2      LEU  73  -2.426   4.143  -5.477
  597    H    ASN  74           H        ASN  74  -7.167   1.691  -3.079
  598    HA   ASN  74           HA       ASN  74  -7.093   4.254  -1.733
  599    HB2  ASN  74           2HB      ASN  74  -9.416   2.699  -2.950
  600    HB3  ASN  74           1HB      ASN  74  -9.566   4.317  -2.265
  601   HD21  ASN  74          1HD2      ASN  74 -10.039   3.426  -4.988
  602   HD22  ASN  74          2HD2      ASN  74  -9.004   4.369  -6.001
  603    H    ALA  75           H        ALA  75  -7.983   0.972  -0.815
  604    HA   ALA  75           HA       ALA  75  -9.206   1.586   1.699
  605    HB1  ALA  75           3HB      ALA  75  -9.350  -0.654   0.674
  606    HB2  ALA  75           1HB      ALA  75  -8.681  -0.747   2.306
  607    HB3  ALA  75           2HB      ALA  75  -7.615  -0.879   0.902
  608    H    ILE  76           H        ILE  76  -5.874   0.833   0.778
  609    HA   ILE  76           HA       ILE  76  -4.591   1.357   3.246
  610    HB   ILE  76           HB       ILE  76  -3.529   1.420   0.390
  611   HG12  ILE  76          2HG1      ILE  76  -3.171  -0.650   2.595
  612   HG13  ILE  76          1HG1      ILE  76  -4.339  -0.803   1.284
  613   HG21  ILE  76          1HG2      ILE  76  -2.074   2.852   1.791
  614   HG22  ILE  76          2HG2      ILE  76  -1.231   1.372   1.333
  615   HG23  ILE  76          3HG2      ILE  76  -1.893   1.541   2.958
  616   HD11  ILE  76          3HD1      ILE  76  -2.483  -0.883  -0.321
  617   HD12  ILE  76          1HD1      ILE  76  -2.402  -2.165   0.889
  618   HD13  ILE  76          2HD1      ILE  76  -1.340  -0.760   1.023
  619    H    SER  77           H        SER  77  -5.663   3.485   0.640
  620    HA   SER  77           HA       SER  77  -4.162   5.778   1.394
  621    HB2  SER  77           2HB      SER  77  -5.295   5.574  -0.834
  622    HB3  SER  77           1HB      SER  77  -6.862   5.722  -0.030
  623    HG   SER  77           HG       SER  77  -4.979   7.701   0.521
  624    H    ARG  78           H        ARG  78  -7.510   4.754   2.179
  625    HA   ARG  78           HA       ARG  78  -8.159   7.010   3.791
  626    HB2  ARG  78           2HB      ARG  78  -9.289   4.186   3.960
  627    HB3  ARG  78           1HB      ARG  78  -9.997   5.606   4.720
  628    HG2  ARG  78           2HG      ARG  78  -9.799   5.002   1.764
  629    HG3  ARG  78           1HG      ARG  78 -11.256   5.158   2.739
  630    HD2  ARG  78           2HD      ARG  78  -9.349   7.382   1.934
  631    HD3  ARG  78           1HD      ARG  78 -11.002   7.144   1.372
  632    HE   ARG  78           HE       ARG  78 -11.616   7.502   3.821
  633   HH11  ARG  78          1HH1      ARG  78  -8.897   9.114   2.280
  634   HH12  ARG  78          2HH1      ARG  78  -8.963  10.489   3.332
  635   HH21  ARG  78          1HH2      ARG  78 -11.692   9.302   5.177
  636   HH22  ARG  78          2HH2      ARG  78 -10.554  10.589   4.975
  637    H    THR  79           H        THR  79  -6.495   4.039   4.495
  638    HA   THR  79           HA       THR  79  -6.421   4.306   7.347
  639    HB   THR  79           HB       THR  79  -4.724   2.568   5.519
  640    HG1  THR  79           HG1      THR  79  -6.553   1.576   5.208
  641   HG21  THR  79          3HG2      THR  79  -4.457   1.098   7.484
  642   HG22  THR  79          1HG2      THR  79  -5.384   2.227   8.476
  643   HG23  THR  79          2HG2      THR  79  -3.808   2.704   7.839
  644    H    VAL  80           H        VAL  80  -4.252   5.155   4.688
  645    HA   VAL  80           HA       VAL  80  -2.030   5.682   6.505
  646    HB   VAL  80           HB       VAL  80  -1.809   4.616   4.160
  647   HG11  VAL  80          1HG1      VAL  80  -1.503   6.112   2.243
  648   HG12  VAL  80          2HG1      VAL  80  -2.025   7.492   3.213
  649   HG13  VAL  80          3HG1      VAL  80  -3.156   6.177   2.865
  650   HG21  VAL  80          3HG2      VAL  80   0.010   6.946   4.863
  651   HG22  VAL  80          1HG2      VAL  80   0.407   5.639   3.744
  652   HG23  VAL  80          2HG2      VAL  80   0.149   5.290   5.454
  653    H    GLU  81           H        GLU  81  -4.566   7.516   4.903
  654    HA   GLU  81           HA       GLU  81  -3.456  10.117   5.190
  655    HB2  GLU  81           2HB      GLU  81  -6.410   9.356   5.218
  656    HB3  GLU  81           1HB      GLU  81  -5.788  10.989   5.031
  657    HG2  GLU  81           2HG      GLU  81  -5.613   8.709   3.059
  658    HG3  GLU  81           1HG      GLU  81  -6.486  10.210   2.885
  659    H    GLN  82           H        GLN  82  -5.605   8.191   7.313
  660    HA   GLN  82           HA       GLN  82  -5.737  10.146   9.398
  661    HB2  GLN  82           2HB      GLN  82  -6.798   8.439  10.772
  662    HB3  GLN  82           1HB      GLN  82  -7.479   8.411   9.152
  663    HG2  GLN  82           2HG      GLN  82  -6.187   6.410   8.600
  664    HG3  GLN  82           1HG      GLN  82  -5.377   6.466  10.159
  665   HE21  GLN  82          1HE2      GLN  82  -8.851   7.015   9.685
  666   HE22  GLN  82          2HE2      GLN  82  -9.358   5.583  10.500
  667    H    LEU  83           H        LEU  83  -3.509   7.523   8.680
  668    HA   LEU  83           HA       LEU  83  -2.162   7.606  11.224
  669    HB2  LEU  83           2HB      LEU  83  -1.442   6.286   8.598
  670    HB3  LEU  83           1HB      LEU  83  -0.408   6.201  10.016
  671    HG   LEU  83           HG       LEU  83  -3.253   5.115   9.880
  672   HD11  LEU  83          1HD1      LEU  83  -0.626   3.612   9.863
  673   HD12  LEU  83          2HD1      LEU  83  -1.698   3.837   8.479
  674   HD13  LEU  83          3HD1      LEU  83  -2.246   2.902   9.871
  675   HD21  LEU  83          3HD2      LEU  83  -2.686   5.802  12.170
  676   HD22  LEU  83          1HD2      LEU  83  -1.177   4.889  12.095
  677   HD23  LEU  83          2HD2      LEU  83  -2.726   4.044  12.055
  678    H    LYS  84           H        LYS  84  -1.694   9.159   8.075
  679    HA   LYS  84           HA       LYS  84   0.710  10.558   8.813
  680    HB2  LYS  84           2HB      LYS  84  -1.414  11.209   6.734
  681    HB3  LYS  84           1HB      LYS  84  -0.018  12.244   7.008
  682    HG2  LYS  84           2HG      LYS  84   1.496  10.423   6.383
  683    HG3  LYS  84           1HG      LYS  84   0.120   9.346   6.133
  684    HD2  LYS  84           2HD      LYS  84   0.676  11.901   4.574
  685    HD3  LYS  84           1HD      LYS  84   0.983  10.261   3.997
  686    HE2  LYS  84           2HE      LYS  84  -1.403   9.749   4.082
  687    HE3  LYS  84           1HE      LYS  84  -1.749  11.340   4.762
  688    HZ1  LYS  84           3HZ      LYS  84  -2.192  11.187   2.392
  689    HZ2  LYS  84           1HZ      LYS  84  -0.557  10.870   2.101
  690    HZ3  LYS  84           2HZ      LYS  84  -1.024  12.360   2.753
  691    H    ALA  85           H        ALA  85  -2.697  11.097   9.468
  692    HA   ALA  85           HA       ALA  85  -2.419  13.788  10.417
  693    HB1  ALA  85           3HB      ALA  85  -4.682  13.482  11.314
  694    HB2  ALA  85           1HB      ALA  85  -4.584  11.745  11.015
  695    HB3  ALA  85           2HB      ALA  85  -4.578  12.878   9.659
  696    H    GLU  86           H        GLU  86  -2.061  10.597  11.864
  697    HA   GLU  86           HA       GLU  86  -1.773  11.612  14.580
  698    HB2  GLU  86           2HB      GLU  86  -1.319   8.797  13.511
  699    HB3  GLU  86           1HB      GLU  86  -1.426   9.252  15.206
  700    HG2  GLU  86           2HG      GLU  86  -3.647   9.311  13.153
  701    HG3  GLU  86           1HG      GLU  86  -3.509   8.237  14.536
  702    H    SER  87           H        SER  87   0.324  10.479  11.998
  703    HA   SER  87           HA       SER  87   2.715  10.369  13.681
  704    HB2  SER  87           2HB      SER  87   2.307   8.551  12.065
  705    HB3  SER  87           1HB      SER  87   2.328   9.708  10.734
  706    HG   SER  87           HG       SER  87   4.365   9.132  10.724
  707    H    ALA  88           H        ALA  88   1.643  12.078  10.743
  708    HA   ALA  88           HA       ALA  88   3.984  13.874  10.811
  709    HB1  ALA  88           3HB      ALA  88   3.478  12.764   8.697
  710    HB2  ALA  88           1HB      ALA  88   3.222  14.502   8.526
  711    HB3  ALA  88           2HB      ALA  88   1.839  13.414   8.701
  712    H    LEU  89           H        LEU  89   3.792  16.115  11.048
  713    HA   LEU  89           HA       LEU  89   1.315  17.170  12.150
  714    HB2  LEU  89           2HB      LEU  89   2.462  19.140  12.704
  715    HB3  LEU  89           1HB      LEU  89   3.595  17.846  13.007
  716    HG   LEU  89           HG       LEU  89   3.697  19.643  10.543
  717   HD11  LEU  89          1HD1      LEU  89   4.086  20.959  12.573
  718   HD12  LEU  89          2HD1      LEU  89   5.577  20.780  11.651
  719   HD13  LEU  89          3HD1      LEU  89   5.317  19.808  13.101
  720   HD21  LEU  89          3HD2      LEU  89   4.775  17.483  10.171
  721   HD22  LEU  89          1HD2      LEU  89   5.726  17.677  11.648
  722   HD23  LEU  89          2HD2      LEU  89   5.986  18.759  10.278
  723    H    GLU  90           H        GLU  90   2.587  16.782   9.045
  724    HA   GLU  90           HA       GLU  90   1.482  19.132   7.788
  725    HB2  GLU  90           2HB      GLU  90   2.608  16.591   6.545
  726    HB3  GLU  90           1HB      GLU  90   2.251  18.081   5.677
  727    HG2  GLU  90           2HG      GLU  90   4.008  19.253   6.903
  728    HG3  GLU  90           1HG      GLU  90   4.331  17.816   7.872
  729   H281  4EM 101          2H28      PYA 142   1.328 -10.398   8.944
  730   H283  4EM 101          3H28      PYA 142   2.194 -11.236  10.229
  731   H303  4EM 101          3H30      PYA 142  -1.175 -10.110   9.133
  732   H301  4EM 101          1H30      PYA 142  -2.014 -10.578  10.623
  733   H302  4EM 101          2H30      PYA 142  -1.384 -11.815   9.532
  734   H312  4EM 101          2H31      PYA 142   1.343  -9.340  11.709
  735   H313  4EM 101          3H31      PYA 142   0.378  -8.694  10.380
  736   H311  4EM 101          1H31      PYA 142  -0.403  -9.106  11.912
  737    H32  4EM 101           H32      PYA 142   0.970 -11.653  12.487
  738    H33  4EM 101           H33      PYA 142  -1.174 -12.061  13.421
  739    H36  4EM 101           H36      PYA 142  -2.080 -13.070  11.369
  740   H373  4EM 101          3H37      PYA 142  -0.772 -15.707  10.895
  741   H372  4EM 101          2H37      PYA 142  -2.245 -15.529  11.838
  742   H382  4EM 101          2H38      PYA 142  -2.698 -16.333   9.552
  743   H383  4EM 101          3H38      PYA 142  -1.939 -14.884   8.898
  744    H41  4EM 101           H41      PYA 142  -3.397 -13.456   8.178
  745   H423  4EM 101          3H42      PYA 142  -6.151 -13.341   9.277
  746   H422  4EM 101          2H42      PYA 142  -5.629 -12.817   7.676
  747   H433  4EM 101          3H43      PYA 142  -4.900 -11.453  10.275
  748   H432  4EM 101          2H43      PYA 142  -6.129 -10.898   9.130
  749    H44  4EM 101           H44      PYA 142  -3.339 -11.301   8.538
  750    H49  4EM 101           H49      PYA 142  -3.765  -7.191   6.861
  751    H51  4EM 101           H51      PYA 142  -1.338  -7.144   5.881
  752    H50  4EM 101           H50      PYA 142  -0.313  -9.516   6.134
  753    H48  4EM 101           H48      PYA 142  -2.117 -10.984   7.223
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1   2.734  15.738  -0.976
    2    H2   MET   1           2H       MET   1   2.247  14.982   0.453
    3    H3   MET   1           3H       MET   1   3.508  16.095   0.482
    4    HA   MET   1           HA       MET   1   1.440  16.962   1.367
    5    HB2  MET   1           2HB      MET   1   1.558  19.086   0.189
    6    HB3  MET   1           1HB      MET   1   3.173  18.439   0.415
    7    HG2  MET   1           2HG      MET   1   3.169  17.674  -1.955
    8    HG3  MET   1           1HG      MET   1   1.582  18.411  -2.168
    9    HE1  MET   1           3HE      MET   1   2.529  22.232  -1.434
   10    HE2  MET   1           1HE      MET   1   2.075  21.036  -0.221
   11    HE3  MET   1           2HE      MET   1   1.194  21.124  -1.746
   12    H    ASP   2           H        ASP   2   0.988  14.955  -1.204
   13    HA   ASP   2           HA       ASP   2  -1.838  15.715  -1.535
   14    HB2  ASP   2           2HB      ASP   2  -0.661  16.776  -3.432
   15    HB3  ASP   2           1HB      ASP   2   0.163  15.269  -3.816
   16    H    GLY   3           H        GLY   3  -3.131  13.958  -2.375
   17    HA2  GLY   3           2HA      GLY   3  -2.489  11.374  -1.298
   18    HA3  GLY   3           1HA      GLY   3  -3.935  11.829  -2.186
   19    H    GLU   4           H        GLU   4  -3.262  12.413  -4.691
   20    HA   GLU   4           HA       GLU   4  -2.736   9.883  -5.877
   21    HB2  GLU   4           2HB      GLU   4  -2.825  12.659  -7.107
   22    HB3  GLU   4           1HB      GLU   4  -2.573  11.213  -8.080
   23    HG2  GLU   4           2HG      GLU   4  -4.753  10.330  -7.226
   24    HG3  GLU   4           1HG      GLU   4  -5.019  11.875  -6.421
   25    H    GLU   5           H        GLU   5  -0.678  12.569  -5.206
   26    HA   GLU   5           HA       GLU   5   1.750  12.133  -6.356
   27    HB2  GLU   5           2HB      GLU   5   1.245  13.974  -4.822
   28    HB3  GLU   5           1HB      GLU   5   1.019  12.850  -3.492
   29    HG2  GLU   5           2HG      GLU   5   3.503  12.256  -3.777
   30    HG3  GLU   5           1HG      GLU   5   3.604  13.690  -4.806
   31    H    VAL   6           H        VAL   6   0.498  10.524  -3.409
   32    HA   VAL   6           HA       VAL   6   2.935   8.915  -3.179
   33    HB   VAL   6           HB       VAL   6   2.197   8.269  -0.961
   34   HG11  VAL   6          1HG1      VAL   6   2.060  10.484   0.145
   35   HG12  VAL   6          2HG1      VAL   6   1.731  11.232  -1.419
   36   HG13  VAL   6          3HG1      VAL   6   3.283  10.444  -1.130
   37   HG21  VAL   6          3HG2      VAL   6  -0.433   9.732  -1.424
   38   HG22  VAL   6          1HG2      VAL   6   0.081   8.962   0.083
   39   HG23  VAL   6          2HG2      VAL   6  -0.244   7.983  -1.348
   40    H    LYS   7           H        LYS   7  -0.456   8.574  -3.871
   41    HA   LYS   7           HA       LYS   7  -0.990   5.910  -3.375
   42    HB2  LYS   7           2HB      LYS   7  -2.168   7.999  -5.203
   43    HB3  LYS   7           1HB      LYS   7  -2.738   6.346  -5.405
   44    HG2  LYS   7           2HG      LYS   7  -3.794   6.301  -3.342
   45    HG3  LYS   7           1HG      LYS   7  -2.746   7.530  -2.635
   46    HD2  LYS   7           2HD      LYS   7  -5.131   8.268  -3.038
   47    HD3  LYS   7           1HD      LYS   7  -3.911   9.298  -3.768
   48    HE2  LYS   7           2HE      LYS   7  -5.721   9.039  -5.315
   49    HE3  LYS   7           1HE      LYS   7  -4.332   8.155  -5.945
   50    HZ1  LYS   7           3HZ      LYS   7  -5.326   6.120  -5.098
   51    HZ2  LYS   7           1HZ      LYS   7  -6.346   6.890  -6.197
   52    HZ3  LYS   7           2HZ      LYS   7  -6.667   6.976  -4.535
   53    H    GLU   8           H        GLU   8  -0.063   7.286  -6.514
   54    HA   GLU   8           HA       GLU   8   0.033   4.942  -8.026
   55    HB2  GLU   8           2HB      GLU   8   1.591   6.234  -9.534
   56    HB3  GLU   8           1HB      GLU   8   0.100   7.073  -9.133
   57    HG2  GLU   8           2HG      GLU   8   1.258   8.473  -7.510
   58    HG3  GLU   8           1HG      GLU   8   2.753   7.573  -7.742
   59    H    LYS   9           H        LYS   9   2.647   6.448  -6.106
   60    HA   LYS   9           HA       LYS   9   4.766   4.820  -7.065
   61    HB2  LYS   9           2HB      LYS   9   4.569   6.431  -4.497
   62    HB3  LYS   9           1HB      LYS   9   6.059   5.745  -5.139
   63    HG2  LYS   9           2HG      LYS   9   5.899   7.177  -7.122
   64    HG3  LYS   9           1HG      LYS   9   4.372   7.848  -6.537
   65    HD2  LYS   9           2HD      LYS   9   7.077   8.094  -5.167
   66    HD3  LYS   9           1HD      LYS   9   6.245   9.369  -6.053
   67    HE2  LYS   9           2HE      LYS   9   4.456   9.412  -4.402
   68    HE3  LYS   9           1HE      LYS   9   5.154   8.037  -3.548
   69    HZ1  LYS   9           3HZ      LYS   9   5.625  10.172  -2.496
   70    HZ2  LYS   9           1HZ      LYS   9   6.488  10.668  -3.861
   71    HZ3  LYS   9           2HZ      LYS   9   7.022   9.351  -2.947
   72    H    ILE  10           H        ILE  10   2.507   4.406  -4.407
   73    HA   ILE  10           HA       ILE  10   3.861   2.363  -2.956
   74    HB   ILE  10           HB       ILE  10   0.829   2.640  -3.138
   75   HG12  ILE  10          2HG1      ILE  10   1.752   4.879  -2.641
   76   HG13  ILE  10          1HG1      ILE  10   0.903   4.228  -1.253
   77   HG21  ILE  10          1HG2      ILE  10   0.848   1.782  -0.826
   78   HG22  ILE  10          2HG2      ILE  10   2.610   1.647  -0.880
   79   HG23  ILE  10          3HG2      ILE  10   1.612   0.649  -1.940
   80   HD11  ILE  10          3HD1      ILE  10   2.918   5.384  -0.584
   81   HD12  ILE  10          1HD1      ILE  10   3.898   4.335  -1.605
   82   HD13  ILE  10          2HD1      ILE  10   3.053   3.669  -0.205
   83    H    ARG  11           H        ARG  11   1.647   2.360  -5.686
   84    HA   ARG  11           HA       ARG  11   1.461  -0.509  -5.960
   85    HB2  ARG  11           2HB      ARG  11   0.254   1.875  -7.316
   86    HB3  ARG  11           1HB      ARG  11   0.280   0.361  -8.209
   87    HG2  ARG  11           2HG      ARG  11  -1.828   0.686  -7.032
   88    HG3  ARG  11           1HG      ARG  11  -0.972  -0.748  -6.501
   89    HD2  ARG  11           2HD      ARG  11  -0.738   1.808  -4.951
   90    HD3  ARG  11           1HD      ARG  11  -2.145   0.774  -4.762
   91    HE   ARG  11           HE       ARG  11   0.542  -0.338  -4.310
   92   HH11  ARG  11          1HH1      ARG  11  -2.580   0.590  -3.045
   93   HH12  ARG  11          2HH1      ARG  11  -2.348  -0.211  -1.533
   94   HH21  ARG  11          1HH2      ARG  11   0.866  -1.375  -2.310
   95   HH22  ARG  11          2HH2      ARG  11  -0.385  -1.327  -1.116
   96    H    ARG  12           H        ARG  12   3.235   2.099  -7.476
   97    HA   ARG  12           HA       ARG  12   4.346   0.673  -9.659
   98    HB2  ARG  12           2HB      ARG  12   5.081   3.189  -8.186
   99    HB3  ARG  12           1HB      ARG  12   6.372   2.431  -9.107
  100    HG2  ARG  12           2HG      ARG  12   5.109   4.251 -10.339
  101    HG3  ARG  12           1HG      ARG  12   5.195   2.703 -11.178
  102    HD2  ARG  12           2HD      ARG  12   2.918   2.181 -10.574
  103    HD3  ARG  12           1HD      ARG  12   2.818   3.585  -9.524
  104    HE   ARG  12           HE       ARG  12   3.291   4.746 -11.889
  105   HH11  ARG  12          1HH1      ARG  12   0.953   2.275 -10.979
  106   HH12  ARG  12          2HH1      ARG  12  -0.211   2.773 -12.166
  107   HH21  ARG  12          1HH2      ARG  12   1.728   5.395 -13.418
  108   HH22  ARG  12          2HH2      ARG  12   0.223   4.532 -13.541
  109    H    TYR  13           H        TYR  13   5.450   1.173  -6.338
  110    HA   TYR  13           HA       TYR  13   7.735  -0.399  -6.239
  111    HB2  TYR  13           2HB      TYR  13   7.048   1.013  -4.375
  112    HB3  TYR  13           1HB      TYR  13   5.598   0.049  -4.120
  113    HD1  TYR  13           HD1      TYR  13   9.304  -0.654  -4.424
  114    HD2  TYR  13           HD2      TYR  13   5.716  -1.293  -2.186
  115    HE1  TYR  13           HE1      TYR  13  10.548  -2.032  -2.817
  116    HE2  TYR  13           HE2      TYR  13   6.962  -2.664  -0.585
  117    HH   TYR  13           HH       TYR  13  10.269  -2.711  -0.363
  118    H    ILE  14           H        ILE  14   4.341  -1.455  -5.834
  119    HA   ILE  14           HA       ILE  14   4.797  -4.185  -5.383
  120    HB   ILE  14           HB       ILE  14   2.407  -2.839  -6.710
  121   HG12  ILE  14          2HG1      ILE  14   2.878  -3.765  -3.839
  122   HG13  ILE  14          1HG1      ILE  14   2.745  -2.097  -4.386
  123   HG21  ILE  14          1HG2      ILE  14   2.623  -5.696  -5.672
  124   HG22  ILE  14          2HG2      ILE  14   2.456  -5.212  -7.360
  125   HG23  ILE  14          3HG2      ILE  14   1.137  -4.920  -6.232
  126   HD11  ILE  14          3HD1      ILE  14   0.545  -4.153  -4.416
  127   HD12  ILE  14          1HD1      ILE  14   0.410  -2.485  -4.984
  128   HD13  ILE  14          2HD1      ILE  14   0.734  -2.818  -3.284
  129    H    MET  15           H        MET  15   4.159  -2.473  -8.452
  130    HA   MET  15           HA       MET  15   4.387  -4.680 -10.206
  131    HB2  MET  15           2HB      MET  15   5.000  -1.724 -10.746
  132    HB3  MET  15           1HB      MET  15   4.734  -2.938 -11.984
  133    HG2  MET  15           2HG      MET  15   2.523  -2.524 -10.025
  134    HG3  MET  15           1HG      MET  15   2.832  -1.228 -11.171
  135    HE1  MET  15           3HE      MET  15   1.223  -5.423 -12.291
  136    HE2  MET  15           1HE      MET  15   1.489  -4.847 -10.645
  137    HE3  MET  15           2HE      MET  15   2.868  -5.303 -11.653
  138    H    GLU  16           H        GLU  16   6.892  -2.530  -8.853
  139    HA   GLU  16           HA       GLU  16   8.908  -3.234 -10.806
  140    HB2  GLU  16           2HB      GLU  16   9.083  -1.555  -8.278
  141    HB3  GLU  16           1HB      GLU  16  10.398  -1.757  -9.427
  142    HG2  GLU  16           2HG      GLU  16   7.738  -0.422  -9.966
  143    HG3  GLU  16           1HG      GLU  16   9.289   0.370  -9.756
  144    H    ASP  17           H        ASP  17   8.267  -4.085  -7.420
  145    HA   ASP  17           HA       ASP  17  10.711  -5.787  -7.392
  146    HB2  ASP  17           2HB      ASP  17   9.410  -4.180  -5.155
  147    HB3  ASP  17           1HB      ASP  17  10.601  -5.439  -4.834
  148    H    LEU  18           H        LEU  18   7.395  -5.496  -6.108
  149    HA   LEU  18           HA       LEU  18   7.351  -8.143  -5.007
  150    HB2  LEU  18           2HB      LEU  18   5.102  -6.181  -5.574
  151    HB3  LEU  18           1HB      LEU  18   4.827  -7.744  -4.850
  152    HG   LEU  18           HG       LEU  18   4.816  -6.037  -3.114
  153   HD11  LEU  18          1HD1      LEU  18   5.717  -8.219  -2.446
  154   HD12  LEU  18          2HD1      LEU  18   6.464  -6.914  -1.531
  155   HD13  LEU  18          3HD1      LEU  18   7.355  -7.685  -2.844
  156   HD21  LEU  18          3HD2      LEU  18   6.742  -4.633  -2.525
  157   HD22  LEU  18          1HD2      LEU  18   6.192  -4.287  -4.163
  158   HD23  LEU  18          2HD2      LEU  18   7.644  -5.256  -3.908
  159    H    ILE  19           H        ILE  19   6.314  -6.813  -8.158
  160    HA   ILE  19           HA       ILE  19   5.834  -9.501  -9.220
  161    HB   ILE  19           HB       ILE  19   5.572  -6.773 -10.559
  162   HG12  ILE  19          2HG1      ILE  19   3.186  -7.388 -10.885
  163   HG13  ILE  19          1HG1      ILE  19   3.462  -8.906 -10.084
  164   HG21  ILE  19          1HG2      ILE  19   6.484  -8.311 -12.233
  165   HG22  ILE  19          2HG2      ILE  19   4.801  -7.960 -12.617
  166   HG23  ILE  19          3HG2      ILE  19   5.233  -9.502 -11.869
  167   HD11  ILE  19          3HD1      ILE  19   3.581  -6.198  -8.822
  168   HD12  ILE  19          1HD1      ILE  19   3.852  -7.735  -7.992
  169   HD13  ILE  19          2HD1      ILE  19   2.272  -7.373  -8.687
  170    H    GLY  20           H        GLY  20   7.851  -6.695 -10.219
  171    HA2  GLY  20           2HA      GLY  20  10.340  -7.110 -10.207
  172    HA3  GLY  20           1HA      GLY  20   9.981  -8.571 -11.117
  173    HA   PRO  21           HA       PRO  21  11.015  -5.215 -14.224
  174    HB2  PRO  21           2HB      PRO  21  12.478  -6.818 -15.916
  175    HB3  PRO  21           1HB      PRO  21  13.168  -6.095 -14.451
  176    HG2  PRO  21           2HG      PRO  21  12.096  -8.874 -14.827
  177    HG3  PRO  21           1HG      PRO  21  13.621  -8.347 -14.072
  178    HD2  PRO  21           2HD      PRO  21  11.475  -8.972 -12.569
  179    HD3  PRO  21           1HD      PRO  21  12.573  -7.657 -12.102
  180    H    SER  22           H        SER  22   9.411  -8.289 -14.460
  181    HA   SER  22           HA       SER  22   8.145  -7.655 -17.051
  182    HB2  SER  22           2HB      SER  22   7.160  -9.996 -16.700
  183    HB3  SER  22           1HB      SER  22   8.916  -9.931 -16.866
  184    HG   SER  22           HG       SER  22   7.353 -10.423 -14.587
  185    H    ALA  23           H        ALA  23   7.522  -5.794 -15.284
  186    HA   ALA  23           HA       ALA  23   5.387  -6.291 -13.466
  187    HB1  ALA  23           3HB      ALA  23   6.500  -3.713 -14.589
  188    HB2  ALA  23           1HB      ALA  23   6.987  -4.531 -13.101
  189    HB3  ALA  23           2HB      ALA  23   5.372  -3.838 -13.233
  190    H    LYS  24           H        LYS  24   3.445  -6.908 -14.198
  191    HA   LYS  24           HA       LYS  24   2.388  -6.090 -16.775
  192    HB2  LYS  24           2HB      LYS  24   1.223  -7.927 -14.652
  193    HB3  LYS  24           1HB      LYS  24   0.616  -7.738 -16.297
  194    HG2  LYS  24           2HG      LYS  24   2.713  -8.654 -17.202
  195    HG3  LYS  24           1HG      LYS  24   3.370  -8.808 -15.570
  196    HD2  LYS  24           2HD      LYS  24   0.924 -10.261 -16.634
  197    HD3  LYS  24           1HD      LYS  24   2.529 -10.962 -16.438
  198    HE2  LYS  24           2HE      LYS  24   2.412 -10.683 -14.028
  199    HE3  LYS  24           1HE      LYS  24   0.864  -9.845 -14.157
  200    HZ1  LYS  24           3HZ      LYS  24  -0.104 -11.864 -15.049
  201    HZ2  LYS  24           1HZ      LYS  24   0.566 -12.129 -13.524
  202    HZ3  LYS  24           2HZ      LYS  24   1.375 -12.670 -14.907
  203    H    GLU  25           H        GLU  25   2.103  -3.894 -16.358
  204    HA   GLU  25           HA       GLU  25   0.611  -2.723 -14.249
  205    HB2  GLU  25           2HB      GLU  25   0.550  -0.697 -16.031
  206    HB3  GLU  25           1HB      GLU  25   1.991  -1.134 -15.150
  207    HG2  GLU  25           2HG      GLU  25   2.468  -0.646 -17.512
  208    HG3  GLU  25           1HG      GLU  25   2.911  -2.288 -17.063
  209    H    ASP  26           H        ASP  26  -0.477  -4.369 -17.037
  210    HA   ASP  26           HA       ASP  26  -2.802  -2.909 -17.669
  211    HB2  ASP  26           2HB      ASP  26  -3.482  -4.828 -19.012
  212    HB3  ASP  26           1HB      ASP  26  -1.753  -4.564 -19.211
  213    H    GLU  27           H        GLU  27  -2.210  -5.487 -15.330
  214    HA   GLU  27           HA       GLU  27  -5.060  -5.967 -14.887
  215    HB2  GLU  27           2HB      GLU  27  -4.314  -7.755 -13.349
  216    HB3  GLU  27           1HB      GLU  27  -3.635  -7.919 -14.966
  217    HG2  GLU  27           2HG      GLU  27  -1.467  -7.239 -14.254
  218    HG3  GLU  27           1HG      GLU  27  -2.072  -6.646 -12.706
  219    H    LEU  28           H        LEU  28  -2.378  -4.335 -13.327
  220    HA   LEU  28           HA       LEU  28  -3.760  -4.076 -10.797
  221    HB2  LEU  28           2HB      LEU  28  -1.284  -4.408 -10.994
  222    HB3  LEU  28           1HB      LEU  28  -1.147  -2.841 -11.749
  223    HG   LEU  28           HG       LEU  28  -2.326  -3.036  -8.963
  224   HD11  LEU  28          1HD1      LEU  28  -0.216  -4.330  -8.872
  225   HD12  LEU  28          2HD1      LEU  28  -0.139  -2.844  -7.926
  226   HD13  LEU  28          3HD1      LEU  28   0.655  -2.928  -9.501
  227   HD21  LEU  28          3HD2      LEU  28  -1.394  -0.790  -8.707
  228   HD22  LEU  28          1HD2      LEU  28  -2.421  -0.861 -10.128
  229   HD23  LEU  28          2HD2      LEU  28  -0.664  -0.874 -10.309
  230    H    ASP  29           H        ASP  29  -4.704  -2.194 -10.038
  231    HA   ASP  29           HA       ASP  29  -4.828   0.230 -11.703
  232    HB2  ASP  29           2HB      ASP  29  -6.846  -1.375 -12.142
  233    HB3  ASP  29           1HB      ASP  29  -7.347  -1.001 -10.497
  234    H    ASP  30           H        ASP  30  -5.908   1.990 -10.469
  235    HA   ASP  30           HA       ASP  30  -4.891   2.412  -7.869
  236    HB2  ASP  30           2HB      ASP  30  -5.340   4.175  -9.627
  237    HB3  ASP  30           1HB      ASP  30  -7.064   3.933  -9.387
  238    H    GLN  31           H        GLN  31  -7.846   1.083  -9.065
  239    HA   GLN  31           HA       GLN  31  -9.032   0.937  -6.350
  240    HB2  GLN  31           2HB      GLN  31 -10.420   1.118  -9.056
  241    HB3  GLN  31           1HB      GLN  31 -11.246   0.806  -7.532
  242    HG2  GLN  31           2HG      GLN  31 -10.494   2.984  -6.650
  243    HG3  GLN  31           1HG      GLN  31  -9.633   3.302  -8.156
  244   HE21  GLN  31          1HE2      GLN  31 -10.817   3.850 -10.007
  245   HE22  GLN  31          2HE2      GLN  31 -12.472   4.338  -9.929
  246    H    THR  32           H        THR  32  -7.107  -0.935  -7.611
  247    HA   THR  32           HA       THR  32  -8.644  -3.407  -7.977
  248    HB   THR  32           HB       THR  32  -5.668  -2.850  -8.134
  249    HG1  THR  32           HG1      THR  32  -7.745  -3.372  -9.931
  250   HG21  THR  32          3HG2      THR  32  -5.372  -5.258  -8.795
  251   HG22  THR  32          1HG2      THR  32  -7.040  -5.569  -8.304
  252   HG23  THR  32          2HG2      THR  32  -5.843  -5.073  -7.105
  253    HA   PRO  33           HA       PRO  33  -8.149  -4.275  -3.519
  254    HB2  PRO  33           2HB      PRO  33  -9.600  -6.613  -3.498
  255    HB3  PRO  33           1HB      PRO  33 -10.350  -5.001  -3.503
  256    HG2  PRO  33           2HG      PRO  33  -9.962  -6.900  -5.772
  257    HG3  PRO  33           1HG      PRO  33 -11.345  -5.854  -5.401
  258    HD2  PRO  33           2HD      PRO  33  -9.440  -5.239  -7.282
  259    HD3  PRO  33           1HD      PRO  33 -10.398  -4.014  -6.426
  260    H    LEU  34           H        LEU  34  -6.127  -4.796  -3.151
  261    HA   LEU  34           HA       LEU  34  -4.454  -6.492  -4.604
  262    HB2  LEU  34           2HB      LEU  34  -4.034  -5.504  -1.769
  263    HB3  LEU  34           1HB      LEU  34  -2.790  -5.978  -2.917
  264    HG   LEU  34           HG       LEU  34  -4.613  -3.563  -3.257
  265   HD11  LEU  34          1HD1      LEU  34  -2.682  -2.199  -2.679
  266   HD12  LEU  34          2HD1      LEU  34  -1.726  -3.647  -2.359
  267   HD13  LEU  34          3HD1      LEU  34  -3.123  -3.263  -1.347
  268   HD21  LEU  34          3HD2      LEU  34  -2.189  -4.444  -4.878
  269   HD22  LEU  34          1HD2      LEU  34  -3.016  -2.889  -5.050
  270   HD23  LEU  34          2HD2      LEU  34  -3.864  -4.385  -5.432
  271    H    LEU  35           H        LEU  35  -5.734  -6.985  -1.254
  272    HA   LEU  35           HA       LEU  35  -4.674  -9.563  -0.807
  273    HB2  LEU  35           2HB      LEU  35  -7.123  -8.198   0.346
  274    HB3  LEU  35           1HB      LEU  35  -6.731  -9.844   0.797
  275    HG   LEU  35           HG       LEU  35  -6.014  -8.283   2.521
  276   HD11  LEU  35          1HD1      LEU  35  -3.598  -9.500   1.144
  277   HD12  LEU  35          2HD1      LEU  35  -4.670 -10.307   2.291
  278   HD13  LEU  35          3HD1      LEU  35  -3.675  -8.955   2.823
  279   HD21  LEU  35          3HD2      LEU  35  -4.260  -6.622   2.192
  280   HD22  LEU  35          1HD2      LEU  35  -5.667  -6.281   1.189
  281   HD23  LEU  35          2HD2      LEU  35  -4.220  -6.981   0.463
  282    H    GLU  36           H        GLU  36  -7.766  -8.563  -2.205
  283    HA   GLU  36           HA       GLU  36  -8.961 -11.094  -2.547
  284    HB2  GLU  36           2HB      GLU  36 -10.223  -8.944  -2.636
  285    HB3  GLU  36           1HB      GLU  36  -9.445  -8.559  -4.170
  286    HG2  GLU  36           2HG      GLU  36 -10.486 -10.708  -5.081
  287    HG3  GLU  36           1HG      GLU  36 -11.421 -10.772  -3.586
  288    H    TRP  37           H        TRP  37  -6.764  -9.221  -4.593
  289    HA   TRP  37           HA       TRP  37  -6.999 -11.131  -6.843
  290    HB2  TRP  37           2HB      TRP  37  -5.577  -8.464  -6.488
  291    HB3  TRP  37           1HB      TRP  37  -5.243  -9.501  -7.871
  292    HD1  TRP  37           HD1      TRP  37  -8.742  -8.623  -6.358
  293    HE1  TRP  37           HE1      TRP  37 -10.161  -7.575  -8.220
  294    HE3  TRP  37           HE3      TRP  37  -5.253  -8.562 -10.098
  295    HZ2  TRP  37           HZ2      TRP  37  -9.856  -6.823 -10.922
  296    HZ3  TRP  37           HZ3      TRP  37  -5.900  -7.663 -12.298
  297    HH2  TRP  37           HH2      TRP  37  -8.155  -6.813 -12.701
  298    H    GLY  38           H        GLY  38  -5.564 -11.385  -3.999
  299    HA2  GLY  38           2HA      GLY  38  -4.002 -12.830  -3.195
  300    HA3  GLY  38           1HA      GLY  38  -3.786 -13.445  -4.823
  301    H    ILE  39           H        ILE  39  -3.294 -10.083  -4.507
  302    HA   ILE  39           HA       ILE  39  -0.576 -10.184  -5.359
  303    HB   ILE  39           HB       ILE  39  -2.303  -7.849  -4.395
  304   HG12  ILE  39          2HG1      ILE  39  -1.567  -8.696  -7.238
  305   HG13  ILE  39          1HG1      ILE  39  -3.134  -8.950  -6.483
  306   HG21  ILE  39          1HG2      ILE  39   0.396  -7.678  -5.784
  307   HG22  ILE  39          2HG2      ILE  39   0.069  -7.264  -4.101
  308   HG23  ILE  39          3HG2      ILE  39  -0.653  -6.311  -5.397
  309   HD11  ILE  39          3HD1      ILE  39  -3.217  -7.098  -8.020
  310   HD12  ILE  39          1HD1      ILE  39  -1.893  -6.289  -7.182
  311   HD13  ILE  39          2HD1      ILE  39  -3.447  -6.506  -6.375
  312    H    LEU  40           H        LEU  40  -2.247  -9.592  -2.316
  313    HA   LEU  40           HA       LEU  40   0.314  -9.587  -0.810
  314    HB2  LEU  40           2HB      LEU  40  -2.373  -8.453   0.064
  315    HB3  LEU  40           1HB      LEU  40  -0.847  -8.313   0.925
  316    HG   LEU  40           HG       LEU  40  -1.536  -6.993  -1.726
  317   HD11  LEU  40          1HD1      LEU  40  -1.191  -5.813   1.042
  318   HD12  LEU  40          2HD1      LEU  40  -2.678  -5.916   0.086
  319   HD13  LEU  40          3HD1      LEU  40  -1.359  -4.883  -0.451
  320   HD21  LEU  40          3HD2      LEU  40   0.820  -7.596  -1.719
  321   HD22  LEU  40          1HD2      LEU  40   1.046  -6.824  -0.141
  322   HD23  LEU  40          2HD2      LEU  40   0.635  -5.853  -1.558
  323    H    ASN  41           H        ASN  41   0.550 -11.028   0.835
  324    HA   ASN  41           HA       ASN  41  -1.728 -12.649   1.765
  325    HB2  ASN  41           2HB      ASN  41   0.924 -13.740   0.758
  326    HB3  ASN  41           1HB      ASN  41  -0.068 -14.654   1.886
  327   HD21  ASN  41          1HD2      ASN  41   0.133 -13.390  -1.379
  328   HD22  ASN  41          2HD2      ASN  41  -1.127 -14.368  -2.039
  329    H    SER  42           H        SER  42   1.774 -11.947   2.370
  330    HA   SER  42           HA       SER  42   1.350 -11.169   5.074
  331    HB2  SER  42           3HB      SER  42   0.861 -13.431   5.638
  332    HB3  SER  42           2HB      SER  42   2.141 -14.047   4.585
  333    H    MET  43           H        MET  43   4.059 -13.184   3.818
  334    HA   MET  43           HA       MET  43   6.067 -11.593   4.938
  335    HB2  MET  43           2HB      MET  43   7.606 -12.832   3.176
  336    HB3  MET  43           1HB      MET  43   6.837 -13.726   4.471
  337    HG2  MET  43           2HG      MET  43   6.779 -14.883   2.283
  338    HG3  MET  43           1HG      MET  43   5.185 -14.624   2.985
  339    HE1  MET  43           3HE      MET  43   3.296 -13.145   0.142
  340    HE2  MET  43           1HE      MET  43   3.317 -13.107   1.904
  341    HE3  MET  43           2HE      MET  43   3.516 -14.641   1.052
  342    H    ASN  44           H        ASN  44   4.367 -11.051   2.011
  343    HA   ASN  44           HA       ASN  44   6.320  -9.145   0.926
  344    HB2  ASN  44           2HB      ASN  44   4.902  -9.140  -1.060
  345    HB3  ASN  44           1HB      ASN  44   5.270 -10.792  -0.586
  346   HD21  ASN  44          1HD2      ASN  44   3.139  -9.932  -2.261
  347   HD22  ASN  44          2HD2      ASN  44   1.660 -10.393  -1.503
  348    H    ILE  45           H        ILE  45   3.334  -9.184   2.718
  349    HA   ILE  45           HA       ILE  45   2.394  -6.550   2.112
  350    HB   ILE  45           HB       ILE  45   1.202  -8.669   3.328
  351   HG12  ILE  45          2HG1      ILE  45   0.376  -5.794   3.926
  352   HG13  ILE  45          1HG1      ILE  45   0.040  -6.640   2.421
  353   HG21  ILE  45          1HG2      ILE  45   1.842  -6.910   5.727
  354   HG22  ILE  45          2HG2      ILE  45   2.523  -8.507   5.433
  355   HG23  ILE  45          3HG2      ILE  45   0.791  -8.329   5.717
  356   HD11  ILE  45          3HD1      ILE  45  -1.336  -8.264   3.662
  357   HD12  ILE  45          1HD1      ILE  45  -1.916  -6.604   3.833
  358   HD13  ILE  45          2HD1      ILE  45  -1.023  -7.362   5.151
  359    H    VAL  46           H        VAL  46   4.837  -7.813   4.125
  360    HA   VAL  46           HA       VAL  46   5.147  -5.714   6.033
  361    HB   VAL  46           HB       VAL  46   7.170  -7.824   5.159
  362   HG11  VAL  46          1HG1      VAL  46   8.184  -6.048   6.521
  363   HG12  VAL  46          2HG1      VAL  46   8.104  -7.551   7.438
  364   HG13  VAL  46          3HG1      VAL  46   6.941  -6.262   7.759
  365   HG21  VAL  46          3HG2      VAL  46   5.047  -8.910   5.795
  366   HG22  VAL  46          1HG2      VAL  46   5.028  -8.026   7.321
  367   HG23  VAL  46          2HG2      VAL  46   6.284  -9.227   7.012
  368    H    LYS  47           H        LYS  47   6.170  -6.205   2.772
  369    HA   LYS  47           HA       LYS  47   8.377  -4.406   2.654
  370    HB2  LYS  47           2HB      LYS  47   6.629  -5.708   0.555
  371    HB3  LYS  47           1HB      LYS  47   7.754  -4.442   0.085
  372    HG2  LYS  47           2HG      LYS  47   8.762  -6.617  -0.283
  373    HG3  LYS  47           1HG      LYS  47   9.630  -5.750   0.986
  374    HD2  LYS  47           2HD      LYS  47   8.330  -7.080   2.689
  375    HD3  LYS  47           1HD      LYS  47   7.635  -8.005   1.362
  376    HE2  LYS  47           2HE      LYS  47   9.484  -9.235   2.348
  377    HE3  LYS  47           1HE      LYS  47   9.926  -8.731   0.716
  378    HZ1  LYS  47           3HZ      LYS  47  10.735  -7.388   3.232
  379    HZ2  LYS  47           1HZ      LYS  47  11.158  -6.891   1.673
  380    HZ3  LYS  47           2HZ      LYS  47  11.716  -8.367   2.264
  381    H    LEU  48           H        LEU  48   4.917  -4.013   2.471
  382    HA   LEU  48           HA       LEU  48   4.934  -1.307   1.486
  383    HB2  LEU  48           2HB      LEU  48   2.729  -2.915   2.846
  384    HB3  LEU  48           1HB      LEU  48   2.514  -1.273   2.265
  385    HG   LEU  48           HG       LEU  48   1.545  -2.735   0.626
  386   HD11  LEU  48          1HD1      LEU  48   4.213  -1.777  -0.489
  387   HD12  LEU  48          2HD1      LEU  48   2.745  -0.809  -0.337
  388   HD13  LEU  48          3HD1      LEU  48   2.777  -2.187  -1.433
  389   HD21  LEU  48          3HD2      LEU  48   2.647  -4.853   1.188
  390   HD22  LEU  48          1HD2      LEU  48   4.158  -4.279   0.476
  391   HD23  LEU  48          2HD2      LEU  48   2.740  -4.541  -0.543
  392    H    MET  49           H        MET  49   4.912  -2.839   4.689
  393    HA   MET  49           HA       MET  49   4.292  -0.653   6.355
  394    HB2  MET  49           2HB      MET  49   6.321  -2.828   7.039
  395    HB3  MET  49           1HB      MET  49   5.430  -1.833   8.176
  396    HG2  MET  49           2HG      MET  49   3.370  -2.979   7.632
  397    HG3  MET  49           1HG      MET  49   4.192  -3.911   6.369
  398    HE1  MET  49           3HE      MET  49   2.646  -5.610   8.568
  399    HE2  MET  49           1HE      MET  49   3.879  -6.806   8.962
  400    HE3  MET  49           2HE      MET  49   3.649  -6.297   7.289
  401    H    VAL  50           H        VAL  50   7.469  -1.900   5.357
  402    HA   VAL  50           HA       VAL  50   9.027   0.149   6.589
  403    HB   VAL  50           HB       VAL  50   9.984  -2.082   6.149
  404   HG11  VAL  50          1HG1      VAL  50   8.916  -2.647   4.018
  405   HG12  VAL  50          2HG1      VAL  50  10.667  -2.793   3.871
  406   HG13  VAL  50          3HG1      VAL  50   9.840  -1.388   3.191
  407   HG21  VAL  50          3HG2      VAL  50  11.497   0.094   4.648
  408   HG22  VAL  50          1HG2      VAL  50  12.196  -1.412   5.254
  409   HG23  VAL  50          2HG2      VAL  50  11.567  -0.213   6.384
  410    H    TYR  51           H        TYR  51   7.643  -0.250   3.369
  411    HA   TYR  51           HA       TYR  51   9.148   1.572   1.861
  412    HB2  TYR  51           2HB      TYR  51   7.424  -0.056   0.911
  413    HB3  TYR  51           1HB      TYR  51   6.168   1.024   1.485
  414    HD1  TYR  51           HD1      TYR  51   9.144   0.897  -0.777
  415    HD2  TYR  51           HD2      TYR  51   5.481   2.917   0.128
  416    HE1  TYR  51           HE1      TYR  51   9.351   2.198  -2.845
  417    HE2  TYR  51           HE2      TYR  51   5.690   4.211  -1.940
  418    HH   TYR  51           HH       TYR  51   7.507   4.969  -3.459
  419    H    ILE  52           H        ILE  52   6.079   2.014   3.493
  420    HA   ILE  52           HA       ILE  52   5.669   4.746   2.834
  421    HB   ILE  52           HB       ILE  52   4.406   3.022   5.020
  422   HG12  ILE  52          2HG1      ILE  52   3.271   3.588   2.242
  423   HG13  ILE  52          1HG1      ILE  52   4.293   2.191   2.555
  424   HG21  ILE  52          1HG2      ILE  52   3.351   5.563   3.761
  425   HG22  ILE  52          2HG2      ILE  52   3.988   5.406   5.394
  426   HG23  ILE  52          3HG2      ILE  52   2.510   4.557   4.946
  427   HD11  ILE  52          3HD1      ILE  52   2.688   1.351   4.154
  428   HD12  ILE  52          1HD1      ILE  52   1.954   1.615   2.573
  429   HD13  ILE  52          2HD1      ILE  52   1.652   2.759   3.883
  430    H    ARG  53           H        ARG  53   7.355   3.158   5.452
  431    HA   ARG  53           HA       ARG  53   7.578   5.327   7.268
  432    HB2  ARG  53           2HB      ARG  53   8.032   3.002   7.904
  433    HB3  ARG  53           1HB      ARG  53   9.439   2.974   6.843
  434    HG2  ARG  53           2HG      ARG  53  10.426   4.837   8.253
  435    HG3  ARG  53           1HG      ARG  53   9.075   4.617   9.368
  436    HD2  ARG  53           2HD      ARG  53  10.975   3.418  10.214
  437    HD3  ARG  53           1HD      ARG  53   9.789   2.231   9.666
  438    HE   ARG  53           HE       ARG  53  11.682   2.849   7.616
  439   HH11  ARG  53          1HH1      ARG  53  11.382   0.949  10.559
  440   HH12  ARG  53          2HH1      ARG  53  12.609  -0.190  10.091
  441   HH21  ARG  53          1HH2      ARG  53  13.291   1.367   7.036
  442   HH22  ARG  53          2HH2      ARG  53  13.687   0.048   8.097
  443    H    ASP  54           H        ASP  54   9.852   4.216   4.642
  444    HA   ASP  54           HA       ASP  54  11.625   6.490   5.076
  445    HB2  ASP  54           2HB      ASP  54  12.854   5.618   3.107
  446    HB3  ASP  54           1HB      ASP  54  12.616   4.390   4.329
  447    H    GLU  55           H        GLU  55   8.936   5.703   3.036
  448    HA   GLU  55           HA       GLU  55   9.224   7.715   1.045
  449    HB2  GLU  55           2HB      GLU  55   7.906   5.636   0.714
  450    HB3  GLU  55           1HB      GLU  55   6.785   6.143   1.966
  451    HG2  GLU  55           2HG      GLU  55   5.765   6.474  -0.174
  452    HG3  GLU  55           1HG      GLU  55   6.082   8.048   0.546
  453    H    MET  56           H        MET  56   6.671   7.483   3.539
  454    HA   MET  56           HA       MET  56   6.326  10.428   3.459
  455    HB2  MET  56           2HB      MET  56   4.414   8.119   3.942
  456    HB3  MET  56           1HB      MET  56   3.988   9.752   4.433
  457    HG2  MET  56           2HG      MET  56   4.002  10.538   2.198
  458    HG3  MET  56           1HG      MET  56   4.783   9.076   1.597
  459    HE1  MET  56           3HE      MET  56   2.031   6.472   1.371
  460    HE2  MET  56           1HE      MET  56   3.448   6.583   2.415
  461    HE3  MET  56           2HE      MET  56   3.558   7.051   0.716
  462    H    GLY  57           H        GLY  57   7.808   8.236   5.410
  463    HA2  GLY  57           2HA      GLY  57   8.661   8.484   7.552
  464    HA3  GLY  57           1HA      GLY  57   7.704   9.941   7.777
  465    H    VAL  58           H        VAL  58   5.905   7.235   6.694
  466    HA   VAL  58           HA       VAL  58   4.559   7.121   9.333
  467    HB   VAL  58           HB       VAL  58   3.452   6.516   6.547
  468   HG11  VAL  58          1HG1      VAL  58   2.273   5.220   8.233
  469   HG12  VAL  58          2HG1      VAL  58   1.220   6.486   7.599
  470   HG13  VAL  58          3HG1      VAL  58   1.969   6.678   9.186
  471   HG21  VAL  58          3HG2      VAL  58   2.970   8.976   8.252
  472   HG22  VAL  58          1HG2      VAL  58   2.160   8.601   6.727
  473   HG23  VAL  58          2HG2      VAL  58   3.899   8.903   6.752
  474    H    SER  59           H        SER  59   5.116   5.283  10.415
  475    HA   SER  59           HA       SER  59   5.452   2.743   8.964
  476    HB2  SER  59           2HB      SER  59   6.122   1.869  11.246
  477    HB3  SER  59           1HB      SER  59   7.150   3.176  10.664
  478    HG   SER  59           HG       SER  59   4.975   3.964  12.196
  479    H    ILE  60           H        ILE  60   3.582   1.659   8.565
  480    HA   ILE  60           HA       ILE  60   1.106   1.989   9.898
  481    HB   ILE  60           HB       ILE  60   2.021  -0.565   8.483
  482   HG12  ILE  60          2HG1      ILE  60   2.024   1.792   7.123
  483   HG13  ILE  60          1HG1      ILE  60   1.558   0.271   6.377
  484   HG21  ILE  60          1HG2      ILE  60  -0.780   0.498   9.063
  485   HG22  ILE  60          2HG2      ILE  60   0.005  -0.889   9.820
  486   HG23  ILE  60          3HG2      ILE  60  -0.413  -0.946   8.111
  487   HD11  ILE  60          3HD1      ILE  60   0.029   2.090   5.800
  488   HD12  ILE  60          1HD1      ILE  60  -0.363   2.310   7.504
  489   HD13  ILE  60          2HD1      ILE  60  -0.802   0.809   6.691
  490    HA   PRO  61           HA       PRO  61   2.433  -0.253  13.707
  491    HB2  PRO  61           2HB      PRO  61   0.038  -0.016  15.073
  492    HB3  PRO  61           1HB      PRO  61   1.212   1.308  14.948
  493    HG2  PRO  61           2HG      PRO  61  -1.256   0.847  13.314
  494    HG3  PRO  61           1HG      PRO  61  -0.675   2.348  14.076
  495    HD2  PRO  61           2HD      PRO  61  -0.287   1.869  11.455
  496    HD3  PRO  61           1HD      PRO  61   0.936   2.721  12.420
  497    H    SER  62           H        SER  62   1.730  -2.230  14.821
  498    HA   SER  62           HA       SER  62   1.026  -4.271  12.937
  499    HB2  SER  62           2HB      SER  62   1.296  -5.782  15.005
  500    HB3  SER  62           1HB      SER  62   2.703  -4.840  14.539
  501    HG   SER  62           HG       SER  62   2.529  -3.661  16.283
  502    H    THR  63           H        THR  63  -0.765  -2.468  15.309
  503    HA   THR  63           HA       THR  63  -3.103  -4.101  15.414
  504    HB   THR  63           HB       THR  63  -2.565  -2.383  17.121
  505    HG1  THR  63           HG1      THR  63  -4.625  -2.388  17.493
  506   HG21  THR  63          3HG2      THR  63  -3.336  -0.312  15.035
  507   HG22  THR  63          1HG2      THR  63  -1.709  -0.566  15.672
  508   HG23  THR  63          2HG2      THR  63  -2.996  -0.003  16.738
  509    H    HIS  64           H        HIS  64  -1.827  -1.970  13.010
  510    HA   HIS  64           HA       HIS  64  -4.351  -1.927  11.466
  511    HB2  HIS  64           2HB      HIS  64  -1.933  -0.103  11.401
  512    HB3  HIS  64           1HB      HIS  64  -3.061  -0.178  10.050
  513    HD1  HIS  64           HD1      HIS  64  -4.360  -0.316  13.598
  514    HD2  HIS  64           HD2      HIS  64  -3.994   2.403  10.478
  515    HE1  HIS  64           HE1      HIS  64  -5.712   1.686  14.288
  516    HE2  HIS  64           HE2      HIS  64  -5.341   3.379  12.450
  517    H    ILE  65           H        ILE  65  -1.797  -3.977  11.722
  518    HA   ILE  65           HA       ILE  65  -1.552  -4.430   8.824
  519    HB   ILE  65           HB       ILE  65  -0.307  -6.162  10.997
  520   HG12  ILE  65          2HG1      ILE  65   0.560  -3.850  11.215
  521   HG13  ILE  65          1HG1      ILE  65   1.805  -4.938  10.611
  522   HG21  ILE  65          1HG2      ILE  65  -0.535  -7.226   8.778
  523   HG22  ILE  65          2HG2      ILE  65   1.159  -6.919   9.145
  524   HG23  ILE  65          3HG2      ILE  65   0.300  -5.869   8.015
  525   HD11  ILE  65          3HD1      ILE  65   0.165  -3.062   8.926
  526   HD12  ILE  65          1HD1      ILE  65   1.483  -4.097   8.369
  527   HD13  ILE  65          2HD1      ILE  65   1.813  -2.778   9.496
  528    H    THR  66           H        THR  66  -3.639  -4.965   8.386
  529    HA   THR  66           HA       THR  66  -4.076  -7.786   8.453
  530    HB   THR  66           HB       THR  66  -5.333  -7.444  10.436
  531    HG1  THR  66           HG1      THR  66  -6.935  -8.490   9.578
  532   HG21  THR  66          3HG2      THR  66  -6.955  -5.648  10.817
  533   HG22  THR  66          1HG2      THR  66  -6.612  -4.993   9.213
  534   HG23  THR  66          2HG2      THR  66  -5.356  -4.981  10.452
  535    H    GLY  67           H        GLY  67  -6.034  -8.295   6.999
  536    HA2  GLY  67           2HA      GLY  67  -5.567  -7.362   4.430
  537    HA3  GLY  67           1HA      GLY  67  -7.004  -8.221   4.945
  538    H    LYS  68           H        LYS  68  -8.030  -6.281   6.752
  539    HA   LYS  68           HA       LYS  68  -9.695  -4.895   4.960
  540    HB2  LYS  68           2HB      LYS  68 -10.740  -3.918   6.949
  541    HB3  LYS  68           1HB      LYS  68 -10.469  -5.646   7.127
  542    HG2  LYS  68           2HG      LYS  68  -8.475  -5.196   8.510
  543    HG3  LYS  68           1HG      LYS  68  -8.760  -3.461   8.361
  544    HD2  LYS  68           2HD      LYS  68 -10.653  -5.466   9.646
  545    HD3  LYS  68           1HD      LYS  68  -9.578  -4.376  10.520
  546    HE2  LYS  68           2HE      LYS  68 -10.802  -2.438   9.540
  547    HE3  LYS  68           1HE      LYS  68 -11.907  -3.559   8.747
  548    HZ1  LYS  68           3HZ      LYS  68 -11.522  -3.290  11.681
  549    HZ2  LYS  68           1HZ      LYS  68 -12.594  -4.356  10.922
  550    HZ3  LYS  68           2HZ      LYS  68 -12.826  -2.687  10.794
  551    H    TYR  69           H        TYR  69  -6.740  -3.754   6.505
  552    HA   TYR  69           HA       TYR  69  -7.261  -0.950   5.797
  553    HB2  TYR  69           2HB      TYR  69  -4.886  -2.314   7.125
  554    HB3  TYR  69           1HB      TYR  69  -4.902  -0.601   6.710
  555    HD1  TYR  69           HD2      TYR  69  -6.493   0.967   7.903
  556    HD2  TYR  69           HD1      TYR  69  -6.104  -3.116   9.088
  557    HE1  TYR  69           HE2      TYR  69  -7.548   1.493  10.049
  558    HE2  TYR  69           HE1      TYR  69  -7.173  -2.591  11.238
  559    HH   TYR  69           HH       TYR  69  -8.751   0.393  11.823
  560    H    PHE  70           H        PHE  70  -5.399  -3.694   4.694
  561    HA   PHE  70           HA       PHE  70  -3.944  -2.145   2.680
  562    HB2  PHE  70           2HB      PHE  70  -3.675  -5.000   3.676
  563    HB3  PHE  70           1HB      PHE  70  -2.784  -4.415   2.279
  564    HD1  PHE  70           HD2      PHE  70  -3.164  -4.055   5.964
  565    HD2  PHE  70           HD1      PHE  70  -0.838  -2.976   2.538
  566    HE1  PHE  70           HE2      PHE  70  -1.383  -3.214   7.426
  567    HE2  PHE  70           HE1      PHE  70   0.937  -2.127   4.017
  568    HZ   PHE  70           HZ       PHE  70   0.670  -2.248   6.462
  569    H    LYS  71           H        LYS  71  -6.962  -3.291   2.684
  570    HA   LYS  71           HA       LYS  71  -7.336  -5.282   0.828
  571    HB2  LYS  71           2HB      LYS  71  -9.084  -2.886   1.402
  572    HB3  LYS  71           1HB      LYS  71  -9.575  -4.096   0.218
  573    HG2  LYS  71           2HG      LYS  71  -9.495  -5.829   1.973
  574    HG3  LYS  71           1HG      LYS  71  -9.058  -4.594   3.156
  575    HD2  LYS  71           2HD      LYS  71 -11.652  -4.753   1.577
  576    HD3  LYS  71           1HD      LYS  71 -11.444  -5.062   3.300
  577    HE2  LYS  71           2HE      LYS  71 -10.777  -2.691   3.624
  578    HE3  LYS  71           1HE      LYS  71 -11.058  -2.388   1.910
  579    HZ1  LYS  71           3HZ      LYS  71 -13.105  -3.315   3.835
  580    HZ2  LYS  71           1HZ      LYS  71 -13.360  -2.928   2.214
  581    HZ3  LYS  71           2HZ      LYS  71 -12.913  -1.724   3.308
  582    H    ASP  72           H        ASP  72  -6.767  -1.903   0.113
  583    HA   ASP  72           HA       ASP  72  -6.606  -2.387  -2.780
  584    HB2  ASP  72           2HB      ASP  72  -9.090  -1.865  -1.896
  585    HB3  ASP  72           1HB      ASP  72  -8.502  -0.221  -1.747
  586    H    LEU  73           H        LEU  73  -6.059  -0.162  -3.851
  587    HA   LEU  73           HA       LEU  73  -4.057   1.242  -2.369
  588    HB2  LEU  73           2HB      LEU  73  -3.816   1.122  -4.761
  589    HB3  LEU  73           1HB      LEU  73  -5.370   1.893  -5.012
  590    HG   LEU  73           HG       LEU  73  -4.529   4.042  -4.236
  591   HD11  LEU  73          1HD1      LEU  73  -1.931   2.629  -3.530
  592   HD12  LEU  73          2HD1      LEU  73  -3.067   3.355  -2.396
  593   HD13  LEU  73          3HD1      LEU  73  -2.170   4.372  -3.516
  594   HD21  LEU  73          3HD2      LEU  73  -2.556   2.750  -6.157
  595   HD22  LEU  73          1HD2      LEU  73  -2.768   4.490  -5.922
  596   HD23  LEU  73          2HD2      LEU  73  -4.084   3.526  -6.583
  597    H    ASN  74           H        ASN  74  -7.466   1.987  -3.256
  598    HA   ASN  74           HA       ASN  74  -7.393   4.583  -2.033
  599    HB2  ASN  74           2HB      ASN  74  -9.774   4.681  -2.272
  600    HB3  ASN  74           1HB      ASN  74  -9.112   3.963  -3.722
  601   HD21  ASN  74          1HD2      ASN  74  -9.622   1.833  -4.226
  602   HD22  ASN  74          2HD2      ASN  74 -10.873   0.968  -3.404
  603    H    ALA  75           H        ALA  75  -7.967   1.361  -0.817
  604    HA   ALA  75           HA       ALA  75  -8.825   2.050   1.805
  605    HB1  ALA  75           3HB      ALA  75  -9.073  -0.212   0.876
  606    HB2  ALA  75           1HB      ALA  75  -8.194  -0.246   2.409
  607    HB3  ALA  75           2HB      ALA  75  -7.320  -0.412   0.885
  608    H    ILE  76           H        ILE  76  -5.551   1.327   0.530
  609    HA   ILE  76           HA       ILE  76  -4.108   1.867   2.940
  610    HB   ILE  76           HB       ILE  76  -3.225   1.612   0.040
  611   HG12  ILE  76          2HG1      ILE  76  -2.856  -0.137   2.496
  612   HG13  ILE  76          1HG1      ILE  76  -3.975  -0.457   1.176
  613   HG21  ILE  76          1HG2      ILE  76  -0.856   1.647   0.737
  614   HG22  ILE  76          2HG2      ILE  76  -1.331   2.005   2.399
  615   HG23  ILE  76          3HG2      ILE  76  -1.624   3.188   1.123
  616   HD11  ILE  76          3HD1      ILE  76  -2.053  -1.884   1.042
  617   HD12  ILE  76          1HD1      ILE  76  -0.968  -0.494   1.040
  618   HD13  ILE  76          2HD1      ILE  76  -2.060  -0.767  -0.324
  619    H    SER  77           H        SER  77  -5.151   3.969   0.304
  620    HA   SER  77           HA       SER  77  -3.460   6.163   1.008
  621    HB2  SER  77           2HB      SER  77  -4.931   7.524  -0.448
  622    HB3  SER  77           1HB      SER  77  -4.458   6.026  -1.234
  623    HG   SER  77           HG       SER  77  -6.869   6.073   0.194
  624    H    ARG  78           H        ARG  78  -6.691   5.111   1.965
  625    HA   ARG  78           HA       ARG  78  -7.173   7.435   3.640
  626    HB2  ARG  78           2HB      ARG  78  -8.743   4.839   3.444
  627    HB3  ARG  78           1HB      ARG  78  -9.258   6.284   4.311
  628    HG2  ARG  78           2HG      ARG  78  -8.900   5.979   1.323
  629    HG3  ARG  78           1HG      ARG  78 -10.416   6.185   2.191
  630    HD2  ARG  78           2HD      ARG  78  -9.787   8.477   2.795
  631    HD3  ARG  78           1HD      ARG  78  -8.204   8.269   2.040
  632    HE   ARG  78           HE       ARG  78 -10.688   8.042   0.471
  633   HH11  ARG  78          1HH1      ARG  78  -7.597   9.637   0.965
  634   HH12  ARG  78          2HH1      ARG  78  -7.684  10.518  -0.531
  635   HH21  ARG  78          1HH2      ARG  78 -10.769   9.179  -1.452
  636   HH22  ARG  78          2HH2      ARG  78  -9.482  10.251  -1.895
  637    H    THR  79           H        THR  79  -5.701   4.313   4.020
  638    HA   THR  79           HA       THR  79  -5.785   4.334   6.924
  639    HB   THR  79           HB       THR  79  -4.263   2.542   4.981
  640    HG1  THR  79           HG1      THR  79  -6.187   1.673   4.898
  641   HG21  THR  79          3HG2      THR  79  -3.835   1.047   6.926
  642   HG22  THR  79          1HG2      THR  79  -4.529   2.255   8.009
  643   HG23  THR  79          2HG2      THR  79  -3.031   2.604   7.141
  644    H    VAL  80           H        VAL  80  -3.546   5.329   4.406
  645    HA   VAL  80           HA       VAL  80  -1.302   5.593   6.207
  646    HB   VAL  80           HB       VAL  80  -1.006   5.012   3.766
  647   HG11  VAL  80          1HG1      VAL  80  -1.004   6.770   2.053
  648   HG12  VAL  80          2HG1      VAL  80  -1.637   7.935   3.221
  649   HG13  VAL  80          3HG1      VAL  80  -2.615   6.547   2.736
  650   HG21  VAL  80          3HG2      VAL  80   0.861   5.816   5.121
  651   HG22  VAL  80          1HG2      VAL  80   0.478   7.486   4.702
  652   HG23  VAL  80          2HG2      VAL  80   1.022   6.360   3.452
  653    H    GLU  81           H        GLU  81  -3.775   7.714   4.794
  654    HA   GLU  81           HA       GLU  81  -2.653  10.150   5.890
  655    HB2  GLU  81           2HB      GLU  81  -4.601  11.277   5.034
  656    HB3  GLU  81           1HB      GLU  81  -4.117  10.091   3.825
  657    HG2  GLU  81           2HG      GLU  81  -5.890   8.551   4.680
  658    HG3  GLU  81           1HG      GLU  81  -6.406   9.811   5.794
  659    H    GLN  82           H        GLN  82  -4.961   7.685   6.939
  660    HA   GLN  82           HA       GLN  82  -6.113   9.193   9.062
  661    HB2  GLN  82           2HB      GLN  82  -7.293   7.306   9.710
  662    HB3  GLN  82           1HB      GLN  82  -6.978   6.912   8.031
  663    HG2  GLN  82           2HG      GLN  82  -5.048   5.502   8.803
  664    HG3  GLN  82           1HG      GLN  82  -5.527   5.823  10.461
  665   HE21  GLN  82          1HE2      GLN  82  -7.686   5.175   7.725
  666   HE22  GLN  82          2HE2      GLN  82  -8.285   3.676   8.330
  667    H    LEU  83           H        LEU  83  -3.288   7.103   8.776
  668    HA   LEU  83           HA       LEU  83  -2.570   7.031  11.528
  669    HB2  LEU  83           2HB      LEU  83  -0.959   6.648   8.993
  670    HB3  LEU  83           1HB      LEU  83  -0.250   6.464  10.594
  671    HG   LEU  83           HG       LEU  83  -2.553   4.802   9.504
  672   HD11  LEU  83          1HD1      LEU  83  -0.443   4.291   8.386
  673   HD12  LEU  83          2HD1      LEU  83  -0.939   2.970   9.440
  674   HD13  LEU  83          3HD1      LEU  83   0.347   4.065   9.949
  675   HD21  LEU  83          3HD2      LEU  83  -2.157   3.417  11.555
  676   HD22  LEU  83          1HD2      LEU  83  -2.789   5.024  11.903
  677   HD23  LEU  83          2HD2      LEU  83  -1.078   4.673  12.158
  678    H    LYS  84           H        LYS  84  -1.743   9.215   8.889
  679    HA   LYS  84           HA       LYS  84   0.025  10.919  10.319
  680    HB2  LYS  84           2HB      LYS  84  -1.827  11.700   8.027
  681    HB3  LYS  84           1HB      LYS  84  -0.385  12.570   8.555
  682    HG2  LYS  84           2HG      LYS  84   1.034  10.719   7.863
  683    HG3  LYS  84           1HG      LYS  84  -0.387   9.765   7.444
  684    HD2  LYS  84           2HD      LYS  84  -0.968  11.611   5.757
  685    HD3  LYS  84           1HD      LYS  84   0.649  12.257   6.056
  686    HE2  LYS  84           2HE      LYS  84   1.625  10.090   5.337
  687    HE3  LYS  84           1HE      LYS  84  -0.005   9.484   5.029
  688    HZ1  LYS  84           3HZ      LYS  84  -0.284  11.126   3.311
  689    HZ2  LYS  84           1HZ      LYS  84   1.132  10.253   3.003
  690    HZ3  LYS  84           2HZ      LYS  84   1.219  11.813   3.644
  691    H    ALA  85           H        ALA  85  -3.469  10.825   9.934
  692    HA   ALA  85           HA       ALA  85  -4.043  13.274  11.363
  693    HB1  ALA  85           3HB      ALA  85  -5.527  12.400   9.596
  694    HB2  ALA  85           1HB      ALA  85  -6.392  12.605  11.122
  695    HB3  ALA  85           2HB      ALA  85  -5.898  10.993  10.594
  696    H    GLU  86           H        GLU  86  -3.919   9.860  12.328
  697    HA   GLU  86           HA       GLU  86  -5.218  10.197  14.885
  698    HB2  GLU  86           2HB      GLU  86  -3.641   7.839  13.745
  699    HB3  GLU  86           1HB      GLU  86  -4.428   7.817  15.318
  700    HG2  GLU  86           2HG      GLU  86  -6.626   8.026  14.275
  701    HG3  GLU  86           1HG      GLU  86  -5.884   8.174  12.682
  702    H    SER  87           H        SER  87  -1.970  10.057  13.602
  703    HA   SER  87           HA       SER  87  -0.702  10.348  16.218
  704    HB2  SER  87           2HB      SER  87   0.387   8.960  14.470
  705    HB3  SER  87           1HB      SER  87   0.503  10.368  13.416
  706    HG   SER  87           HG       SER  87   2.451  10.202  14.428
  707    H    ALA  88           H        ALA  88  -2.039  12.446  13.799
  708    HA   ALA  88           HA       ALA  88  -0.312  14.674  13.954
  709    HB1  ALA  88           3HB      ALA  88  -2.173  16.041  13.086
  710    HB2  ALA  88           1HB      ALA  88  -3.307  14.727  13.424
  711    HB3  ALA  88           2HB      ALA  88  -2.036  14.511  12.222
  712    H    LEU  89           H        LEU  89   0.238  15.689  15.729
  713    HA   LEU  89           HA       LEU  89  -1.357  16.219  18.017
  714    HB2  LEU  89           2HB      LEU  89   0.413  17.639  18.745
  715    HB3  LEU  89           1HB      LEU  89   1.141  16.243  17.983
  716    HG   LEU  89           HG       LEU  89   0.951  19.030  16.744
  717   HD11  LEU  89          1HD1      LEU  89   2.484  18.956  18.649
  718   HD12  LEU  89          2HD1      LEU  89   3.380  19.139  17.143
  719   HD13  LEU  89          3HD1      LEU  89   3.321  17.568  17.948
  720   HD21  LEU  89          3HD2      LEU  89   2.437  16.587  15.704
  721   HD22  LEU  89          1HD2      LEU  89   2.491  18.208  15.006
  722   HD23  LEU  89          2HD2      LEU  89   0.987  17.291  14.989
  723    H    GLU  90           H        GLU  90  -1.388  17.494  14.892
  724    HA   GLU  90           HA       GLU  90  -2.109  20.186  15.183
  725    HB2  GLU  90           2HB      GLU  90  -2.849  18.234  12.946
  726    HB3  GLU  90           1HB      GLU  90  -2.844  19.991  12.817
  727    HG2  GLU  90           2HG      GLU  90  -0.445  20.084  13.032
  728    HG3  GLU  90           1HG      GLU  90  -0.361  18.371  13.445
  729   H281  4EM 101          2H28      PYA 142   0.474 -12.219   9.006
  730   H283  4EM 101          3H28      PYA 142   1.416 -11.190   7.938
  731   H303  4EM 101          3H30      PYA 142   0.596  -8.958  10.749
  732   H301  4EM 101          1H30      PYA 142  -0.474 -10.195  10.058
  733   H302  4EM 101          2H30      PYA 142   0.509  -9.173   9.005
  734   H312  4EM 101          2H31      PYA 142   2.941  -9.431   8.908
  735   H313  4EM 101          3H31      PYA 142   3.067  -9.236  10.653
  736   H311  4EM 101          1H31      PYA 142   3.777 -10.655   9.873
  737    H32  4EM 101           H32      PYA 142   1.681 -10.549  12.166
  738    H33  4EM 101           H33      PYA 142   0.104 -12.209  12.514
  739    H36  4EM 101           H36      PYA 142   1.167 -13.715  11.060
  740   H373  4EM 101          3H37      PYA 142   3.815 -14.785  11.505
  741   H372  4EM 101          2H37      PYA 142   2.582 -15.256  12.671
  742   H382  4EM 101          2H38      PYA 142   2.755 -16.951  10.899
  743   H383  4EM 101          3H38      PYA 142   2.490 -15.716   9.675
  744    H41  4EM 101           H41      PYA 142   0.455 -14.996   9.252
  745   H423  4EM 101          3H42      PYA 142  -1.900 -14.906  10.462
  746   H422  4EM 101          2H42      PYA 142  -1.819 -16.629  10.106
  747   H433  4EM 101          3H43      PYA 142  -3.102 -15.508   8.372
  748   H432  4EM 101          2H43      PYA 142  -1.591 -16.108   7.699
  749    H44  4EM 101           H44      PYA 142  -1.151 -14.154   7.088
  750    H49  4EM 101           H49      PYA 142  -2.653 -10.358   9.039
  751    H51  4EM 101           H51      PYA 142  -1.527  -8.763   7.289
  752    H50  4EM 101           H50      PYA 142  -0.321 -10.235   5.515
  753    H48  4EM 101           H48      PYA 142  -0.619 -12.675   6.258
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1   3.917  17.424   2.209
    2    H2   MET   1           2H       MET   1   2.309  17.904   2.030
    3    H3   MET   1           3H       MET   1   3.425  18.222   0.804
    4    HA   MET   1           HA       MET   1   3.702  15.869   0.395
    5    HB2  MET   1           2HB      MET   1   3.227  15.072   2.681
    6    HB3  MET   1           1HB      MET   1   1.560  15.610   2.558
    7    HG2  MET   1           2HG      MET   1   1.237  13.943   0.709
    8    HG3  MET   1           1HG      MET   1   2.859  13.341   1.032
    9    HE1  MET   1           3HE      MET   1   0.145  10.684   2.423
   10    HE2  MET   1           1HE      MET   1   1.301  10.987   1.127
   11    HE3  MET   1           2HE      MET   1  -0.230  11.866   1.167
   12    H    ASP   2           H        ASP   2   2.658  15.254  -1.447
   13    HA   ASP   2           HA       ASP   2   0.176  16.563  -2.279
   14    HB2  ASP   2           2HB      ASP   2   0.589  15.420  -4.437
   15    HB3  ASP   2           1HB      ASP   2   2.001  16.325  -3.910
   16    H    GLY   3           H        GLY   3  -1.101  14.578  -3.745
   17    HA2  GLY   3           2HA      GLY   3  -1.856  12.545  -1.706
   18    HA3  GLY   3           1HA      GLY   3  -3.047  13.436  -2.647
   19    H    GLU   4           H        GLU   4  -1.799  13.318  -5.168
   20    HA   GLU   4           HA       GLU   4  -2.589  10.595  -5.856
   21    HB2  GLU   4           2HB      GLU   4  -2.225  13.109  -7.471
   22    HB3  GLU   4           1HB      GLU   4  -2.581  11.555  -8.218
   23    HG2  GLU   4           2HG      GLU   4  -4.347  12.513  -5.980
   24    HG3  GLU   4           1HG      GLU   4  -4.525  13.246  -7.570
   25    H    GLU   5           H        GLU   5   0.344  12.598  -6.138
   26    HA   GLU   5           HA       GLU   5   1.723  10.870  -7.969
   27    HB2  GLU   5           2HB      GLU   5   2.921  12.923  -6.062
   28    HB3  GLU   5           1HB      GLU   5   3.751  12.183  -7.431
   29    HG2  GLU   5           2HG      GLU   5   2.246  13.269  -8.991
   30    HG3  GLU   5           1HG      GLU   5   1.284  13.924  -7.664
   31    H    VAL   6           H        VAL   6   1.584  11.096  -4.436
   32    HA   VAL   6           HA       VAL   6   3.596   9.188  -3.843
   33    HB   VAL   6           HB       VAL   6   2.402   8.857  -1.616
   34   HG11  VAL   6          1HG1      VAL   6   2.989  11.736  -2.366
   35   HG12  VAL   6          2HG1      VAL   6   4.174  10.535  -1.849
   36   HG13  VAL   6          3HG1      VAL   6   2.930  11.081  -0.723
   37   HG21  VAL   6          3HG2      VAL   6   0.558  10.356  -1.005
   38   HG22  VAL   6          1HG2      VAL   6   0.094   9.301  -2.339
   39   HG23  VAL   6          2HG2      VAL   6   0.507  10.988  -2.655
   40    H    LYS   7           H        LYS   7   0.173   8.879  -4.617
   41    HA   LYS   7           HA       LYS   7  -0.083   6.132  -3.892
   42    HB2  LYS   7           2HB      LYS   7  -1.789   7.877  -5.689
   43    HB3  LYS   7           1HB      LYS   7  -2.241   6.249  -5.188
   44    HG2  LYS   7           2HG      LYS   7  -2.268   7.003  -2.816
   45    HG3  LYS   7           1HG      LYS   7  -1.818   8.622  -3.347
   46    HD2  LYS   7           2HD      LYS   7  -4.473   7.237  -3.525
   47    HD3  LYS   7           1HD      LYS   7  -4.099   8.917  -3.147
   48    HE2  LYS   7           2HE      LYS   7  -5.152   9.119  -5.187
   49    HE3  LYS   7           1HE      LYS   7  -3.461   9.088  -5.671
   50    HZ1  LYS   7           3HZ      LYS   7  -4.807   7.703  -7.095
   51    HZ2  LYS   7           1HZ      LYS   7  -5.353   6.799  -5.778
   52    HZ3  LYS   7           2HZ      LYS   7  -3.727   6.728  -6.233
   53    H    GLU   8           H        GLU   8   0.177   7.701  -7.132
   54    HA   GLU   8           HA       GLU   8   0.233   5.323  -8.638
   55    HB2  GLU   8           2HB      GLU   8   1.266   6.655 -10.457
   56    HB3  GLU   8           1HB      GLU   8  -0.106   7.484  -9.730
   57    HG2  GLU   8           2HG      GLU   8   1.304   9.007  -8.560
   58    HG3  GLU   8           1HG      GLU   8   2.747   8.065  -8.919
   59    H    LYS   9           H        LYS   9   2.770   6.924  -6.833
   60    HA   LYS   9           HA       LYS   9   4.980   5.483  -7.816
   61    HB2  LYS   9           2HB      LYS   9   5.308   7.584  -6.742
   62    HB3  LYS   9           1HB      LYS   9   4.392   7.075  -5.328
   63    HG2  LYS   9           2HG      LYS   9   6.132   5.634  -4.600
   64    HG3  LYS   9           1HG      LYS   9   7.034   5.852  -6.102
   65    HD2  LYS   9           2HD      LYS   9   7.965   7.197  -4.199
   66    HD3  LYS   9           1HD      LYS   9   7.470   8.183  -5.579
   67    HE2  LYS   9           2HE      LYS   9   5.284   8.608  -4.350
   68    HE3  LYS   9           1HE      LYS   9   6.010   7.823  -2.947
   69    HZ1  LYS   9           3HZ      LYS   9   7.022  10.255  -4.311
   70    HZ2  LYS   9           1HZ      LYS   9   7.766   9.499  -2.994
   71    HZ3  LYS   9           2HZ      LYS   9   6.237  10.201  -2.819
   72    H    ILE  10           H        ILE  10   2.771   5.016  -5.059
   73    HA   ILE  10           HA       ILE  10   3.936   2.689  -3.983
   74    HB   ILE  10           HB       ILE  10   0.944   3.288  -4.086
   75   HG12  ILE  10          2HG1      ILE  10   2.053   5.195  -3.061
   76   HG13  ILE  10          1HG1      ILE  10   1.189   4.297  -1.828
   77   HG21  ILE  10          1HG2      ILE  10   1.364   0.979  -3.438
   78   HG22  ILE  10          2HG2      ILE  10   0.787   1.886  -2.039
   79   HG23  ILE  10          3HG2      ILE  10   2.503   1.496  -2.192
   80   HD11  ILE  10          3HD1      ILE  10   3.320   5.047  -0.990
   81   HD12  ILE  10          1HD1      ILE  10   4.161   4.258  -2.321
   82   HD13  ILE  10          2HD1      ILE  10   3.323   3.288  -1.105
   83    H    ARG  11           H        ARG  11   1.607   3.233  -6.560
   84    HA   ARG  11           HA       ARG  11   0.863   0.598  -7.164
   85    HB2  ARG  11           2HB      ARG  11   0.856   3.137  -8.815
   86    HB3  ARG  11           1HB      ARG  11   0.237   1.620  -9.440
   87    HG2  ARG  11           2HG      ARG  11  -0.824   3.007  -6.959
   88    HG3  ARG  11           1HG      ARG  11  -1.534   3.139  -8.565
   89    HD2  ARG  11           2HD      ARG  11  -2.825   1.543  -7.415
   90    HD3  ARG  11           1HD      ARG  11  -1.799   0.593  -8.487
   91    HE   ARG  11           HE       ARG  11  -0.486   0.810  -6.033
   92   HH11  ARG  11          1HH1      ARG  11  -3.487  -0.629  -7.187
   93   HH12  ARG  11          2HH1      ARG  11  -3.483  -1.869  -5.980
   94   HH21  ARG  11          1HH2      ARG  11  -0.506  -0.791  -4.483
   95   HH22  ARG  11          2HH2      ARG  11  -1.786  -1.947  -4.450
   96    H    ARG  12           H        ARG  12   3.415   2.615  -8.627
   97    HA   ARG  12           HA       ARG  12   4.361   0.678 -10.479
   98    HB2  ARG  12           2HB      ARG  12   5.446   3.250  -9.354
   99    HB3  ARG  12           1HB      ARG  12   6.595   2.168 -10.120
  100    HG2  ARG  12           2HG      ARG  12   5.781   3.881 -11.687
  101    HG3  ARG  12           1HG      ARG  12   5.366   2.251 -12.216
  102    HD2  ARG  12           2HD      ARG  12   3.074   2.540 -11.590
  103    HD3  ARG  12           1HD      ARG  12   3.421   4.043 -10.740
  104    HE   ARG  12           HE       ARG  12   3.360   3.651 -13.655
  105   HH11  ARG  12          1HH1      ARG  12   3.450   5.857 -10.921
  106   HH12  ARG  12          2HH1      ARG  12   3.138   7.260 -11.894
  107   HH21  ARG  12          1HH2      ARG  12   2.984   5.480 -14.909
  108   HH22  ARG  12          2HH2      ARG  12   2.871   7.040 -14.156
  109    H    TYR  13           H        TYR  13   5.311   1.502  -7.182
  110    HA   TYR  13           HA       TYR  13   7.476  -0.248  -6.835
  111    HB2  TYR  13           2HB      TYR  13   7.001   1.544  -5.245
  112    HB3  TYR  13           1HB      TYR  13   5.465   0.811  -4.814
  113    HD1  TYR  13           HD1      TYR  13   9.134  -0.051  -4.853
  114    HD2  TYR  13           HD2      TYR  13   5.399  -0.464  -2.816
  115    HE1  TYR  13           HE1      TYR  13  10.256  -1.250  -3.030
  116    HE2  TYR  13           HE2      TYR  13   6.528  -1.664  -0.995
  117    HH   TYR  13           HH       TYR  13   9.871  -1.711  -0.622
  118    H    ILE  14           H        ILE  14   4.011  -0.820  -6.504
  119    HA   ILE  14           HA       ILE  14   4.131  -3.438  -5.431
  120    HB   ILE  14           HB       ILE  14   1.944  -2.040  -7.025
  121   HG12  ILE  14          2HG1      ILE  14   2.401  -1.053  -4.798
  122   HG13  ILE  14          1HG1      ILE  14   0.811  -1.800  -4.841
  123   HG21  ILE  14          1HG2      ILE  14   0.389  -3.818  -6.235
  124   HG22  ILE  14          2HG2      ILE  14   1.772  -4.721  -5.607
  125   HG23  ILE  14          3HG2      ILE  14   1.615  -4.430  -7.341
  126   HD11  ILE  14          3HD1      ILE  14   3.296  -2.961  -3.584
  127   HD12  ILE  14          1HD1      ILE  14   1.718  -3.752  -3.642
  128   HD13  ILE  14          2HD1      ILE  14   1.922  -2.250  -2.743
  129    H    MET  15           H        MET  15   3.738  -2.292  -8.814
  130    HA   MET  15           HA       MET  15   3.668  -4.826 -10.068
  131    HB2  MET  15           2HB      MET  15   4.752  -2.172 -11.146
  132    HB3  MET  15           1HB      MET  15   4.402  -3.576 -12.142
  133    HG2  MET  15           2HG      MET  15   2.156  -2.528 -10.496
  134    HG3  MET  15           1HG      MET  15   2.701  -1.523 -11.830
  135    HE1  MET  15           3HE      MET  15   0.794  -5.716 -12.325
  136    HE2  MET  15           1HE      MET  15   0.997  -4.889 -10.781
  137    HE3  MET  15           2HE      MET  15   2.402  -5.581 -11.605
  138    H    GLU  16           H        GLU  16   6.449  -2.652  -9.523
  139    HA   GLU  16           HA       GLU  16   8.269  -4.220 -11.058
  140    HB2  GLU  16           2HB      GLU  16   8.829  -1.901  -9.148
  141    HB3  GLU  16           1HB      GLU  16   9.968  -2.562 -10.320
  142    HG2  GLU  16           2HG      GLU  16   8.549  -1.879 -12.160
  143    HG3  GLU  16           1HG      GLU  16   7.314  -1.301 -11.046
  144    H    ASP  17           H        ASP  17   7.920  -3.648  -7.548
  145    HA   ASP  17           HA       ASP  17  10.128  -5.487  -6.957
  146    HB2  ASP  17           2HB      ASP  17   8.454  -3.735  -5.115
  147    HB3  ASP  17           1HB      ASP  17   9.826  -4.715  -4.605
  148    H    LEU  18           H        LEU  18   6.653  -5.140  -6.113
  149    HA   LEU  18           HA       LEU  18   6.631  -7.543  -4.543
  150    HB2  LEU  18           2HB      LEU  18   4.406  -5.712  -5.459
  151    HB3  LEU  18           1HB      LEU  18   4.076  -7.173  -4.555
  152    HG   LEU  18           HG       LEU  18   4.062  -5.327  -3.009
  153   HD11  LEU  18          1HD1      LEU  18   6.646  -6.869  -2.634
  154   HD12  LEU  18          2HD1      LEU  18   5.031  -7.417  -2.176
  155   HD13  LEU  18          3HD1      LEU  18   5.738  -6.014  -1.384
  156   HD21  LEU  18          3HD2      LEU  18   6.868  -4.575  -3.908
  157   HD22  LEU  18          1HD2      LEU  18   5.960  -3.828  -2.589
  158   HD23  LEU  18          2HD2      LEU  18   5.396  -3.667  -4.249
  159    H    ILE  19           H        ILE  19   5.144  -6.801  -7.735
  160    HA   ILE  19           HA       ILE  19   4.450  -9.551  -8.245
  161    HB   ILE  19           HB       ILE  19   4.538  -7.131 -10.099
  162   HG12  ILE  19          2HG1      ILE  19   2.065  -7.491 -10.262
  163   HG13  ILE  19          1HG1      ILE  19   2.202  -8.821  -9.142
  164   HG21  ILE  19          1HG2      ILE  19   5.158  -9.066 -11.466
  165   HG22  ILE  19          2HG2      ILE  19   3.536  -8.512 -11.889
  166   HG23  ILE  19          3HG2      ILE  19   3.743  -9.952 -10.885
  167   HD11  ILE  19          3HD1      ILE  19   1.312  -6.835  -8.112
  168   HD12  ILE  19          1HD1      ILE  19   2.784  -5.955  -8.519
  169   HD13  ILE  19          2HD1      ILE  19   2.846  -7.305  -7.380
  170    H    GLY  20           H        GLY  20   7.201  -7.469  -8.976
  171    HA2  GLY  20           2HA      GLY  20   9.425  -8.201  -9.148
  172    HA3  GLY  20           1HA      GLY  20   8.862  -9.814  -9.549
  173    HA   PRO  21           HA       PRO  21  10.422  -7.966 -13.535
  174    HB2  PRO  21           2HB      PRO  21  11.376 -10.358 -14.550
  175    HB3  PRO  21           1HB      PRO  21  12.307  -9.319 -13.457
  176    HG2  PRO  21           2HG      PRO  21  10.748 -11.792 -12.816
  177    HG3  PRO  21           1HG      PRO  21  12.347 -11.276 -12.237
  178    HD2  PRO  21           2HD      PRO  21  10.103 -10.978 -10.736
  179    HD3  PRO  21           1HD      PRO  21  11.467  -9.841 -10.643
  180    H    SER  22           H        SER  22   8.045 -10.272 -12.719
  181    HA   SER  22           HA       SER  22   6.962 -10.640 -15.401
  182    HB2  SER  22           2HB      SER  22   5.188 -11.931 -14.118
  183    HB3  SER  22           1HB      SER  22   6.832 -12.524 -13.873
  184    HG   SER  22           HG       SER  22   6.154 -12.356 -11.849
  185    H    ALA  23           H        ALA  23   7.133  -7.918 -13.984
  186    HA   ALA  23           HA       ALA  23   4.654  -7.064 -13.012
  187    HB1  ALA  23           3HB      ALA  23   6.747  -5.901 -12.556
  188    HB2  ALA  23           1HB      ALA  23   5.528  -4.805 -13.216
  189    HB3  ALA  23           2HB      ALA  23   6.848  -5.385 -14.243
  190    H    LYS  24           H        LYS  24   2.980  -7.595 -14.350
  191    HA   LYS  24           HA       LYS  24   2.775  -6.435 -17.022
  192    HB2  LYS  24           2HB      LYS  24   0.913  -8.283 -15.483
  193    HB3  LYS  24           1HB      LYS  24   0.582  -7.661 -17.100
  194    HG2  LYS  24           2HG      LYS  24   2.684  -8.809 -17.884
  195    HG3  LYS  24           1HG      LYS  24   2.816  -9.544 -16.282
  196    HD2  LYS  24           2HD      LYS  24   0.518  -9.881 -18.240
  197    HD3  LYS  24           1HD      LYS  24   1.746 -11.088 -17.860
  198    HE2  LYS  24           2HE      LYS  24   0.886 -11.432 -15.675
  199    HE3  LYS  24           1HE      LYS  24  -0.091  -9.964 -15.728
  200    HZ1  LYS  24           3HZ      LYS  24  -1.453 -11.000 -17.451
  201    HZ2  LYS  24           1HZ      LYS  24  -1.454 -11.899 -16.021
  202    HZ3  LYS  24           2HZ      LYS  24  -0.537 -12.417 -17.339
  203    H    GLU  25           H        GLU  25   2.439  -4.383 -16.825
  204    HA   GLU  25           HA       GLU  25   1.176  -2.808 -14.941
  205    HB2  GLU  25           2HB      GLU  25   1.130  -1.109 -16.797
  206    HB3  GLU  25           1HB      GLU  25   2.671  -1.921 -16.602
  207    HG2  GLU  25           2HG      GLU  25   1.930  -3.510 -18.467
  208    HG3  GLU  25           1HG      GLU  25   0.617  -2.366 -18.763
  209    H    ASP  26           H        ASP  26  -0.374  -4.903 -17.187
  210    HA   ASP  26           HA       ASP  26  -2.730  -3.511 -17.793
  211    HB2  ASP  26           2HB      ASP  26  -2.594  -6.540 -17.482
  212    HB3  ASP  26           1HB      ASP  26  -3.667  -5.614 -18.525
  213    H    GLU  27           H        GLU  27  -1.714  -5.314 -15.013
  214    HA   GLU  27           HA       GLU  27  -4.329  -5.757 -13.839
  215    HB2  GLU  27           2HB      GLU  27  -1.595  -6.054 -12.529
  216    HB3  GLU  27           1HB      GLU  27  -3.100  -6.809 -12.018
  217    HG2  GLU  27           2HG      GLU  27  -1.468  -7.424 -14.490
  218    HG3  GLU  27           1HG      GLU  27  -1.739  -8.470 -13.096
  219    H    LEU  28           H        LEU  28  -2.229  -3.148 -13.956
  220    HA   LEU  28           HA       LEU  28  -2.337  -2.308 -11.222
  221    HB2  LEU  28           2HB      LEU  28  -0.375  -2.159 -12.833
  222    HB3  LEU  28           1HB      LEU  28  -1.191  -0.823 -13.609
  223    HG   LEU  28           HG       LEU  28   0.672  -0.262 -11.923
  224   HD11  LEU  28          1HD1      LEU  28  -0.421   1.735 -11.051
  225   HD12  LEU  28          2HD1      LEU  28  -2.009   1.061 -11.415
  226   HD13  LEU  28          3HD1      LEU  28  -0.900   1.469 -12.724
  227   HD21  LEU  28          3HD2      LEU  28   0.009  -1.919 -10.193
  228   HD22  LEU  28          1HD2      LEU  28  -1.459  -0.981  -9.874
  229   HD23  LEU  28          2HD2      LEU  28   0.126  -0.289  -9.547
  230    H    ASP  29           H        ASP  29  -4.025  -1.295 -10.377
  231    HA   ASP  29           HA       ASP  29  -4.573   1.382 -11.326
  232    HB2  ASP  29           2HB      ASP  29  -6.497  -0.043 -12.278
  233    HB3  ASP  29           1HB      ASP  29  -6.898  -0.428 -10.608
  234    H    ASP  30           H        ASP  30  -5.686   2.626  -9.584
  235    HA   ASP  30           HA       ASP  30  -4.314   2.177  -7.150
  236    HB2  ASP  30           2HB      ASP  30  -6.478   4.192  -7.854
  237    HB3  ASP  30           1HB      ASP  30  -5.635   4.181  -6.307
  238    H    GLN  31           H        GLN  31  -7.683   1.783  -8.092
  239    HA   GLN  31           HA       GLN  31  -8.387   0.762  -5.428
  240    HB2  GLN  31           2HB      GLN  31 -10.117   1.338  -7.865
  241    HB3  GLN  31           1HB      GLN  31 -10.737   0.769  -6.314
  242    HG2  GLN  31           2HG      GLN  31  -9.909   2.826  -5.225
  243    HG3  GLN  31           1HG      GLN  31  -9.257   3.379  -6.768
  244   HE21  GLN  31          1HE2      GLN  31 -12.189   2.840  -4.924
  245   HE22  GLN  31          2HE2      GLN  31 -13.223   3.767  -5.953
  246    H    THR  32           H        THR  32  -6.896  -0.641  -7.998
  247    HA   THR  32           HA       THR  32  -8.238  -3.103  -8.299
  248    HB   THR  32           HB       THR  32  -5.256  -2.551  -8.456
  249    HG1  THR  32           HG1      THR  32  -6.927  -3.189 -10.622
  250   HG21  THR  32          3HG2      THR  32  -5.591  -4.955  -7.952
  251   HG22  THR  32          1HG2      THR  32  -5.085  -4.755  -9.635
  252   HG23  THR  32          2HG2      THR  32  -6.782  -5.076  -9.249
  253    HA   PRO  33           HA       PRO  33  -7.772  -4.336  -3.968
  254    HB2  PRO  33           2HB      PRO  33  -9.264  -6.627  -4.085
  255    HB3  PRO  33           1HB      PRO  33  -9.985  -5.005  -4.107
  256    HG2  PRO  33           2HG      PRO  33  -9.462  -6.848  -6.399
  257    HG3  PRO  33           1HG      PRO  33 -10.891  -5.855  -6.056
  258    HD2  PRO  33           2HD      PRO  33  -8.962  -5.103  -7.829
  259    HD3  PRO  33           1HD      PRO  33  -9.934  -3.934  -6.906
  260    H    LEU  34           H        LEU  34  -5.768  -4.935  -3.501
  261    HA   LEU  34           HA       LEU  34  -4.156  -6.680  -5.038
  262    HB2  LEU  34           2HB      LEU  34  -3.707  -5.646  -2.224
  263    HB3  LEU  34           1HB      LEU  34  -2.481  -6.330  -3.282
  264    HG   LEU  34           HG       LEU  34  -3.960  -3.718  -3.776
  265   HD11  LEU  34          1HD1      LEU  34  -1.115  -4.196  -2.839
  266   HD12  LEU  34          2HD1      LEU  34  -2.439  -3.539  -1.870
  267   HD13  LEU  34          3HD1      LEU  34  -1.825  -2.631  -3.248
  268   HD21  LEU  34          3HD2      LEU  34  -1.667  -4.982  -5.324
  269   HD22  LEU  34          1HD2      LEU  34  -2.308  -3.355  -5.586
  270   HD23  LEU  34          2HD2      LEU  34  -3.322  -4.761  -5.899
  271    H    LEU  35           H        LEU  35  -5.457  -7.019  -1.709
  272    HA   LEU  35           HA       LEU  35  -4.570  -9.613  -1.128
  273    HB2  LEU  35           2HB      LEU  35  -7.052  -8.130  -0.212
  274    HB3  LEU  35           1HB      LEU  35  -6.589  -9.690   0.452
  275    HG   LEU  35           HG       LEU  35  -4.850  -7.195   0.633
  276   HD11  LEU  35          1HD1      LEU  35  -6.662  -8.426   2.723
  277   HD12  LEU  35          2HD1      LEU  35  -6.944  -6.903   1.878
  278   HD13  LEU  35          3HD1      LEU  35  -5.566  -7.060   2.961
  279   HD21  LEU  35          3HD2      LEU  35  -3.575  -9.315   0.776
  280   HD22  LEU  35          1HD2      LEU  35  -4.643  -9.868   2.068
  281   HD23  LEU  35          2HD2      LEU  35  -3.597  -8.468   2.322
  282    H    GLU  36           H        GLU  36  -7.580  -8.558  -2.622
  283    HA   GLU  36           HA       GLU  36  -8.881 -11.052  -2.801
  284    HB2  GLU  36           2HB      GLU  36 -10.024  -8.840  -2.909
  285    HB3  GLU  36           1HB      GLU  36  -9.278  -8.544  -4.475
  286    HG2  GLU  36           2HG      GLU  36 -10.492 -10.675  -5.262
  287    HG3  GLU  36           1HG      GLU  36 -11.409 -10.559  -3.759
  288    H    TRP  37           H        TRP  37  -6.567  -9.423  -4.908
  289    HA   TRP  37           HA       TRP  37  -7.019 -11.355  -7.103
  290    HB2  TRP  37           2HB      TRP  37  -5.337  -8.830  -6.910
  291    HB3  TRP  37           1HB      TRP  37  -5.214  -9.933  -8.275
  292    HD1  TRP  37           HD1      TRP  37  -8.670  -9.078  -6.775
  293    HE1  TRP  37           HE1      TRP  37 -10.004  -7.723  -8.502
  294    HE3  TRP  37           HE3      TRP  37  -4.999  -8.388 -10.285
  295    HZ2  TRP  37           HZ2      TRP  37  -9.576  -6.530 -11.017
  296    HZ3  TRP  37           HZ3      TRP  37  -5.550  -7.127 -12.329
  297    HH2  TRP  37           HH2      TRP  37  -7.795  -6.218 -12.686
  298    H    GLY  38           H        GLY  38  -5.307 -11.354  -4.280
  299    HA2  GLY  38           2HA      GLY  38  -3.708 -12.803  -3.476
  300    HA3  GLY  38           1HA      GLY  38  -3.653 -13.585  -5.048
  301    H    ILE  39           H        ILE  39  -3.161 -10.176  -4.855
  302    HA   ILE  39           HA       ILE  39  -0.469 -10.268  -5.863
  303    HB   ILE  39           HB       ILE  39  -2.181  -7.904  -4.946
  304   HG12  ILE  39          2HG1      ILE  39  -1.662  -8.968  -7.765
  305   HG13  ILE  39          1HG1      ILE  39  -3.176  -9.110  -6.883
  306   HG21  ILE  39          1HG2      ILE  39   0.199  -7.321  -4.853
  307   HG22  ILE  39          2HG2      ILE  39  -0.593  -6.457  -6.170
  308   HG23  ILE  39          3HG2      ILE  39   0.414  -7.861  -6.521
  309   HD11  ILE  39          3HD1      ILE  39  -1.919  -6.561  -7.895
  310   HD12  ILE  39          1HD1      ILE  39  -3.418  -6.658  -6.963
  311   HD13  ILE  39          2HD1      ILE  39  -3.323  -7.391  -8.563
  312    H    LEU  40           H        LEU  40  -2.099  -9.569  -2.826
  313    HA   LEU  40           HA       LEU  40   0.469  -9.567  -1.357
  314    HB2  LEU  40           2HB      LEU  40  -2.283  -8.799  -0.329
  315    HB3  LEU  40           1HB      LEU  40  -0.749  -8.607   0.518
  316    HG   LEU  40           HG       LEU  40  -1.645  -7.100  -1.952
  317   HD11  LEU  40          1HD1      LEU  40  -1.285  -6.170   0.902
  318   HD12  LEU  40          2HD1      LEU  40  -2.811  -6.372   0.027
  319   HD13  LEU  40          3HD1      LEU  40  -1.661  -5.139  -0.483
  320   HD21  LEU  40          3HD2      LEU  40   0.747  -7.458  -2.079
  321   HD22  LEU  40          1HD2      LEU  40   0.961  -6.853  -0.430
  322   HD23  LEU  40          2HD2      LEU  40   0.405  -5.770  -1.710
  323    H    ASN  41           H        ASN  41   0.810 -11.068   0.196
  324    HA   ASN  41           HA       ASN  41  -1.215 -13.127   0.791
  325    HB2  ASN  41           2HB      ASN  41   1.692 -13.679  -0.003
  326    HB3  ASN  41           1HB      ASN  41   0.602 -14.893   0.660
  327   HD21  ASN  41          1HD2      ASN  41  -1.048 -15.739  -0.659
  328   HD22  ASN  41          2HD2      ASN  41  -1.102 -15.460  -2.362
  329    H    SER  42           H        SER  42   2.204 -12.392   1.670
  330    HA   SER  42           HA       SER  42   1.506 -11.647   4.370
  331    HB2  SER  42           3HB      SER  42   1.323 -14.077   4.601
  332    HB3  SER  42           2HB      SER  42   2.916 -14.301   3.869
  333    H    MET  43           H        MET  43   4.421 -13.093   2.804
  334    HA   MET  43           HA       MET  43   6.122 -11.258   4.249
  335    HB2  MET  43           2HB      MET  43   6.791 -13.330   2.140
  336    HB3  MET  43           1HB      MET  43   7.981 -12.464   3.108
  337    HG2  MET  43           2HG      MET  43   5.845 -14.293   4.256
  338    HG3  MET  43           1HG      MET  43   7.501 -14.779   3.923
  339    HE1  MET  43           3HE      MET  43   5.070 -13.117   6.507
  340    HE2  MET  43           1HE      MET  43   5.751 -11.618   5.879
  341    HE3  MET  43           2HE      MET  43   6.146 -12.152   7.515
  342    H    ASN  44           H        ASN  44   4.682 -11.236   1.178
  343    HA   ASN  44           HA       ASN  44   6.264  -9.099   0.053
  344    HB2  ASN  44           2HB      ASN  44   4.407  -9.051  -1.665
  345    HB3  ASN  44           1HB      ASN  44   5.230 -10.595  -1.502
  346   HD21  ASN  44          1HD2      ASN  44   2.777 -10.417  -2.751
  347   HD22  ASN  44          2HD2      ASN  44   1.584 -11.226  -1.801
  348    H    ILE  45           H        ILE  45   3.467  -9.325   2.151
  349    HA   ILE  45           HA       ILE  45   2.450  -6.684   1.756
  350    HB   ILE  45           HB       ILE  45   1.569  -8.966   3.119
  351   HG12  ILE  45          2HG1      ILE  45   0.360  -6.183   3.386
  352   HG13  ILE  45          1HG1      ILE  45   0.143  -7.242   1.997
  353   HG21  ILE  45          1HG2      ILE  45   1.986  -6.869   5.275
  354   HG22  ILE  45          2HG2      ILE  45   2.858  -8.398   5.153
  355   HG23  ILE  45          3HG2      ILE  45   1.117  -8.396   5.449
  356   HD11  ILE  45          3HD1      ILE  45  -0.995  -8.875   3.441
  357   HD12  ILE  45          1HD1      ILE  45  -1.794  -7.300   3.446
  358   HD13  ILE  45          2HD1      ILE  45  -0.789  -7.784   4.816
  359    H    VAL  46           H        VAL  46   5.127  -7.924   3.497
  360    HA   VAL  46           HA       VAL  46   5.391  -6.040   5.601
  361    HB   VAL  46           HB       VAL  46   7.572  -7.744   4.319
  362   HG11  VAL  46          1HG1      VAL  46   7.405  -6.536   7.101
  363   HG12  VAL  46          2HG1      VAL  46   8.474  -5.998   5.802
  364   HG13  VAL  46          3HG1      VAL  46   8.691  -7.594   6.522
  365   HG21  VAL  46          3HG2      VAL  46   7.062  -9.433   6.056
  366   HG22  VAL  46          1HG2      VAL  46   5.672  -9.155   5.003
  367   HG23  VAL  46          2HG2      VAL  46   5.708  -8.448   6.621
  368    H    LYS  47           H        LYS  47   6.254  -5.971   2.251
  369    HA   LYS  47           HA       LYS  47   8.342  -4.049   2.247
  370    HB2  LYS  47           2HB      LYS  47   6.386  -4.925   0.094
  371    HB3  LYS  47           1HB      LYS  47   7.591  -3.680  -0.202
  372    HG2  LYS  47           2HG      LYS  47   8.368  -5.801  -1.060
  373    HG3  LYS  47           1HG      LYS  47   9.394  -5.282   0.279
  374    HD2  LYS  47           2HD      LYS  47   8.388  -6.891   1.773
  375    HD3  LYS  47           1HD      LYS  47   7.126  -7.278   0.600
  376    HE2  LYS  47           2HE      LYS  47   8.805  -9.051   0.661
  377    HE3  LYS  47           1HE      LYS  47   8.837  -8.243  -0.906
  378    HZ1  LYS  47           3HZ      LYS  47  10.746  -6.964  -0.119
  379    HZ2  LYS  47           1HZ      LYS  47  11.038  -8.626  -0.122
  380    HZ3  LYS  47           2HZ      LYS  47  10.729  -7.825   1.335
  381    H    LEU  48           H        LEU  48   4.851  -3.803   2.200
  382    HA   LEU  48           HA       LEU  48   4.601  -1.043   1.586
  383    HB2  LEU  48           2HB      LEU  48   2.710  -2.992   2.949
  384    HB3  LEU  48           1HB      LEU  48   2.275  -1.317   2.659
  385    HG   LEU  48           HG       LEU  48   1.271  -2.676   0.933
  386   HD11  LEU  48          1HD1      LEU  48   2.065  -0.444   0.226
  387   HD12  LEU  48          2HD1      LEU  48   2.117  -1.593  -1.105
  388   HD13  LEU  48          3HD1      LEU  48   3.609  -1.143  -0.281
  389   HD21  LEU  48          3HD2      LEU  48   2.543  -4.053  -0.665
  390   HD22  LEU  48          1HD2      LEU  48   2.739  -4.651   0.981
  391   HD23  LEU  48          2HD2      LEU  48   4.035  -3.728   0.219
  392    H    MET  49           H        MET  49   4.852  -2.830   4.625
  393    HA   MET  49           HA       MET  49   4.048  -0.903   6.480
  394    HB2  MET  49           2HB      MET  49   6.248  -2.957   6.978
  395    HB3  MET  49           1HB      MET  49   5.222  -2.193   8.184
  396    HG2  MET  49           2HG      MET  49   3.278  -3.412   7.325
  397    HG3  MET  49           1HG      MET  49   4.290  -4.160   6.081
  398    HE1  MET  49           3HE      MET  49   2.698  -6.222   7.893
  399    HE2  MET  49           1HE      MET  49   3.999  -7.326   8.334
  400    HE3  MET  49           2HE      MET  49   3.914  -6.670   6.698
  401    H    VAL  50           H        VAL  50   7.329  -1.635   5.325
  402    HA   VAL  50           HA       VAL  50   8.610   0.465   6.825
  403    HB   VAL  50           HB       VAL  50   9.845  -1.594   6.329
  404   HG11  VAL  50          1HG1      VAL  50   9.694  -0.833   3.391
  405   HG12  VAL  50          2HG1      VAL  50   8.866  -2.192   4.157
  406   HG13  VAL  50          3HG1      VAL  50  10.628  -2.171   4.058
  407   HG21  VAL  50          3HG2      VAL  50  11.133   0.763   4.909
  408   HG22  VAL  50          1HG2      VAL  50  11.981  -0.658   5.517
  409   HG23  VAL  50          2HG2      VAL  50  11.191   0.449   6.644
  410    H    TYR  51           H        TYR  51   7.332   0.136   3.572
  411    HA   TYR  51           HA       TYR  51   8.864   2.124   2.256
  412    HB2  TYR  51           2HB      TYR  51   7.364   0.304   1.191
  413    HB3  TYR  51           1HB      TYR  51   6.015   1.375   1.491
  414    HD1  TYR  51           HD1      TYR  51   9.312   1.203  -0.284
  415    HD2  TYR  51           HD2      TYR  51   5.514   3.136  -0.047
  416    HE1  TYR  51           HE1      TYR  51   9.776   2.374  -2.388
  417    HE2  TYR  51           HE2      TYR  51   5.981   4.305  -2.148
  418    HH   TYR  51           HH       TYR  51   8.487   3.467  -4.233
  419    H    ILE  52           H        ILE  52   5.885   2.223   4.025
  420    HA   ILE  52           HA       ILE  52   5.128   4.910   3.323
  421    HB   ILE  52           HB       ILE  52   4.045   2.985   5.425
  422   HG12  ILE  52          2HG1      ILE  52   2.844   3.650   2.703
  423   HG13  ILE  52          1HG1      ILE  52   3.993   2.335   2.904
  424   HG21  ILE  52          1HG2      ILE  52   2.782   5.529   4.357
  425   HG22  ILE  52          2HG2      ILE  52   3.436   5.310   5.978
  426   HG23  ILE  52          3HG2      ILE  52   2.022   4.386   5.473
  427   HD11  ILE  52          3HD1      ILE  52   1.734   1.538   2.862
  428   HD12  ILE  52          1HD1      ILE  52   1.311   2.549   4.246
  429   HD13  ILE  52          2HD1      ILE  52   2.479   1.229   4.429
  430    H    ARG  53           H        ARG  53   6.781   3.332   6.010
  431    HA   ARG  53           HA       ARG  53   7.080   5.634   7.683
  432    HB2  ARG  53           2HB      ARG  53   7.361   3.330   8.559
  433    HB3  ARG  53           1HB      ARG  53   8.761   3.098   7.523
  434    HG2  ARG  53           2HG      ARG  53   9.401   3.546   9.873
  435    HG3  ARG  53           1HG      ARG  53  10.033   4.756   8.760
  436    HD2  ARG  53           2HD      ARG  53   8.154   6.280   9.413
  437    HD3  ARG  53           1HD      ARG  53   7.634   5.079  10.602
  438    HE   ARG  53           HE       ARG  53  10.308   5.609  11.137
  439   HH11  ARG  53          1HH1      ARG  53   7.319   7.474  11.125
  440   HH12  ARG  53          2HH1      ARG  53   7.867   8.578  12.337
  441   HH21  ARG  53          1HH2      ARG  53  11.015   7.056  12.695
  442   HH22  ARG  53          2HH2      ARG  53   9.983   8.343  13.236
  443    H    ASP  54           H        ASP  54   8.792   4.389   4.929
  444    HA   ASP  54           HA       ASP  54  11.170   6.005   5.162
  445    HB2  ASP  54           2HB      ASP  54  11.265   3.810   4.088
  446    HB3  ASP  54           1HB      ASP  54  10.046   4.283   2.911
  447    H    GLU  55           H        GLU  55   8.226   6.070   3.160
  448    HA   GLU  55           HA       GLU  55   9.103   8.453   1.730
  449    HB2  GLU  55           2HB      GLU  55   8.039   6.581   0.514
  450    HB3  GLU  55           1HB      GLU  55   6.570   6.795   1.456
  451    HG2  GLU  55           2HG      GLU  55   6.428   7.744  -0.826
  452    HG3  GLU  55           1HG      GLU  55   6.138   8.934   0.441
  453    H    MET  56           H        MET  56   6.056   7.594   3.432
  454    HA   MET  56           HA       MET  56   5.322  10.393   3.707
  455    HB2  MET  56           2HB      MET  56   3.945   7.775   4.354
  456    HB3  MET  56           1HB      MET  56   3.300   9.281   4.995
  457    HG2  MET  56           2HG      MET  56   2.120   8.693   2.973
  458    HG3  MET  56           1HG      MET  56   3.071  10.148   2.698
  459    HE1  MET  56           3HE      MET  56   2.466   6.426   1.739
  460    HE2  MET  56           1HE      MET  56   3.984   6.251   2.616
  461    HE3  MET  56           2HE      MET  56   3.941   5.994   0.872
  462    H    GLY  57           H        GLY  57   7.120   8.208   5.590
  463    HA2  GLY  57           2HA      GLY  57   8.289   8.591   7.543
  464    HA3  GLY  57           1HA      GLY  57   7.541  10.176   7.662
  465    H    VAL  58           H        VAL  58   5.615   7.263   7.373
  466    HA   VAL  58           HA       VAL  58   5.052   7.224  10.267
  467    HB   VAL  58           HB       VAL  58   3.358   8.736   9.340
  468   HG11  VAL  58          1HG1      VAL  58   1.679   8.017   7.663
  469   HG12  VAL  58          2HG1      VAL  58   2.573   6.509   7.434
  470   HG13  VAL  58          3HG1      VAL  58   3.315   8.050   6.997
  471   HG21  VAL  58          3HG2      VAL  58   1.308   7.602  10.102
  472   HG22  VAL  58          1HG2      VAL  58   2.664   7.265  11.180
  473   HG23  VAL  58          2HG2      VAL  58   2.135   6.045  10.018
  474    H    SER  59           H        SER  59   5.241   5.155  10.949
  475    HA   SER  59           HA       SER  59   5.347   2.953   9.055
  476    HB2  SER  59           2HB      SER  59   5.958   1.640  11.165
  477    HB3  SER  59           1HB      SER  59   7.031   2.989  10.794
  478    HG   SER  59           HG       SER  59   4.898   3.010  12.677
  479    H    ILE  60           H        ILE  60   3.767   1.423   8.748
  480    HA   ILE  60           HA       ILE  60   1.297   1.412  10.263
  481    HB   ILE  60           HB       ILE  60   2.331  -0.745   8.361
  482   HG12  ILE  60          2HG1      ILE  60   1.921   1.599   7.309
  483   HG13  ILE  60          1HG1      ILE  60   1.126   0.221   6.556
  484   HG21  ILE  60          1HG2      ILE  60  -0.062  -1.458   8.270
  485   HG22  ILE  60          2HG2      ILE  60  -0.447  -0.276   9.523
  486   HG23  ILE  60          3HG2      ILE  60   0.642  -1.618   9.877
  487   HD11  ILE  60          3HD1      ILE  60  -0.330   2.189   6.730
  488   HD12  ILE  60          1HD1      ILE  60  -0.198   2.125   8.484
  489   HD13  ILE  60          2HD1      ILE  60  -0.978   0.805   7.613
  490    HA   PRO  61           HA       PRO  61   3.338  -1.187  13.480
  491    HB2  PRO  61           2HB      PRO  61   1.189  -1.254  15.206
  492    HB3  PRO  61           1HB      PRO  61   2.272   0.146  15.073
  493    HG2  PRO  61           2HG      PRO  61  -0.413  -0.274  13.809
  494    HG3  PRO  61           1HG      PRO  61   0.227   1.159  14.648
  495    HD2  PRO  61           2HD      PRO  61   0.176   0.986  11.952
  496    HD3  PRO  61           1HD      PRO  61   1.477   1.843  12.808
  497    H    SER  62           H        SER  62   2.859  -3.299  14.482
  498    HA   SER  62           HA       SER  62   1.912  -5.254  12.686
  499    HB2  SER  62           2HB      SER  62   2.213  -6.805  14.657
  500    HB3  SER  62           1HB      SER  62   3.614  -5.783  14.336
  501    HG   SER  62           HG       SER  62   2.761  -5.990  16.612
  502    H    THR  63           H        THR  63   0.331  -3.486  15.270
  503    HA   THR  63           HA       THR  63  -1.999  -5.121  15.524
  504    HB   THR  63           HB       THR  63  -1.218  -3.677  17.343
  505    HG1  THR  63           HG1      THR  63  -3.259  -3.941  17.799
  506   HG21  THR  63          3HG2      THR  63  -2.072  -1.313  15.632
  507   HG22  THR  63          1HG2      THR  63  -0.411  -1.746  16.050
  508   HG23  THR  63          2HG2      THR  63  -1.535  -1.246  17.312
  509    H    HIS  64           H        HIS  64  -1.018  -2.967  13.113
  510    HA   HIS  64           HA       HIS  64  -3.771  -2.621  12.067
  511    HB2  HIS  64           2HB      HIS  64  -1.329  -0.849  11.879
  512    HB3  HIS  64           1HB      HIS  64  -2.521  -0.808  10.583
  513    HD1  HIS  64           HD1      HIS  64  -3.819  -1.273  14.069
  514    HD2  HIS  64           HD2      HIS  64  -3.226   1.812  11.337
  515    HE1  HIS  64           HE1      HIS  64  -5.116   0.677  14.959
  516    HE2  HIS  64           HE2      HIS  64  -4.623   2.564  13.377
  517    H    ILE  65           H        ILE  65  -1.403  -4.780  11.771
  518    HA   ILE  65           HA       ILE  65  -1.450  -4.941   8.838
  519    HB   ILE  65           HB       ILE  65  -0.189  -6.949  10.761
  520   HG12  ILE  65          2HG1      ILE  65   0.874  -4.760  11.099
  521   HG13  ILE  65          1HG1      ILE  65   1.979  -5.833  10.245
  522   HG21  ILE  65          1HG2      ILE  65   0.222  -6.469   7.779
  523   HG22  ILE  65          2HG2      ILE  65  -0.646  -7.823   8.505
  524   HG23  ILE  65          3HG2      ILE  65   1.091  -7.657   8.762
  525   HD11  ILE  65          3HD1      ILE  65   1.996  -3.567   9.357
  526   HD12  ILE  65          1HD1      ILE  65   0.278  -3.699   8.974
  527   HD13  ILE  65          2HD1      ILE  65   1.451  -4.734   8.149
  528    H    THR  66           H        THR  66  -3.607  -5.274   8.487
  529    HA   THR  66           HA       THR  66  -4.450  -8.020   8.639
  530    HB   THR  66           HB       THR  66  -5.329  -7.217  10.785
  531    HG1  THR  66           HG1      THR  66  -7.733  -7.402  10.118
  532   HG21  THR  66          3HG2      THR  66  -6.815  -5.081   9.216
  533   HG22  THR  66          1HG2      THR  66  -5.430  -4.806  10.280
  534   HG23  THR  66          2HG2      THR  66  -6.959  -5.392  10.948
  535    H    GLY  67           H        GLY  67  -6.817  -8.054   7.575
  536    HA2  GLY  67           2HA      GLY  67  -6.325  -7.569   4.885
  537    HA3  GLY  67           1HA      GLY  67  -7.871  -8.028   5.563
  538    H    LYS  68           H        LYS  68  -8.654  -5.852   6.990
  539    HA   LYS  68           HA       LYS  68  -9.979  -4.374   5.041
  540    HB2  LYS  68           2HB      LYS  68 -10.711  -2.904   6.901
  541    HB3  LYS  68           1HB      LYS  68 -10.848  -4.618   7.281
  542    HG2  LYS  68           2HG      LYS  68  -8.801  -4.525   8.623
  543    HG3  LYS  68           1HG      LYS  68  -8.574  -2.823   8.211
  544    HD2  LYS  68           2HD      LYS  68 -10.950  -3.950   9.741
  545    HD3  LYS  68           1HD      LYS  68  -9.550  -3.176  10.484
  546    HE2  LYS  68           2HE      LYS  68 -10.094  -1.092   9.206
  547    HE3  LYS  68           1HE      LYS  68 -11.560  -1.878   8.615
  548    HZ1  LYS  68           3HZ      LYS  68 -11.893  -0.416  10.562
  549    HZ2  LYS  68           1HZ      LYS  68 -10.942  -1.461  11.490
  550    HZ3  LYS  68           2HZ      LYS  68 -12.399  -2.008  10.829
  551    H    TYR  69           H        TYR  69  -6.920  -3.635   6.566
  552    HA   TYR  69           HA       TYR  69  -6.879  -0.856   5.706
  553    HB2  TYR  69           2HB      TYR  69  -4.832  -2.569   7.160
  554    HB3  TYR  69           1HB      TYR  69  -4.617  -0.856   6.804
  555    HD1  TYR  69           HD2      TYR  69  -7.212   0.346   7.447
  556    HD2  TYR  69           HD1      TYR  69  -5.125  -2.747   9.524
  557    HE1  TYR  69           HE2      TYR  69  -8.344   0.985   9.515
  558    HE2  TYR  69           HE1      TYR  69  -6.266  -2.105  11.607
  559    HH   TYR  69           HH       TYR  69  -7.406  -0.153  12.579
  560    H    PHE  70           H        PHE  70  -5.536  -3.929   4.685
  561    HA   PHE  70           HA       PHE  70  -3.765  -2.630   2.689
  562    HB2  PHE  70           2HB      PHE  70  -3.652  -5.344   4.065
  563    HB3  PHE  70           1HB      PHE  70  -2.676  -4.983   2.649
  564    HD1  PHE  70           HD2      PHE  70  -3.256  -4.038   6.206
  565    HD2  PHE  70           HD1      PHE  70  -0.677  -3.656   2.815
  566    HE1  PHE  70           HE2      PHE  70  -1.522  -3.039   7.624
  567    HE2  PHE  70           HE1      PHE  70   1.049  -2.655   4.250
  568    HZ   PHE  70           HZ       PHE  70   0.632  -2.345   6.654
  569    H    LYS  71           H        LYS  71  -6.785  -3.378   2.446
  570    HA   LYS  71           HA       LYS  71  -7.151  -5.568   0.754
  571    HB2  LYS  71           2HB      LYS  71  -8.702  -2.960   0.804
  572    HB3  LYS  71           1HB      LYS  71  -9.219  -4.397  -0.081
  573    HG2  LYS  71           2HG      LYS  71  -9.233  -5.642   2.112
  574    HG3  LYS  71           1HG      LYS  71  -8.935  -4.100   2.919
  575    HD2  LYS  71           2HD      LYS  71 -11.338  -4.784   1.186
  576    HD3  LYS  71           1HD      LYS  71 -11.322  -4.675   2.946
  577    HE2  LYS  71           2HE      LYS  71 -10.854  -2.287   2.833
  578    HE3  LYS  71           1HE      LYS  71 -10.734  -2.358   1.072
  579    HZ1  LYS  71           3HZ      LYS  71 -13.171  -2.905   2.678
  580    HZ2  LYS  71           1HZ      LYS  71 -13.059  -3.025   0.995
  581    HZ3  LYS  71           2HZ      LYS  71 -12.864  -1.527   1.751
  582    H    ASP  72           H        ASP  72  -6.319  -2.275  -0.055
  583    HA   ASP  72           HA       ASP  72  -5.019  -2.906  -2.514
  584    HB2  ASP  72           2HB      ASP  72  -6.459  -1.577  -4.020
  585    HB3  ASP  72           1HB      ASP  72  -7.359  -2.918  -3.337
  586    H    LEU  73           H        LEU  73  -4.797  -0.398  -3.657
  587    HA   LEU  73           HA       LEU  73  -3.175   0.956  -1.795
  588    HB2  LEU  73           2HB      LEU  73  -2.670   1.118  -4.116
  589    HB3  LEU  73           1HB      LEU  73  -4.249   1.763  -4.492
  590    HG   LEU  73           HG       LEU  73  -2.589   3.416  -2.617
  591   HD11  LEU  73          1HD1      LEU  73  -0.934   2.655  -4.282
  592   HD12  LEU  73          2HD1      LEU  73  -1.247   4.382  -4.368
  593   HD13  LEU  73          3HD1      LEU  73  -1.960   3.304  -5.569
  594   HD21  LEU  73          3HD2      LEU  73  -4.822   4.189  -3.321
  595   HD22  LEU  73          1HD2      LEU  73  -4.324   4.129  -5.015
  596   HD23  LEU  73          2HD2      LEU  73  -3.572   5.276  -3.909
  597    H    ASN  74           H        ASN  74  -6.496   1.653  -2.992
  598    HA   ASN  74           HA       ASN  74  -6.664   4.201  -1.720
  599    HB2  ASN  74           2HB      ASN  74  -7.978   3.534  -3.736
  600    HB3  ASN  74           1HB      ASN  74  -8.910   2.419  -2.747
  601   HD21  ASN  74          1HD2      ASN  74 -10.814   3.415  -3.186
  602   HD22  ASN  74          2HD2      ASN  74 -11.247   4.979  -2.592
  603    H    ALA  75           H        ALA  75  -7.429   0.920  -0.705
  604    HA   ALA  75           HA       ALA  75  -8.696   1.503   1.760
  605    HB1  ALA  75           3HB      ALA  75  -6.839  -0.803   1.092
  606    HB2  ALA  75           1HB      ALA  75  -8.587  -0.776   0.841
  607    HB3  ALA  75           2HB      ALA  75  -7.931  -0.727   2.479
  608    H    ILE  76           H        ILE  76  -5.261   1.161   0.905
  609    HA   ILE  76           HA       ILE  76  -4.142   1.759   3.477
  610    HB   ILE  76           HB       ILE  76  -2.927   1.744   0.688
  611   HG12  ILE  76          2HG1      ILE  76  -2.636  -0.216   2.988
  612   HG13  ILE  76          1HG1      ILE  76  -3.680  -0.472   1.589
  613   HG21  ILE  76          1HG2      ILE  76  -1.426   2.032   3.322
  614   HG22  ILE  76          2HG2      ILE  76  -1.593   3.284   2.092
  615   HG23  ILE  76          3HG2      ILE  76  -0.682   1.818   1.732
  616   HD11  ILE  76          3HD1      ILE  76  -1.653  -1.747   1.391
  617   HD12  ILE  76          1HD1      ILE  76  -0.666  -0.302   1.595
  618   HD13  ILE  76          2HD1      ILE  76  -1.672  -0.491   0.151
  619    H    SER  77           H        SER  77  -5.129   3.766   0.729
  620    HA   SER  77           HA       SER  77  -3.567   6.053   1.436
  621    HB2  SER  77           2HB      SER  77  -4.857   7.266  -0.238
  622    HB3  SER  77           1HB      SER  77  -4.495   5.668  -0.879
  623    HG   SER  77           HG       SER  77  -6.855   6.799  -0.631
  624    H    ARG  78           H        ARG  78  -6.855   4.941   2.152
  625    HA   ARG  78           HA       ARG  78  -7.633   7.246   3.672
  626    HB2  ARG  78           2HB      ARG  78  -8.726   4.410   3.803
  627    HB3  ARG  78           1HB      ARG  78  -9.499   5.836   4.489
  628    HG2  ARG  78           2HG      ARG  78  -9.094   5.181   1.565
  629    HG3  ARG  78           1HG      ARG  78 -10.617   5.301   2.437
  630    HD2  ARG  78           2HD      ARG  78 -10.296   7.732   2.695
  631    HD3  ARG  78           1HD      ARG  78  -8.725   7.620   1.891
  632    HE   ARG  78           HE       ARG  78 -10.858   6.584   0.287
  633   HH11  ARG  78          1HH1      ARG  78  -9.252   9.568   1.206
  634   HH12  ARG  78          2HH1      ARG  78  -9.744  10.407  -0.227
  635   HH21  ARG  78          1HH2      ARG  78 -11.490   7.686  -1.560
  636   HH22  ARG  78          2HH2      ARG  78 -11.018   9.334  -1.801
  637    H    THR  79           H        THR  79  -6.243   4.091   4.506
  638    HA   THR  79           HA       THR  79  -6.361   4.302   7.323
  639    HB   THR  79           HB       THR  79  -4.458   2.672   5.588
  640    HG1  THR  79           HG1      THR  79  -6.157   1.464   5.300
  641   HG21  THR  79          3HG2      THR  79  -5.130   2.326   8.544
  642   HG22  THR  79          1HG2      THR  79  -3.559   2.815   7.894
  643   HG23  THR  79          2HG2      THR  79  -4.186   1.197   7.573
  644    H    VAL  80           H        VAL  80  -3.922   5.316   4.993
  645    HA   VAL  80           HA       VAL  80  -1.879   5.839   6.956
  646    HB   VAL  80           HB       VAL  80  -1.409   5.102   4.563
  647   HG11  VAL  80          1HG1      VAL  80  -1.302   6.785   2.781
  648   HG12  VAL  80          2HG1      VAL  80  -2.027   7.998   3.841
  649   HG13  VAL  80          3HG1      VAL  80  -2.957   6.576   3.352
  650   HG21  VAL  80          3HG2      VAL  80   0.617   6.478   4.332
  651   HG22  VAL  80          1HG2      VAL  80   0.357   5.979   6.001
  652   HG23  VAL  80          2HG2      VAL  80  -0.017   7.635   5.508
  653    H    GLU  81           H        GLU  81  -4.390   7.684   5.265
  654    HA   GLU  81           HA       GLU  81  -3.659  10.261   6.228
  655    HB2  GLU  81           2HB      GLU  81  -6.407   9.191   5.492
  656    HB3  GLU  81           1HB      GLU  81  -6.080  10.874   5.891
  657    HG2  GLU  81           2HG      GLU  81  -4.989   9.321   3.550
  658    HG3  GLU  81           1HG      GLU  81  -6.203  10.585   3.486
  659    H    GLN  82           H        GLN  82  -5.669   7.639   7.558
  660    HA   GLN  82           HA       GLN  82  -6.678   8.890   9.862
  661    HB2  GLN  82           2HB      GLN  82  -5.820   5.969   9.600
  662    HB3  GLN  82           1HB      GLN  82  -6.815   6.607  10.905
  663    HG2  GLN  82           2HG      GLN  82  -7.572   6.552   7.981
  664    HG3  GLN  82           1HG      GLN  82  -8.128   5.413   9.203
  665   HE21  GLN  82          1HE2      GLN  82  -9.567   7.382   7.440
  666   HE22  GLN  82          2HE2      GLN  82 -10.546   8.316   8.518
  667    H    LEU  83           H        LEU  83  -3.678   7.057   9.445
  668    HA   LEU  83           HA       LEU  83  -2.608   7.283  12.021
  669    HB2  LEU  83           2HB      LEU  83  -1.157   7.138   9.359
  670    HB3  LEU  83           1HB      LEU  83  -0.403   6.866  10.925
  671    HG   LEU  83           HG       LEU  83  -2.611   5.137   9.740
  672   HD11  LEU  83          1HD1      LEU  83  -0.832   3.464   9.411
  673   HD12  LEU  83          2HD1      LEU  83   0.376   4.635   9.947
  674   HD13  LEU  83          3HD1      LEU  83  -0.541   4.922   8.464
  675   HD21  LEU  83          3HD2      LEU  83  -2.645   5.110  12.200
  676   HD22  LEU  83          1HD2      LEU  83  -0.920   4.739  12.241
  677   HD23  LEU  83          2HD2      LEU  83  -2.063   3.570  11.574
  678    H    LYS  84           H        LYS  84  -2.112   9.394   9.197
  679    HA   LYS  84           HA       LYS  84  -0.350  11.192  10.604
  680    HB2  LYS  84           2HB      LYS  84  -1.758  11.509   7.920
  681    HB3  LYS  84           1HB      LYS  84  -0.525  12.605   8.539
  682    HG2  LYS  84           2HG      LYS  84   1.100  10.743   8.552
  683    HG3  LYS  84           1HG      LYS  84  -0.129   9.675   7.881
  684    HD2  LYS  84           2HD      LYS  84   0.964  12.167   6.509
  685    HD3  LYS  84           1HD      LYS  84   1.480  10.516   6.178
  686    HE2  LYS  84           2HE      LYS  84  -0.038  10.982   4.445
  687    HE3  LYS  84           1HE      LYS  84  -0.995  10.054   5.592
  688    HZ1  LYS  84           3HZ      LYS  84  -2.129  12.032   4.647
  689    HZ2  LYS  84           1HZ      LYS  84  -1.020  13.024   5.458
  690    HZ3  LYS  84           2HZ      LYS  84  -2.062  12.031   6.334
  691    H    ALA  85           H        ALA  85  -3.779  10.940  10.297
  692    HA   ALA  85           HA       ALA  85  -4.419  13.679  11.005
  693    HB1  ALA  85           3HB      ALA  85  -5.965  12.314   9.630
  694    HB2  ALA  85           1HB      ALA  85  -6.737  12.898  11.105
  695    HB3  ALA  85           2HB      ALA  85  -6.200  11.219  10.997
  696    H    GLU  86           H        GLU  86  -4.130  10.566  12.675
  697    HA   GLU  86           HA       GLU  86  -5.035  11.598  15.236
  698    HB2  GLU  86           2HB      GLU  86  -3.578   8.983  14.663
  699    HB3  GLU  86           1HB      GLU  86  -4.456   9.395  16.131
  700    HG2  GLU  86           2HG      GLU  86  -5.622   8.872  13.389
  701    HG3  GLU  86           1HG      GLU  86  -5.762   7.859  14.812
  702    H    SER  87           H        SER  87  -1.997  10.901  13.629
  703    HA   SER  87           HA       SER  87  -0.293  11.648  15.843
  704    HB2  SER  87           2HB      SER  87   0.395  10.016  14.082
  705    HB3  SER  87           1HB      SER  87   0.387  11.314  12.893
  706    HG   SER  87           HG       SER  87   1.907  12.032  14.985
  707    H    ALA  88           H        ALA  88  -2.110  13.420  13.544
  708    HA   ALA  88           HA       ALA  88  -0.593  15.643  12.891
  709    HB1  ALA  88           3HB      ALA  88  -3.560  15.619  13.530
  710    HB2  ALA  88           1HB      ALA  88  -2.824  15.236  11.971
  711    HB3  ALA  88           2HB      ALA  88  -2.705  16.871  12.620
  712    H    LEU  89           H        LEU  89   0.140  17.371  13.928
  713    HA   LEU  89           HA       LEU  89  -0.072  17.561  16.826
  714    HB2  LEU  89           2HB      LEU  89   1.858  18.942  16.760
  715    HB3  LEU  89           1HB      LEU  89   2.145  17.626  15.643
  716    HG   LEU  89           HG       LEU  89   1.383  20.468  14.823
  717   HD11  LEU  89          1HD1      LEU  89   4.072  19.072  14.754
  718   HD12  LEU  89          2HD1      LEU  89   3.604  20.376  15.846
  719   HD13  LEU  89          3HD1      LEU  89   3.730  20.683  14.116
  720   HD21  LEU  89          3HD2      LEU  89   2.284  18.129  13.097
  721   HD22  LEU  89          1HD2      LEU  89   2.027  19.785  12.534
  722   HD23  LEU  89          2HD2      LEU  89   0.666  18.836  13.129
  723    H    GLU  90           H        GLU  90  -1.864  18.811  14.365
  724    HA   GLU  90           HA       GLU  90  -2.016  21.600  15.116
  725    HB2  GLU  90           2HB      GLU  90  -3.632  19.952  13.115
  726    HB3  GLU  90           1HB      GLU  90  -3.719  21.706  13.272
  727    HG2  GLU  90           2HG      GLU  90  -1.375  21.907  12.582
  728    HG3  GLU  90           1HG      GLU  90  -1.225  20.152  12.511
  729   H281  4EM 101          2H28      PYA 142   1.419 -12.253   7.832
  730   H283  4EM 101          3H28      PYA 142   2.536 -13.033   8.950
  731   H303  4EM 101          3H30      PYA 142  -0.942 -14.164   8.270
  732   H301  4EM 101          1H30      PYA 142  -1.056 -12.398   8.217
  733   H302  4EM 101          2H30      PYA 142  -1.683 -13.288   9.609
  734   H312  4EM 101          2H31      PYA 142  -0.223 -11.868  11.139
  735   H313  4EM 101          3H31      PYA 142   1.510 -11.775  10.846
  736   H311  4EM 101          1H31      PYA 142   0.391 -11.000   9.724
  737    H32  4EM 101           H32      PYA 142   0.615 -15.283   9.852
  738    H33  4EM 101           H33      PYA 142   2.669 -14.464  10.331
  739    H36  4EM 101           H36      PYA 142   0.836 -13.252  12.656
  740   H373  4EM 101          3H37      PYA 142  -1.523 -14.437  13.962
  741   H372  4EM 101          2H37      PYA 142  -0.101 -13.774  14.753
  742   H382  4EM 101          2H38      PYA 142  -0.764 -11.507  14.025
  743   H383  4EM 101          3H38      PYA 142  -1.913 -12.258  15.123
  744    H41  4EM 101           H41      PYA 142  -2.022 -10.074  12.933
  745   H423  4EM 101          3H42      PYA 142  -3.571  -9.133  11.585
  746   H422  4EM 101          2H42      PYA 142  -4.724 -10.281  12.243
  747   H433  4EM 101          3H43      PYA 142  -4.749 -10.453   9.857
  748   H432  4EM 101          2H43      PYA 142  -4.034 -11.916  10.525
  749    H44  4EM 101           H44      PYA 142  -1.917 -10.907  10.055
  750    H49  4EM 101           H49      PYA 142  -2.396 -10.571   5.652
  751    H51  4EM 101           H51      PYA 142   0.164 -10.481   5.116
  752    H50  4EM 101           H50      PYA 142   1.446 -10.008   7.332
  753    H48  4EM 101           H48      PYA 142  -0.327  -9.808   9.170
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1   4.766  13.596  -2.406
    2    H2   MET   1           2H       MET   1   6.052  14.161  -3.351
    3    H3   MET   1           3H       MET   1   4.548  13.871  -4.048
    4    HA   MET   1           HA       MET   1   5.046  15.894  -1.985
    5    HB2  MET   1           2HB      MET   1   6.186  16.447  -4.133
    6    HB3  MET   1           1HB      MET   1   4.668  16.276  -4.995
    7    HG2  MET   1           2HG      MET   1   3.740  18.215  -3.792
    8    HG3  MET   1           1HG      MET   1   5.227  18.364  -2.855
    9    HE1  MET   1           3HE      MET   1   7.805  19.510  -5.623
   10    HE2  MET   1           1HE      MET   1   7.528  17.856  -5.067
   11    HE3  MET   1           2HE      MET   1   7.570  19.187  -3.910
   12    H    ASP   2           H        ASP   2   2.812  15.346  -4.761
   13    HA   ASP   2           HA       ASP   2   0.600  16.268  -3.058
   14    HB2  ASP   2           2HB      ASP   2   0.655  15.755  -6.067
   15    HB3  ASP   2           1HB      ASP   2  -0.660  16.504  -5.163
   16    H    GLY   3           H        GLY   3   0.728  14.214  -1.859
   17    HA2  GLY   3           2HA      GLY   3  -0.177  12.211  -1.200
   18    HA3  GLY   3           1HA      GLY   3  -1.626  12.989  -1.758
   19    H    GLU   4           H        GLU   4  -1.956  12.609  -4.226
   20    HA   GLU   4           HA       GLU   4  -2.447   9.901  -4.740
   21    HB2  GLU   4           2HB      GLU   4  -2.258  12.113  -6.825
   22    HB3  GLU   4           1HB      GLU   4  -3.149  10.594  -6.956
   23    HG2  GLU   4           2HG      GLU   4  -4.576  11.304  -5.042
   24    HG3  GLU   4           1HG      GLU   4  -3.751  12.867  -5.063
   25    H    GLU   5           H        GLU   5   0.329  11.805  -5.386
   26    HA   GLU   5           HA       GLU   5   1.711  10.243  -7.258
   27    HB2  GLU   5           2HB      GLU   5   2.360  12.550  -6.523
   28    HB3  GLU   5           1HB      GLU   5   2.824  11.896  -4.959
   29    HG2  GLU   5           2HG      GLU   5   4.446  10.379  -6.332
   30    HG3  GLU   5           1HG      GLU   5   4.158  11.532  -7.633
   31    H    VAL   6           H        VAL   6   1.614  10.103  -3.660
   32    HA   VAL   6           HA       VAL   6   3.553   7.942  -3.605
   33    HB   VAL   6           HB       VAL   6   3.335   7.831  -1.216
   34   HG11  VAL   6          1HG1      VAL   6   3.325  10.733  -2.095
   35   HG12  VAL   6          2HG1      VAL   6   4.718   9.647  -2.047
   36   HG13  VAL   6          3HG1      VAL   6   3.925  10.127  -0.549
   37   HG21  VAL   6          3HG2      VAL   6   0.862   8.039  -1.012
   38   HG22  VAL   6          1HG2      VAL   6   0.994   9.770  -1.324
   39   HG23  VAL   6          2HG2      VAL   6   1.719   9.078   0.128
   40    H    LYS   7           H        LYS   7   0.085   8.253  -3.731
   41    HA   LYS   7           HA       LYS   7  -0.706   5.648  -3.125
   42    HB2  LYS   7           2HB      LYS   7  -1.860   7.844  -4.765
   43    HB3  LYS   7           1HB      LYS   7  -2.401   6.243  -5.246
   44    HG2  LYS   7           2HG      LYS   7  -3.044   5.864  -2.813
   45    HG3  LYS   7           1HG      LYS   7  -2.752   7.584  -2.550
   46    HD2  LYS   7           2HD      LYS   7  -4.631   6.606  -4.729
   47    HD3  LYS   7           1HD      LYS   7  -5.182   6.848  -3.076
   48    HE2  LYS   7           2HE      LYS   7  -3.844   9.018  -4.706
   49    HE3  LYS   7           1HE      LYS   7  -5.592   8.773  -4.672
   50    HZ1  LYS   7           3HZ      LYS   7  -4.997  10.444  -3.105
   51    HZ2  LYS   7           1HZ      LYS   7  -3.849   9.445  -2.367
   52    HZ3  LYS   7           2HZ      LYS   7  -5.495   9.083  -2.238
   53    H    GLU   8           H        GLU   8   0.094   6.871  -6.447
   54    HA   GLU   8           HA       GLU   8  -0.014   4.318  -7.642
   55    HB2  GLU   8           2HB      GLU   8   1.112   5.214  -9.590
   56    HB3  GLU   8           1HB      GLU   8  -0.039   6.409  -9.009
   57    HG2  GLU   8           2HG      GLU   8   1.667   7.834  -8.189
   58    HG3  GLU   8           1HG      GLU   8   2.890   6.565  -8.263
   59    H    LYS   9           H        LYS   9   2.577   5.983  -5.963
   60    HA   LYS   9           HA       LYS   9   4.752   4.332  -6.580
   61    HB2  LYS   9           2HB      LYS   9   4.143   6.068  -4.187
   62    HB3  LYS   9           1HB      LYS   9   5.660   5.183  -4.319
   63    HG2  LYS   9           2HG      LYS   9   6.293   6.402  -6.294
   64    HG3  LYS   9           1HG      LYS   9   4.701   7.158  -6.410
   65    HD2  LYS   9           2HD      LYS   9   6.505   8.652  -5.491
   66    HD3  LYS   9           1HD      LYS   9   5.095   8.482  -4.449
   67    HE2  LYS   9           2HE      LYS   9   7.259   8.421  -3.203
   68    HE3  LYS   9           1HE      LYS   9   6.299   6.957  -2.989
   69    HZ1  LYS   9           3HZ      LYS   9   8.622   7.257  -4.825
   70    HZ2  LYS   9           1HZ      LYS   9   7.689   5.858  -4.630
   71    HZ3  LYS   9           2HZ      LYS   9   8.613   6.438  -3.343
   72    H    ILE  10           H        ILE  10   2.253   3.890  -4.107
   73    HA   ILE  10           HA       ILE  10   3.438   1.802  -2.608
   74    HB   ILE  10           HB       ILE  10   0.487   2.206  -3.238
   75   HG12  ILE  10          2HG1      ILE  10   1.315   4.212  -2.183
   76   HG13  ILE  10          1HG1      ILE  10   0.366   3.341  -0.991
   77   HG21  ILE  10          1HG2      ILE  10   1.723   0.596  -0.992
   78   HG22  ILE  10          2HG2      ILE  10   0.832  -0.041  -2.375
   79   HG23  ILE  10          3HG2      ILE  10   0.001   0.943  -1.170
   80   HD11  ILE  10          3HD1      ILE  10   2.348   4.283   0.009
   81   HD12  ILE  10          1HD1      ILE  10   3.383   3.451  -1.148
   82   HD13  ILE  10          2HD1      ILE  10   2.456   2.525   0.042
   83    H    ARG  11           H        ARG  11   1.282   1.698  -5.414
   84    HA   ARG  11           HA       ARG  11   1.287  -1.201  -5.534
   85    HB2  ARG  11           2HB      ARG  11  -0.003   0.871  -7.334
   86    HB3  ARG  11           1HB      ARG  11  -0.235  -0.867  -7.482
   87    HG2  ARG  11           2HG      ARG  11  -1.079   0.897  -5.176
   88    HG3  ARG  11           1HG      ARG  11  -2.128   0.045  -6.307
   89    HD2  ARG  11           2HD      ARG  11  -1.304  -2.126  -5.404
   90    HD3  ARG  11           1HD      ARG  11  -0.287  -1.248  -4.260
   91    HE   ARG  11           HE       ARG  11  -3.148  -0.709  -4.162
   92   HH11  ARG  11          1HH1      ARG  11  -0.444  -2.429  -2.746
   93   HH12  ARG  11          2HH1      ARG  11  -1.269  -2.779  -1.269
   94   HH21  ARG  11          1HH2      ARG  11  -4.262  -1.298  -2.275
   95   HH22  ARG  11          2HH2      ARG  11  -3.450  -2.135  -0.999
   96    H    ARG  12           H        ARG  12   2.775   1.431  -7.299
   97    HA   ARG  12           HA       ARG  12   3.918  -0.032  -9.437
   98    HB2  ARG  12           2HB      ARG  12   4.342   2.654  -8.198
   99    HB3  ARG  12           1HB      ARG  12   5.777   1.995  -8.963
  100    HG2  ARG  12           2HG      ARG  12   4.504   3.472 -10.468
  101    HG3  ARG  12           1HG      ARG  12   4.649   1.833 -11.089
  102    HD2  ARG  12           2HD      ARG  12   2.323   1.379 -10.320
  103    HD3  ARG  12           1HD      ARG  12   2.196   3.059  -9.799
  104    HE   ARG  12           HE       ARG  12   1.801   3.661 -11.956
  105   HH11  ARG  12          1HH1      ARG  12   3.370   0.524 -12.060
  106   HH12  ARG  12          2HH1      ARG  12   3.179   0.357 -13.768
  107   HH21  ARG  12          1HH2      ARG  12   1.529   3.406 -14.190
  108   HH22  ARG  12          2HH2      ARG  12   2.136   1.987 -14.992
  109    H    TYR  13           H        TYR  13   5.036   0.740  -6.174
  110    HA   TYR  13           HA       TYR  13   7.586  -0.376  -6.209
  111    HB2  TYR  13           2HB      TYR  13   6.793   0.985  -4.348
  112    HB3  TYR  13           1HB      TYR  13   5.567  -0.211  -3.925
  113    HD1  TYR  13           HD1      TYR  13   9.287  -0.247  -4.571
  114    HD2  TYR  13           HD2      TYR  13   6.108  -1.385  -1.957
  115    HE1  TYR  13           HE1      TYR  13  10.898  -1.295  -3.049
  116    HE2  TYR  13           HE2      TYR  13   7.717  -2.424  -0.450
  117    HH   TYR  13           HH       TYR  13  11.100  -2.001  -0.798
  118    H    ILE  14           H        ILE  14   4.489  -1.953  -5.577
  119    HA   ILE  14           HA       ILE  14   5.441  -4.517  -4.872
  120    HB   ILE  14           HB       ILE  14   2.779  -3.833  -6.193
  121   HG12  ILE  14          2HG1      ILE  14   3.421  -3.986  -3.215
  122   HG13  ILE  14          1HG1      ILE  14   3.266  -2.481  -4.110
  123   HG21  ILE  14          1HG2      ILE  14   1.960  -5.891  -5.050
  124   HG22  ILE  14          2HG2      ILE  14   3.595  -6.216  -4.477
  125   HG23  ILE  14          3HG2      ILE  14   3.241  -6.252  -6.205
  126   HD11  ILE  14          3HD1      ILE  14   1.276  -2.974  -2.853
  127   HD12  ILE  14          1HD1      ILE  14   1.097  -4.518  -3.682
  128   HD13  ILE  14          2HD1      ILE  14   0.933  -3.008  -4.582
  129    H    MET  15           H        MET  15   4.323  -3.208  -8.002
  130    HA   MET  15           HA       MET  15   4.662  -5.662  -9.434
  131    HB2  MET  15           2HB      MET  15   4.449  -2.840 -10.598
  132    HB3  MET  15           1HB      MET  15   4.100  -4.355 -11.427
  133    HG2  MET  15           2HG      MET  15   2.540  -3.079  -9.189
  134    HG3  MET  15           1HG      MET  15   2.013  -3.360 -10.846
  135    HE1  MET  15           3HE      MET  15   0.752  -5.478 -11.575
  136    HE2  MET  15           1HE      MET  15   1.102  -7.077 -10.922
  137    HE3  MET  15           2HE      MET  15   2.382  -6.150 -11.707
  138    H    GLU  16           H        GLU  16   6.663  -2.693  -9.269
  139    HA   GLU  16           HA       GLU  16   8.610  -3.479 -11.195
  140    HB2  GLU  16           2HB      GLU  16   8.834  -1.397  -8.970
  141    HB3  GLU  16           1HB      GLU  16   9.924  -1.537 -10.340
  142    HG2  GLU  16           2HG      GLU  16   8.197  -0.866 -11.877
  143    HG3  GLU  16           1HG      GLU  16   6.978  -0.918 -10.601
  144    H    ASP  17           H        ASP  17   8.632  -3.416  -7.627
  145    HA   ASP  17           HA       ASP  17  11.353  -4.507  -7.526
  146    HB2  ASP  17           2HB      ASP  17  10.892  -2.560  -6.130
  147    HB3  ASP  17           1HB      ASP  17   9.541  -3.375  -5.356
  148    H    LEU  18           H        LEU  18   8.146  -5.293  -6.089
  149    HA   LEU  18           HA       LEU  18   9.160  -7.699  -4.879
  150    HB2  LEU  18           2HB      LEU  18   6.359  -6.577  -5.109
  151    HB3  LEU  18           1HB      LEU  18   6.675  -8.119  -4.345
  152    HG   LEU  18           HG       LEU  18   6.458  -6.498  -2.604
  153   HD11  LEU  18          1HD1      LEU  18   8.599  -6.627  -1.426
  154   HD12  LEU  18          2HD1      LEU  18   9.417  -7.109  -2.910
  155   HD13  LEU  18          3HD1      LEU  18   8.195  -8.159  -2.185
  156   HD21  LEU  18          3HD2      LEU  18   6.836  -4.423  -3.824
  157   HD22  LEU  18          1HD2      LEU  18   8.564  -4.770  -3.934
  158   HD23  LEU  18          2HD2      LEU  18   7.815  -4.472  -2.364
  159    H    ILE  19           H        ILE  19   7.092  -7.097  -7.736
  160    HA   ILE  19           HA       ILE  19   6.993  -9.911  -8.446
  161    HB   ILE  19           HB       ILE  19   6.048  -7.402  -9.879
  162   HG12  ILE  19          2HG1      ILE  19   3.800  -8.480  -9.777
  163   HG13  ILE  19          1HG1      ILE  19   4.510  -9.854  -8.964
  164   HG21  ILE  19          1HG2      ILE  19   6.013 -10.187 -11.070
  165   HG22  ILE  19          2HG2      ILE  19   6.948  -8.810 -11.657
  166   HG23  ILE  19          3HG2      ILE  19   5.187  -8.780 -11.745
  167   HD11  ILE  19          3HD1      ILE  19   5.012  -8.443  -7.036
  168   HD12  ILE  19          1HD1      ILE  19   3.295  -8.457  -7.442
  169   HD13  ILE  19          2HD1      ILE  19   4.290  -7.064  -7.878
  170    H    GLY  20           H        GLY  20   8.456  -7.027  -9.948
  171    HA2  GLY  20           2HA      GLY  20  10.934  -7.227 -10.418
  172    HA3  GLY  20           1HA      GLY  20  10.525  -8.726 -11.250
  173    HA   PRO  21           HA       PRO  21  10.459  -5.243 -14.426
  174    HB2  PRO  21           2HB      PRO  21  11.997  -6.550 -16.304
  175    HB3  PRO  21           1HB      PRO  21  12.699  -5.601 -14.981
  176    HG2  PRO  21           2HG      PRO  21  12.297  -8.571 -15.134
  177    HG3  PRO  21           1HG      PRO  21  13.739  -7.653 -14.633
  178    HD2  PRO  21           2HD      PRO  21  12.057  -8.687 -12.808
  179    HD3  PRO  21           1HD      PRO  21  12.851  -7.119 -12.546
  180    H    SER  22           H        SER  22   9.539  -8.571 -14.302
  181    HA   SER  22           HA       SER  22   7.987  -8.606 -16.782
  182    HB2  SER  22           2HB      SER  22   8.154 -10.630 -14.511
  183    HB3  SER  22           1HB      SER  22   7.476 -10.913 -16.117
  184    HG   SER  22           HG       SER  22   9.784 -11.546 -15.616
  185    H    ALA  23           H        ALA  23   7.372  -6.656 -14.626
  186    HA   ALA  23           HA       ALA  23   5.152  -7.264 -13.064
  187    HB1  ALA  23           3HB      ALA  23   6.576  -5.348 -12.654
  188    HB2  ALA  23           1HB      ALA  23   4.905  -4.818 -12.863
  189    HB3  ALA  23           2HB      ALA  23   6.070  -4.601 -14.173
  190    H    LYS  24           H        LYS  24   3.144  -7.703 -13.626
  191    HA   LYS  24           HA       LYS  24   1.993  -6.861 -16.182
  192    HB2  LYS  24           2HB      LYS  24   0.717  -8.559 -13.993
  193    HB3  LYS  24           1HB      LYS  24   0.169  -8.398 -15.656
  194    HG2  LYS  24           2HG      LYS  24   2.750  -9.716 -14.764
  195    HG3  LYS  24           1HG      LYS  24   1.286 -10.563 -15.260
  196    HD2  LYS  24           2HD      LYS  24   1.520  -9.655 -17.550
  197    HD3  LYS  24           1HD      LYS  24   2.948  -8.742 -17.053
  198    HE2  LYS  24           2HE      LYS  24   4.168 -10.825 -16.612
  199    HE3  LYS  24           1HE      LYS  24   2.729 -11.775 -16.995
  200    HZ1  LYS  24           3HZ      LYS  24   2.826 -10.886 -19.257
  201    HZ2  LYS  24           1HZ      LYS  24   4.228 -11.738 -18.857
  202    HZ3  LYS  24           2HZ      LYS  24   4.243 -10.054 -18.877
  203    H    GLU  25           H        GLU  25   2.440  -4.632 -15.076
  204    HA   GLU  25           HA       GLU  25   0.849  -3.635 -12.960
  205    HB2  GLU  25           2HB      GLU  25   1.586  -1.394 -13.748
  206    HB3  GLU  25           1HB      GLU  25   2.901  -2.542 -13.609
  207    HG2  GLU  25           2HG      GLU  25   3.007  -2.862 -16.007
  208    HG3  GLU  25           1HG      GLU  25   1.547  -1.897 -16.241
  209    H    ASP  26           H        ASP  26   0.179  -4.110 -16.269
  210    HA   ASP  26           HA       ASP  26  -1.925  -2.268 -16.667
  211    HB2  ASP  26           2HB      ASP  26  -1.355  -4.914 -18.072
  212    HB3  ASP  26           1HB      ASP  26  -2.416  -3.650 -18.688
  213    H    GLU  27           H        GLU  27  -1.723  -5.334 -15.101
  214    HA   GLU  27           HA       GLU  27  -4.586  -5.924 -15.095
  215    HB2  GLU  27           2HB      GLU  27  -2.306  -7.301 -13.606
  216    HB3  GLU  27           1HB      GLU  27  -3.930  -7.931 -13.839
  217    HG2  GLU  27           2HG      GLU  27  -1.796  -7.534 -15.935
  218    HG3  GLU  27           1HG      GLU  27  -2.451  -9.060 -15.348
  219    H    LEU  28           H        LEU  28  -2.475  -4.013 -13.255
  220    HA   LEU  28           HA       LEU  28  -4.009  -4.257 -10.773
  221    HB2  LEU  28           2HB      LEU  28  -1.423  -4.264 -10.936
  222    HB3  LEU  28           1HB      LEU  28  -1.531  -2.552 -11.283
  223    HG   LEU  28           HG       LEU  28  -2.736  -3.696  -8.752
  224   HD11  LEU  28          1HD1      LEU  28  -0.690  -3.210  -7.529
  225   HD12  LEU  28          2HD1      LEU  28   0.116  -2.761  -9.034
  226   HD13  LEU  28          3HD1      LEU  28  -0.405  -4.425  -8.774
  227   HD21  LEU  28          3HD2      LEU  28  -2.380  -1.428  -7.858
  228   HD22  LEU  28          1HD2      LEU  28  -3.375  -1.391  -9.307
  229   HD23  LEU  28          2HD2      LEU  28  -1.677  -0.927  -9.399
  230    H    ASP  29           H        ASP  29  -5.154  -2.545  -9.927
  231    HA   ASP  29           HA       ASP  29  -5.284   0.091 -11.210
  232    HB2  ASP  29           2HB      ASP  29  -7.105  -1.354 -12.260
  233    HB3  ASP  29           1HB      ASP  29  -7.751  -1.585 -10.641
  234    H    ASP  30           H        ASP  30  -6.695   1.542  -9.782
  235    HA   ASP  30           HA       ASP  30  -5.690   1.503  -7.150
  236    HB2  ASP  30           2HB      ASP  30  -6.011   3.599  -8.395
  237    HB3  ASP  30           1HB      ASP  30  -7.739   3.292  -8.519
  238    H    GLN  31           H        GLN  31  -8.959   1.088  -8.474
  239    HA   GLN  31           HA       GLN  31 -10.056   0.442  -5.811
  240    HB2  GLN  31           2HB      GLN  31 -11.525   1.006  -8.424
  241    HB3  GLN  31           1HB      GLN  31 -12.294   0.736  -6.863
  242    HG2  GLN  31           2HG      GLN  31 -11.014   2.781  -6.016
  243    HG3  GLN  31           1HG      GLN  31 -10.583   3.098  -7.697
  244   HE21  GLN  31          1HE2      GLN  31 -12.178   4.709  -5.832
  245   HE22  GLN  31          2HE2      GLN  31 -13.720   4.944  -6.584
  246    H    THR  32           H        THR  32  -8.589  -1.321  -8.037
  247    HA   THR  32           HA       THR  32 -10.355  -3.657  -8.075
  248    HB   THR  32           HB       THR  32  -7.510  -3.155  -9.052
  249    HG1  THR  32           HG1      THR  32  -9.481  -2.340 -10.149
  250   HG21  THR  32          3HG2      THR  32  -9.110  -5.717  -9.375
  251   HG22  THR  32          1HG2      THR  32  -7.654  -5.526  -8.390
  252   HG23  THR  32          2HG2      THR  32  -7.564  -5.355 -10.140
  253    HA   PRO  33           HA       PRO  33  -8.954  -4.870  -3.963
  254    HB2  PRO  33           2HB      PRO  33  -9.861  -7.489  -3.968
  255    HB3  PRO  33           1HB      PRO  33 -10.922  -6.077  -3.762
  256    HG2  PRO  33           2HG      PRO  33 -10.416  -7.697  -6.222
  257    HG3  PRO  33           1HG      PRO  33 -11.947  -7.042  -5.597
  258    HD2  PRO  33           2HD      PRO  33 -10.585  -5.856  -7.614
  259    HD3  PRO  33           1HD      PRO  33 -11.552  -4.923  -6.459
  260    H    LEU  34           H        LEU  34  -6.804  -4.989  -3.806
  261    HA   LEU  34           HA       LEU  34  -5.133  -6.483  -5.564
  262    HB2  LEU  34           2HB      LEU  34  -4.423  -5.032  -2.984
  263    HB3  LEU  34           1HB      LEU  34  -3.260  -5.698  -4.112
  264    HG   LEU  34           HG       LEU  34  -3.276  -3.369  -4.508
  265   HD11  LEU  34          1HD1      LEU  34  -4.049  -3.066  -6.812
  266   HD12  LEU  34          2HD1      LEU  34  -5.009  -4.543  -6.703
  267   HD13  LEU  34          3HD1      LEU  34  -3.248  -4.619  -6.605
  268   HD21  LEU  34          3HD2      LEU  34  -6.281  -3.379  -4.625
  269   HD22  LEU  34          1HD2      LEU  34  -5.243  -1.994  -4.977
  270   HD23  LEU  34          2HD2      LEU  34  -5.265  -2.690  -3.358
  271    H    LEU  35           H        LEU  35  -6.252  -6.968  -2.236
  272    HA   LEU  35           HA       LEU  35  -4.719  -9.236  -1.519
  273    HB2  LEU  35           2HB      LEU  35  -7.567  -8.516  -0.743
  274    HB3  LEU  35           1HB      LEU  35  -6.589  -9.727   0.072
  275    HG   LEU  35           HG       LEU  35  -5.784  -6.797  -0.051
  276   HD11  LEU  35          1HD1      LEU  35  -7.972  -7.003   1.051
  277   HD12  LEU  35          2HD1      LEU  35  -6.698  -6.557   2.184
  278   HD13  LEU  35          3HD1      LEU  35  -7.304  -8.216   2.151
  279   HD21  LEU  35          3HD2      LEU  35  -4.894  -9.041   1.805
  280   HD22  LEU  35          1HD2      LEU  35  -4.331  -7.367   1.843
  281   HD23  LEU  35          2HD2      LEU  35  -3.951  -8.392   0.461
  282    H    GLU  36           H        GLU  36  -7.923  -8.965  -3.000
  283    HA   GLU  36           HA       GLU  36  -8.505 -11.730  -3.225
  284    HB2  GLU  36           2HB      GLU  36  -9.637  -9.242  -4.535
  285    HB3  GLU  36           1HB      GLU  36 -10.230 -10.844  -4.954
  286    HG2  GLU  36           2HG      GLU  36 -11.587  -9.562  -3.259
  287    HG3  GLU  36           1HG      GLU  36 -11.142 -11.203  -2.811
  288    H    TRP  37           H        TRP  37  -6.579  -9.600  -5.159
  289    HA   TRP  37           HA       TRP  37  -6.445 -11.550  -7.389
  290    HB2  TRP  37           2HB      TRP  37  -5.553  -8.655  -7.137
  291    HB3  TRP  37           1HB      TRP  37  -5.095  -9.669  -8.503
  292    HD1  TRP  37           HD1      TRP  37  -8.636  -9.359  -6.855
  293    HE1  TRP  37           HE1      TRP  37 -10.307  -8.697  -8.668
  294    HE3  TRP  37           HE3      TRP  37  -5.384  -8.787 -10.775
  295    HZ2  TRP  37           HZ2      TRP  37 -10.273  -8.004 -11.407
  296    HZ3  TRP  37           HZ3      TRP  37  -6.297  -8.106 -12.966
  297    HH2  TRP  37           HH2      TRP  37  -8.694  -7.725 -13.269
  298    H    GLY  38           H        GLY  38  -5.052 -11.440  -4.525
  299    HA2  GLY  38           2HA      GLY  38  -3.256 -12.552  -3.647
  300    HA3  GLY  38           1HA      GLY  38  -2.889 -13.148  -5.253
  301    H    ILE  39           H        ILE  39  -3.004  -9.745  -4.778
  302    HA   ILE  39           HA       ILE  39  -0.245  -9.435  -5.613
  303    HB   ILE  39           HB       ILE  39  -2.493  -7.425  -5.101
  304   HG12  ILE  39          2HG1      ILE  39  -1.362  -8.489  -7.728
  305   HG13  ILE  39          1HG1      ILE  39  -2.891  -8.985  -7.022
  306   HG21  ILE  39          1HG2      ILE  39  -1.151  -5.719  -6.246
  307   HG22  ILE  39          2HG2      ILE  39   0.195  -6.851  -6.386
  308   HG23  ILE  39          3HG2      ILE  39  -0.327  -6.295  -4.796
  309   HD11  ILE  39          3HD1      ILE  39  -3.735  -6.697  -7.323
  310   HD12  ILE  39          1HD1      ILE  39  -3.235  -7.448  -8.839
  311   HD13  ILE  39          2HD1      ILE  39  -2.199  -6.247  -8.070
  312    H    LEU  40           H        LEU  40  -2.063  -9.342  -2.652
  313    HA   LEU  40           HA       LEU  40   0.312  -8.367  -1.150
  314    HB2  LEU  40           2HB      LEU  40  -2.606  -7.824  -0.524
  315    HB3  LEU  40           1HB      LEU  40  -1.226  -7.297   0.431
  316    HG   LEU  40           HG       LEU  40  -1.723  -6.372  -2.420
  317   HD11  LEU  40          1HD1      LEU  40  -3.583  -5.658  -1.036
  318   HD12  LEU  40          2HD1      LEU  40  -2.558  -4.286  -1.460
  319   HD13  LEU  40          3HD1      LEU  40  -2.469  -4.977   0.164
  320   HD21  LEU  40          3HD2      LEU  40   0.150  -5.375  -0.253
  321   HD22  LEU  40          1HD2      LEU  40  -0.119  -4.600  -1.816
  322   HD23  LEU  40          2HD2      LEU  40   0.599  -6.206  -1.749
  323    H    ASN  41           H        ASN  41   1.074 -10.105  -0.130
  324    HA   ASN  41           HA       ASN  41  -0.514 -11.148   2.078
  325    HB2  ASN  41           2HB      ASN  41   0.863 -13.003   0.088
  326    HB3  ASN  41           1HB      ASN  41   0.452 -13.505   1.719
  327   HD21  ASN  41          1HD2      ASN  41  -0.773 -12.825  -1.450
  328   HD22  ASN  41          2HD2      ASN  41  -2.383 -13.376  -1.163
  329    H    SER  42           H        SER  42   1.132 -12.574   3.493
  330    HA   SER  42           HA       SER  42   2.667 -10.731   4.810
  331    HB2  SER  42           3HB      SER  42   3.126 -13.737   4.747
  332    HB3  SER  42           2HB      SER  42   3.788 -12.648   5.972
  333    H    MET  43           H        MET  43   3.798 -12.765   2.198
  334    HA   MET  43           HA       MET  43   6.560 -12.698   2.495
  335    HB2  MET  43           2HB      MET  43   5.056 -12.604  -0.153
  336    HB3  MET  43           1HB      MET  43   6.677 -13.230   0.100
  337    HG2  MET  43           2HG      MET  43   5.908 -15.203   1.062
  338    HG3  MET  43           1HG      MET  43   4.363 -14.483   1.536
  339    HE1  MET  43           3HE      MET  43   2.433 -13.828  -0.155
  340    HE2  MET  43           1HE      MET  43   2.453 -14.202  -1.880
  341    HE3  MET  43           2HE      MET  43   3.511 -12.945  -1.237
  342    H    ASN  44           H        ASN  44   4.467 -10.415   0.727
  343    HA   ASN  44           HA       ASN  44   6.812  -8.673   0.181
  344    HB2  ASN  44           2HB      ASN  44   5.778  -8.048  -1.910
  345    HB3  ASN  44           1HB      ASN  44   5.872  -9.794  -1.826
  346   HD21  ASN  44          1HD2      ASN  44   4.184  -7.999  -3.452
  347   HD22  ASN  44          2HD2      ASN  44   2.568  -8.501  -3.157
  348    H    ILE  45           H        ILE  45   3.727  -8.795   1.674
  349    HA   ILE  45           HA       ILE  45   2.911  -6.089   1.397
  350    HB   ILE  45           HB       ILE  45   1.537  -8.210   2.077
  351   HG12  ILE  45          2HG1      ILE  45   0.934  -5.602   3.544
  352   HG13  ILE  45          1HG1      ILE  45   0.571  -5.892   1.845
  353   HG21  ILE  45          1HG2      ILE  45   2.856  -8.810   4.087
  354   HG22  ILE  45          2HG2      ILE  45   1.155  -8.555   4.476
  355   HG23  ILE  45          3HG2      ILE  45   2.343  -7.312   4.870
  356   HD11  ILE  45          3HD1      ILE  45  -0.574  -7.396   4.192
  357   HD12  ILE  45          1HD1      ILE  45  -0.918  -7.734   2.490
  358   HD13  ILE  45          2HD1      ILE  45  -1.405  -6.188   3.204
  359    H    VAL  46           H        VAL  46   5.176  -7.646   3.516
  360    HA   VAL  46           HA       VAL  46   5.249  -5.746   5.647
  361    HB   VAL  46           HB       VAL  46   7.392  -7.729   4.770
  362   HG11  VAL  46          1HG1      VAL  46   6.980  -6.336   7.444
  363   HG12  VAL  46          2HG1      VAL  46   8.291  -6.026   6.303
  364   HG13  VAL  46          3HG1      VAL  46   8.184  -7.586   7.118
  365   HG21  VAL  46          3HG2      VAL  46   6.437  -9.282   6.413
  366   HG22  VAL  46          1HG2      VAL  46   5.202  -8.832   5.233
  367   HG23  VAL  46          2HG2      VAL  46   5.190  -8.108   6.844
  368    H    LYS  47           H        LYS  47   6.606  -5.891   2.497
  369    HA   LYS  47           HA       LYS  47   8.724  -3.988   2.846
  370    HB2  LYS  47           2HB      LYS  47   7.431  -5.162   0.361
  371    HB3  LYS  47           1HB      LYS  47   8.721  -3.966   0.285
  372    HG2  LYS  47           2HG      LYS  47   9.661  -6.164  -0.029
  373    HG3  LYS  47           1HG      LYS  47  10.216  -5.515   1.514
  374    HD2  LYS  47           2HD      LYS  47   8.607  -6.919   2.718
  375    HD3  LYS  47           1HD      LYS  47   7.937  -7.496   1.196
  376    HE2  LYS  47           2HE      LYS  47   9.446  -9.157   2.203
  377    HE3  LYS  47           1HE      LYS  47  10.069  -8.590   0.654
  378    HZ1  LYS  47           3HZ      LYS  47  10.964  -7.617   3.312
  379    HZ2  LYS  47           1HZ      LYS  47  11.600  -7.156   1.815
  380    HZ3  LYS  47           2HZ      LYS  47  11.782  -8.744   2.358
  381    H    LEU  48           H        LEU  48   5.324  -3.867   2.064
  382    HA   LEU  48           HA       LEU  48   5.224  -1.125   1.235
  383    HB2  LEU  48           2HB      LEU  48   3.070  -3.046   2.189
  384    HB3  LEU  48           1HB      LEU  48   2.712  -1.370   1.811
  385    HG   LEU  48           HG       LEU  48   2.093  -2.678  -0.105
  386   HD11  LEU  48          1HD1      LEU  48   4.726  -1.286  -0.754
  387   HD12  LEU  48          2HD1      LEU  48   3.148  -0.508  -0.628
  388   HD13  LEU  48          3HD1      LEU  48   3.443  -1.686  -1.902
  389   HD21  LEU  48          3HD2      LEU  48   3.416  -4.712   0.302
  390   HD22  LEU  48          1HD2      LEU  48   4.889  -3.866  -0.178
  391   HD23  LEU  48          2HD2      LEU  48   3.605  -4.150  -1.356
  392    H    MET  49           H        MET  49   5.075  -2.773   4.343
  393    HA   MET  49           HA       MET  49   4.016  -0.712   5.970
  394    HB2  MET  49           2HB      MET  49   6.091  -2.779   6.825
  395    HB3  MET  49           1HB      MET  49   4.993  -1.902   7.881
  396    HG2  MET  49           2HG      MET  49   3.098  -3.108   7.018
  397    HG3  MET  49           1HG      MET  49   4.096  -3.869   5.772
  398    HE1  MET  49           3HE      MET  49   3.427  -6.964   8.073
  399    HE2  MET  49           1HE      MET  49   3.586  -6.433   6.396
  400    HE3  MET  49           2HE      MET  49   2.340  -5.737   7.429
  401    H    VAL  50           H        VAL  50   7.389  -1.577   5.239
  402    HA   VAL  50           HA       VAL  50   8.510   0.721   6.588
  403    HB   VAL  50           HB       VAL  50   9.740  -1.427   6.469
  404   HG11  VAL  50          1HG1      VAL  50   9.112  -2.181   4.224
  405   HG12  VAL  50          2HG1      VAL  50  10.869  -2.140   4.385
  406   HG13  VAL  50          3HG1      VAL  50  10.036  -0.860   3.497
  407   HG21  VAL  50          3HG2      VAL  50  11.047   0.611   6.873
  408   HG22  VAL  50          1HG2      VAL  50  11.230   0.861   5.135
  409   HG23  VAL  50          2HG2      VAL  50  11.985  -0.531   5.911
  410    H    TYR  51           H        TYR  51   7.417   0.022   3.338
  411    HA   TYR  51           HA       TYR  51   8.739   2.050   1.889
  412    HB2  TYR  51           2HB      TYR  51   7.215   0.169   0.955
  413    HB3  TYR  51           1HB      TYR  51   5.864   1.197   1.363
  414    HD1  TYR  51           HD1      TYR  51   9.104   1.313  -0.529
  415    HD2  TYR  51           HD2      TYR  51   5.083   2.733  -0.275
  416    HE1  TYR  51           HE1      TYR  51   9.377   2.472  -2.680
  417    HE2  TYR  51           HE2      TYR  51   5.351   3.890  -2.414
  418    HH   TYR  51           HH       TYR  51   7.891   3.321  -4.549
  419    H    ILE  52           H        ILE  52   5.681   2.010   3.614
  420    HA   ILE  52           HA       ILE  52   4.926   4.716   3.133
  421    HB   ILE  52           HB       ILE  52   3.960   2.697   5.211
  422   HG12  ILE  52          2HG1      ILE  52   2.576   3.462   2.606
  423   HG13  ILE  52          1HG1      ILE  52   3.749   2.155   2.660
  424   HG21  ILE  52          1HG2      ILE  52   1.941   4.076   5.425
  425   HG22  ILE  52          2HG2      ILE  52   2.630   5.262   4.315
  426   HG23  ILE  52          3HG2      ILE  52   3.379   4.986   5.887
  427   HD11  ILE  52          3HD1      ILE  52   1.183   2.259   4.237
  428   HD12  ILE  52          1HD1      ILE  52   2.355   0.934   4.202
  429   HD13  ILE  52          2HD1      ILE  52   1.464   1.359   2.744
  430    H    ARG  53           H        ARG  53   6.588   3.048   5.749
  431    HA   ARG  53           HA       ARG  53   6.966   5.078   7.630
  432    HB2  ARG  53           2HB      ARG  53   7.480   2.705   8.024
  433    HB3  ARG  53           1HB      ARG  53   8.784   2.788   6.849
  434    HG2  ARG  53           2HG      ARG  53  10.043   4.313   8.308
  435    HG3  ARG  53           1HG      ARG  53   8.722   4.306   9.479
  436    HD2  ARG  53           2HD      ARG  53   9.039   1.818   9.727
  437    HD3  ARG  53           1HD      ARG  53  10.457   1.946   8.679
  438    HE   ARG  53           HE       ARG  53  11.287   3.596  10.438
  439   HH11  ARG  53          1HH1      ARG  53   9.284   0.827  11.257
  440   HH12  ARG  53          2HH1      ARG  53   9.907   0.712  12.870
  441   HH21  ARG  53          1HH2      ARG  53  12.067   3.453  12.546
  442   HH22  ARG  53          2HH2      ARG  53  11.491   2.207  13.602
  443    H    ASP  54           H        ASP  54   8.567   4.478   4.585
  444    HA   ASP  54           HA       ASP  54  10.756   6.357   5.071
  445    HB2  ASP  54           2HB      ASP  54  11.219   4.220   3.951
  446    HB3  ASP  54           1HB      ASP  54  10.059   4.594   2.680
  447    H    GLU  55           H        GLU  55   7.993   6.043   2.832
  448    HA   GLU  55           HA       GLU  55   8.637   8.451   1.393
  449    HB2  GLU  55           2HB      GLU  55   6.104   6.767   1.215
  450    HB3  GLU  55           1HB      GLU  55   6.649   7.956   0.046
  451    HG2  GLU  55           2HG      GLU  55   8.113   5.388   0.690
  452    HG3  GLU  55           1HG      GLU  55   7.002   5.591  -0.657
  453    H    MET  56           H        MET  56   5.822   7.445   3.375
  454    HA   MET  56           HA       MET  56   4.876  10.212   3.620
  455    HB2  MET  56           2HB      MET  56   3.682   7.522   4.372
  456    HB3  MET  56           1HB      MET  56   2.952   9.030   4.922
  457    HG2  MET  56           2HG      MET  56   1.851   8.185   2.911
  458    HG3  MET  56           1HG      MET  56   2.619   9.741   2.621
  459    HE1  MET  56           3HE      MET  56   2.323   6.066   1.542
  460    HE2  MET  56           1HE      MET  56   3.784   5.904   2.518
  461    HE3  MET  56           2HE      MET  56   3.870   5.727   0.766
  462    H    GLY  57           H        GLY  57   6.984   8.199   5.315
  463    HA2  GLY  57           2HA      GLY  57   8.181   8.588   7.235
  464    HA3  GLY  57           1HA      GLY  57   7.325  10.110   7.430
  465    H    VAL  58           H        VAL  58   5.435   7.206   7.146
  466    HA   VAL  58           HA       VAL  58   4.990   7.119  10.071
  467    HB   VAL  58           HB       VAL  58   3.148   8.476   9.232
  468   HG11  VAL  58          1HG1      VAL  58   2.556   6.302   7.210
  469   HG12  VAL  58          2HG1      VAL  58   3.200   7.903   6.849
  470   HG13  VAL  58          3HG1      VAL  58   1.561   7.739   7.488
  471   HG21  VAL  58          3HG2      VAL  58   2.556   6.827  10.969
  472   HG22  VAL  58          1HG2      VAL  58   2.127   5.667   9.711
  473   HG23  VAL  58          2HG2      VAL  58   1.190   7.150   9.897
  474    H    SER  59           H        SER  59   5.438   5.115  10.732
  475    HA   SER  59           HA       SER  59   5.364   2.846   8.906
  476    HB2  SER  59           2HB      SER  59   7.241   3.240  10.604
  477    HB3  SER  59           1HB      SER  59   6.089   2.837  11.875
  478    HG   SER  59           HG       SER  59   6.284   0.804  11.386
  479    H    ILE  60           H        ILE  60   3.616   1.568   8.759
  480    HA   ILE  60           HA       ILE  60   1.328   1.811  10.460
  481    HB   ILE  60           HB       ILE  60   1.988  -0.204   8.263
  482   HG12  ILE  60          2HG1      ILE  60   0.273   2.291   8.413
  483   HG13  ILE  60          1HG1      ILE  60   1.498   1.880   7.225
  484   HG21  ILE  60          1HG2      ILE  60  -0.598  -0.011   9.842
  485   HG22  ILE  60          2HG2      ILE  60   0.572  -1.327   9.930
  486   HG23  ILE  60          3HG2      ILE  60  -0.320  -1.046   8.438
  487   HD11  ILE  60          3HD1      ILE  60  -1.236   0.629   7.469
  488   HD12  ILE  60          1HD1      ILE  60  -0.018   0.232   6.245
  489   HD13  ILE  60          2HD1      ILE  60  -0.736   1.844   6.284
  490    HA   PRO  61           HA       PRO  61   2.952  -1.030  13.633
  491    HB2  PRO  61           2HB      PRO  61   0.660  -1.108  15.200
  492    HB3  PRO  61           1HB      PRO  61   1.828   0.226  15.239
  493    HG2  PRO  61           2HG      PRO  61  -0.768   0.057  13.764
  494    HG3  PRO  61           1HG      PRO  61  -0.098   1.404  14.716
  495    HD2  PRO  61           2HD      PRO  61   0.038   1.382  12.023
  496    HD3  PRO  61           1HD      PRO  61   1.344   2.072  13.008
  497    H    SER  62           H        SER  62   2.369  -3.146  14.536
  498    HA   SER  62           HA       SER  62   1.829  -4.916  12.385
  499    HB2  SER  62           2HB      SER  62   2.294  -6.689  14.117
  500    HB3  SER  62           1HB      SER  62   3.538  -5.448  14.001
  501    HG   SER  62           HG       SER  62   1.837  -6.055  16.086
  502    H    THR  63           H        THR  63  -0.112  -3.877  15.134
  503    HA   THR  63           HA       THR  63  -2.187  -5.832  14.883
  504    HB   THR  63           HB       THR  63  -1.757  -4.576  17.004
  505    HG1  THR  63           HG1      THR  63  -3.872  -5.524  16.392
  506   HG21  THR  63          3HG2      THR  63  -2.614  -2.303  17.317
  507   HG22  THR  63          1HG2      THR  63  -3.070  -2.214  15.614
  508   HG23  THR  63          2HG2      THR  63  -1.368  -2.314  16.068
  509    H    HIS  64           H        HIS  64  -1.426  -2.918  13.235
  510    HA   HIS  64           HA       HIS  64  -4.073  -2.444  12.078
  511    HB2  HIS  64           2HB      HIS  64  -2.513  -0.617  12.869
  512    HB3  HIS  64           1HB      HIS  64  -1.421  -1.050  11.565
  513    HD1  HIS  64           HD1      HIS  64  -2.290  -0.533   9.126
  514    HD2  HIS  64           HD2      HIS  64  -4.560   1.059  12.187
  515    HE1  HIS  64           HE1      HIS  64  -3.560   1.334   8.084
  516    HE2  HIS  64           HE2      HIS  64  -4.984   2.259   9.966
  517    H    ILE  65           H        ILE  65  -1.472  -4.496  11.428
  518    HA   ILE  65           HA       ILE  65  -1.643  -4.445   8.534
  519    HB   ILE  65           HB       ILE  65  -0.414  -6.625  10.273
  520   HG12  ILE  65          2HG1      ILE  65   0.668  -4.492  10.796
  521   HG13  ILE  65          1HG1      ILE  65   1.766  -5.494   9.852
  522   HG21  ILE  65          1HG2      ILE  65  -0.868  -7.345   7.956
  523   HG22  ILE  65          2HG2      ILE  65   0.866  -7.215   8.236
  524   HG23  ILE  65          3HG2      ILE  65   0.025  -5.955   7.330
  525   HD11  ILE  65          3HD1      ILE  65   0.095  -3.239   8.757
  526   HD12  ILE  65          1HD1      ILE  65   1.277  -4.202   7.863
  527   HD13  ILE  65          2HD1      ILE  65   1.808  -3.152   9.182
  528    H    THR  66           H        THR  66  -3.724  -4.843   7.979
  529    HA   THR  66           HA       THR  66  -4.602  -7.594   8.135
  530    HB   THR  66           HB       THR  66  -5.628  -6.713  10.182
  531    HG1  THR  66           HG1      THR  66  -7.838  -7.159   9.649
  532   HG21  THR  66          3HG2      THR  66  -6.913  -4.579   8.451
  533   HG22  THR  66          1HG2      THR  66  -5.631  -4.318   9.640
  534   HG23  THR  66          2HG2      THR  66  -7.232  -4.850  10.164
  535    H    GLY  67           H        GLY  67  -6.801  -7.713   6.910
  536    HA2  GLY  67           2HA      GLY  67  -6.305  -7.201   4.239
  537    HA3  GLY  67           1HA      GLY  67  -7.861  -7.633   4.917
  538    H    LYS  68           H        LYS  68  -8.725  -5.549   6.277
  539    HA   LYS  68           HA       LYS  68  -9.833  -3.936   4.297
  540    HB2  LYS  68           2HB      LYS  68 -10.820  -2.649   6.130
  541    HB3  LYS  68           1HB      LYS  68 -10.920  -4.381   6.408
  542    HG2  LYS  68           2HG      LYS  68  -9.066  -4.277   8.012
  543    HG3  LYS  68           1HG      LYS  68  -8.863  -2.550   7.708
  544    HD2  LYS  68           2HD      LYS  68 -11.318  -3.876   8.914
  545    HD3  LYS  68           1HD      LYS  68 -10.109  -2.945   9.797
  546    HE2  LYS  68           2HE      LYS  68 -10.745  -0.911   8.614
  547    HE3  LYS  68           1HE      LYS  68 -11.864  -1.808   7.589
  548    HZ1  LYS  68           3HZ      LYS  68 -13.069  -2.389   9.695
  549    HZ2  LYS  68           1HZ      LYS  68 -13.126  -0.764   9.242
  550    HZ3  LYS  68           2HZ      LYS  68 -12.100  -1.255  10.484
  551    H    TYR  69           H        TYR  69  -6.888  -3.312   6.106
  552    HA   TYR  69           HA       TYR  69  -6.891  -0.442   5.479
  553    HB2  TYR  69           2HB      TYR  69  -5.019  -2.122   7.175
  554    HB3  TYR  69           1HB      TYR  69  -4.835  -0.387   6.915
  555    HD1  TYR  69           HD2      TYR  69  -7.711   0.514   7.098
  556    HD2  TYR  69           HD1      TYR  69  -5.520  -2.239   9.521
  557    HE1  TYR  69           HE2      TYR  69  -9.194   0.999   8.979
  558    HE2  TYR  69           HE1      TYR  69  -7.013  -1.752  11.407
  559    HH   TYR  69           HH       TYR  69  -8.534   0.100  12.152
  560    H    PHE  70           H        PHE  70  -5.626  -3.323   4.182
  561    HA   PHE  70           HA       PHE  70  -3.748  -1.816   2.438
  562    HB2  PHE  70           2HB      PHE  70  -3.643  -4.657   3.490
  563    HB3  PHE  70           1HB      PHE  70  -2.787  -4.222   2.015
  564    HD1  PHE  70           HD2      PHE  70  -2.997  -3.467   5.677
  565    HD2  PHE  70           HD1      PHE  70  -0.697  -2.997   2.094
  566    HE1  PHE  70           HE2      PHE  70  -1.105  -2.606   6.995
  567    HE2  PHE  70           HE1      PHE  70   1.191  -2.136   3.425
  568    HZ   PHE  70           HZ       PHE  70   0.992  -1.949   5.877
  569    H    LYS  71           H        LYS  71  -6.761  -2.969   2.459
  570    HA   LYS  71           HA       LYS  71  -7.169  -4.880   0.588
  571    HB2  LYS  71           2HB      LYS  71  -8.741  -3.602   2.313
  572    HB3  LYS  71           1HB      LYS  71  -9.207  -2.680   0.887
  573    HG2  LYS  71           2HG      LYS  71  -9.908  -4.767  -0.226
  574    HG3  LYS  71           1HG      LYS  71  -9.380  -5.686   1.190
  575    HD2  LYS  71           2HD      LYS  71 -11.807  -5.392   1.282
  576    HD3  LYS  71           1HD      LYS  71 -11.053  -4.472   2.587
  577    HE2  LYS  71           2HE      LYS  71 -12.838  -3.161   1.536
  578    HE3  LYS  71           1HE      LYS  71 -11.277  -2.402   1.213
  579    HZ1  LYS  71           3HZ      LYS  71 -11.270  -3.403  -0.969
  580    HZ2  LYS  71           1HZ      LYS  71 -12.670  -2.484  -0.753
  581    HZ3  LYS  71           2HZ      LYS  71 -12.750  -4.169  -0.670
  582    H    ASP  72           H        ASP  72  -7.207  -1.428   0.033
  583    HA   ASP  72           HA       ASP  72  -7.011  -1.750  -2.892
  584    HB2  ASP  72           2HB      ASP  72  -8.924   0.086  -1.366
  585    HB3  ASP  72           1HB      ASP  72  -8.463   0.393  -3.027
  586    H    LEU  73           H        LEU  73  -6.345   0.346  -3.864
  587    HA   LEU  73           HA       LEU  73  -4.108   1.452  -2.415
  588    HB2  LEU  73           2HB      LEU  73  -4.046   1.066  -4.862
  589    HB3  LEU  73           1HB      LEU  73  -5.310   2.270  -5.081
  590    HG   LEU  73           HG       LEU  73  -3.814   4.051  -4.275
  591   HD11  LEU  73          1HD1      LEU  73  -2.562   2.750  -2.601
  592   HD12  LEU  73          2HD1      LEU  73  -1.472   3.588  -3.694
  593   HD13  LEU  73          3HD1      LEU  73  -1.746   1.861  -3.892
  594   HD21  LEU  73          3HD2      LEU  73  -2.472   2.340  -6.404
  595   HD22  LEU  73          1HD2      LEU  73  -2.152   4.049  -6.100
  596   HD23  LEU  73          2HD2      LEU  73  -3.735   3.542  -6.683
  597    H    ASN  74           H        ASN  74  -7.308   2.595  -3.459
  598    HA   ASN  74           HA       ASN  74  -7.269   5.111  -2.175
  599    HB2  ASN  74           2HB      ASN  74  -9.791   4.925  -2.232
  600    HB3  ASN  74           1HB      ASN  74  -9.011   4.655  -3.781
  601   HD21  ASN  74          1HD2      ASN  74  -9.163   2.672  -4.762
  602   HD22  ASN  74          2HD2      ASN  74 -10.165   1.387  -4.167
  603    H    ALA  75           H        ALA  75  -8.051   1.856  -0.958
  604    HA   ALA  75           HA       ALA  75  -9.070   2.566   1.573
  605    HB1  ALA  75           3HB      ALA  75  -9.306   0.308   0.650
  606    HB2  ALA  75           1HB      ALA  75  -8.589   0.263   2.262
  607    HB3  ALA  75           2HB      ALA  75  -7.572   0.045   0.835
  608    H    ILE  76           H        ILE  76  -5.739   1.727   0.622
  609    HA   ILE  76           HA       ILE  76  -4.493   2.150   3.129
  610    HB   ILE  76           HB       ILE  76  -3.317   2.332   0.313
  611   HG12  ILE  76          2HG1      ILE  76  -3.165   0.094   2.362
  612   HG13  ILE  76          1HG1      ILE  76  -4.214   0.091   0.950
  613   HG21  ILE  76          1HG2      ILE  76  -1.067   2.123   1.324
  614   HG22  ILE  76          2HG2      ILE  76  -1.776   2.213   2.937
  615   HG23  ILE  76          3HG2      ILE  76  -1.866   3.603   1.853
  616   HD11  ILE  76          3HD1      ILE  76  -1.203   0.020   0.960
  617   HD12  ILE  76          1HD1      ILE  76  -2.220   0.084  -0.489
  618   HD13  ILE  76          2HD1      ILE  76  -2.317  -1.301   0.594
  619    H    SER  77           H        SER  77  -5.044   4.299   0.361
  620    HA   SER  77           HA       SER  77  -3.529   6.508   1.157
  621    HB2  SER  77           2HB      SER  77  -4.607   6.240  -1.094
  622    HB3  SER  77           1HB      SER  77  -6.180   6.552  -0.362
  623    HG   SER  77           HG       SER  77  -5.210   8.616   0.341
  624    H    ARG  78           H        ARG  78  -6.998   5.931   1.664
  625    HA   ARG  78           HA       ARG  78  -7.541   8.265   3.133
  626    HB2  ARG  78           2HB      ARG  78  -8.983   5.589   3.089
  627    HB3  ARG  78           1HB      ARG  78  -9.630   7.047   3.848
  628    HG2  ARG  78           2HG      ARG  78  -9.099   6.587   0.902
  629    HG3  ARG  78           1HG      ARG  78 -10.656   6.852   1.687
  630    HD2  ARG  78           2HD      ARG  78  -8.416   8.894   1.368
  631    HD3  ARG  78           1HD      ARG  78  -9.968   8.890   0.519
  632    HE   ARG  78           HE       ARG  78 -11.011   9.174   2.783
  633   HH11  ARG  78          1HH1      ARG  78  -7.779  10.333   2.192
  634   HH12  ARG  78          2HH1      ARG  78  -7.854  11.559   3.411
  635   HH21  ARG  78          1HH2      ARG  78 -11.110  10.770   4.402
  636   HH22  ARG  78          2HH2      ARG  78  -9.749  11.804   4.663
  637    H    THR  79           H        THR  79  -6.587   5.046   4.146
  638    HA   THR  79           HA       THR  79  -6.972   5.477   6.944
  639    HB   THR  79           HB       THR  79  -5.443   3.275   5.507
  640    HG1  THR  79           HG1      THR  79  -7.405   2.646   5.045
  641   HG21  THR  79          3HG2      THR  79  -4.794   3.433   7.901
  642   HG22  THR  79          1HG2      THR  79  -5.739   1.980   7.573
  643   HG23  THR  79          2HG2      THR  79  -6.499   3.363   8.356
  644    H    VAL  80           H        VAL  80  -4.176   5.742   4.790
  645    HA   VAL  80           HA       VAL  80  -2.214   5.833   6.903
  646    HB   VAL  80           HB       VAL  80  -1.685   4.994   4.560
  647   HG11  VAL  80          1HG1      VAL  80  -1.648   7.937   3.790
  648   HG12  VAL  80          2HG1      VAL  80  -2.772   6.719   3.189
  649   HG13  VAL  80          3HG1      VAL  80  -1.056   6.603   2.799
  650   HG21  VAL  80          3HG2      VAL  80   0.589   5.947   4.507
  651   HG22  VAL  80          1HG2      VAL  80   0.091   5.523   6.145
  652   HG23  VAL  80          2HG2      VAL  80   0.085   7.211   5.633
  653    H    GLU  81           H        GLU  81  -4.084   8.135   5.076
  654    HA   GLU  81           HA       GLU  81  -2.823  10.534   5.927
  655    HB2  GLU  81           2HB      GLU  81  -5.646   9.957   4.953
  656    HB3  GLU  81           1HB      GLU  81  -5.022  11.583   5.219
  657    HG2  GLU  81           2HG      GLU  81  -3.324  11.264   3.513
  658    HG3  GLU  81           1HG      GLU  81  -3.817   9.587   3.291
  659    H    GLN  82           H        GLN  82  -5.327   8.460   7.327
  660    HA   GLN  82           HA       GLN  82  -6.030  10.146   9.534
  661    HB2  GLN  82           2HB      GLN  82  -6.121   7.107   9.548
  662    HB3  GLN  82           1HB      GLN  82  -7.045   8.199  10.571
  663    HG2  GLN  82           2HG      GLN  82  -7.390   7.694   7.619
  664    HG3  GLN  82           1HG      GLN  82  -8.496   7.266   8.910
  665   HE21  GLN  82          1HE2      GLN  82  -7.349   9.794   6.825
  666   HE22  GLN  82          2HE2      GLN  82  -8.536  10.981   7.237
  667    H    LEU  83           H        LEU  83  -3.650   7.559   9.096
  668    HA   LEU  83           HA       LEU  83  -2.668   7.367  11.724
  669    HB2  LEU  83           2HB      LEU  83  -1.209   6.861   9.105
  670    HB3  LEU  83           1HB      LEU  83  -0.652   6.321  10.683
  671    HG   LEU  83           HG       LEU  83  -3.236   5.395   9.352
  672   HD11  LEU  83          1HD1      LEU  83  -1.262   4.576   8.148
  673   HD12  LEU  83          2HD1      LEU  83  -2.071   3.265   9.004
  674   HD13  LEU  83          3HD1      LEU  83  -0.583   3.955   9.656
  675   HD21  LEU  83          3HD2      LEU  83  -3.292   3.684  11.138
  676   HD22  LEU  83          1HD2      LEU  83  -3.394   5.310  11.809
  677   HD23  LEU  83          2HD2      LEU  83  -1.875   4.416  11.893
  678    H    LYS  84           H        LYS  84  -1.572   9.449   9.049
  679    HA   LYS  84           HA       LYS  84   0.541  10.727  10.473
  680    HB2  LYS  84           2HB      LYS  84  -1.119  11.746   8.126
  681    HB3  LYS  84           1HB      LYS  84   0.355  12.510   8.710
  682    HG2  LYS  84           2HG      LYS  84   1.661  10.525   8.096
  683    HG3  LYS  84           1HG      LYS  84   0.197   9.702   7.551
  684    HD2  LYS  84           2HD      LYS  84   1.348  12.256   6.353
  685    HD3  LYS  84           1HD      LYS  84   1.472  10.645   5.651
  686    HE2  LYS  84           2HE      LYS  84  -0.913  10.545   5.280
  687    HE3  LYS  84           1HE      LYS  84  -1.172  12.033   6.187
  688    HZ1  LYS  84           3HZ      LYS  84  -1.294  12.425   3.830
  689    HZ2  LYS  84           1HZ      LYS  84   0.267  11.821   3.596
  690    HZ3  LYS  84           2HZ      LYS  84   0.033  13.237   4.477
  691    H    ALA  85           H        ALA  85  -2.905  11.390  10.162
  692    HA   ALA  85           HA       ALA  85  -2.960  13.951  11.400
  693    HB1  ALA  85           3HB      ALA  85  -4.736  13.140   9.885
  694    HB2  ALA  85           1HB      ALA  85  -5.399  13.632  11.449
  695    HB3  ALA  85           2HB      ALA  85  -5.187  11.920  11.075
  696    H    GLU  86           H        GLU  86  -3.148  10.686  12.644
  697    HA   GLU  86           HA       GLU  86  -4.011  11.497  15.308
  698    HB2  GLU  86           2HB      GLU  86  -3.257   8.770  14.186
  699    HB3  GLU  86           1HB      GLU  86  -3.932   9.048  15.786
  700    HG2  GLU  86           2HG      GLU  86  -5.351   9.758  13.205
  701    HG3  GLU  86           1HG      GLU  86  -5.580   8.247  14.068
  702    H    SER  87           H        SER  87  -1.044  10.306  13.740
  703    HA   SER  87           HA       SER  87   0.550  10.137  16.092
  704    HB2  SER  87           2HB      SER  87   1.361  10.518  13.178
  705    HB3  SER  87           1HB      SER  87   2.508  10.215  14.491
  706    HG   SER  87           HG       SER  87   0.431   8.517  13.569
  707    H    ALA  88           H        ALA  88   0.287  12.743  13.634
  708    HA   ALA  88           HA       ALA  88   1.988  14.549  15.153
  709    HB1  ALA  88           3HB      ALA  88   1.543  16.146  13.329
  710    HB2  ALA  88           1HB      ALA  88   0.337  15.045  12.657
  711    HB3  ALA  88           2HB      ALA  88   2.035  14.570  12.706
  712    H    LEU  89           H        LEU  89   1.335  16.121  16.525
  713    HA   LEU  89           HA       LEU  89  -1.375  16.240  17.474
  714    HB2  LEU  89           2HB      LEU  89  -0.553  17.719  19.219
  715    HB3  LEU  89           1HB      LEU  89   0.465  16.326  19.045
  716    HG   LEU  89           HG       LEU  89   2.111  17.884  19.470
  717   HD11  LEU  89          1HD1      LEU  89   2.742  17.095  17.261
  718   HD12  LEU  89          2HD1      LEU  89   3.282  18.754  17.515
  719   HD13  LEU  89          3HD1      LEU  89   1.865  18.433  16.513
  720   HD21  LEU  89          3HD2      LEU  89   2.051  20.298  19.006
  721   HD22  LEU  89          1HD2      LEU  89   0.603  19.781  19.872
  722   HD23  LEU  89          2HD2      LEU  89   0.528  20.108  18.141
  723    H    GLU  90           H        GLU  90  -2.110  16.879  15.212
  724    HA   GLU  90           HA       GLU  90  -1.862  19.726  14.551
  725    HB2  GLU  90           2HB      GLU  90  -3.223  19.068  12.507
  726    HB3  GLU  90           1HB      GLU  90  -1.613  18.378  12.633
  727    HG2  GLU  90           2HG      GLU  90  -2.556  16.231  13.350
  728    HG3  GLU  90           1HG      GLU  90  -4.184  16.913  13.332
  729   H281  4EM 101          2H28      PYA 142   0.131 -11.161   7.064
  730   H283  4EM 101          3H28      PYA 142   0.989  -9.884   7.922
  731   H303  4EM 101          3H30      PYA 142  -1.862 -12.293  10.004
  732   H301  4EM 101          1H30      PYA 142  -0.352 -13.034   9.451
  733   H302  4EM 101          2H30      PYA 142  -1.591 -12.549   8.283
  734   H312  4EM 101          2H31      PYA 142  -2.336  -9.901   9.538
  735   H313  4EM 101          3H31      PYA 142  -1.159  -8.897   8.704
  736   H311  4EM 101          1H31      PYA 142  -2.029 -10.152   7.816
  737    H32  4EM 101           H32      PYA 142   1.003 -11.185  10.664
  738    H33  4EM 101           H33      PYA 142   1.103  -8.921  11.201
  739    H36  4EM 101           H36      PYA 142  -1.448  -8.706  11.120
  740   H373  4EM 101          3H37      PYA 142  -2.711 -10.137  13.380
  741   H372  4EM 101          2H37      PYA 142  -2.164  -8.468  13.511
  742   H382  4EM 101          2H38      PYA 142  -3.758  -7.819  11.738
  743   H383  4EM 101          3H38      PYA 142  -4.527  -8.457  13.178
  744    H41  4EM 101           H41      PYA 142  -4.367  -8.713   9.719
  745   H423  4EM 101          3H42      PYA 142  -5.986  -9.673   8.365
  746   H422  4EM 101          2H42      PYA 142  -6.605 -10.575   9.733
  747   H433  4EM 101          3H43      PYA 142  -5.909 -12.140   8.098
  748   H432  4EM 101          2H43      PYA 142  -4.753 -12.206   9.417
  749    H44  4EM 101           H44      PYA 142  -3.255 -11.885   7.990
  750    H49  4EM 101           H49      PYA 142  -3.285  -8.942   4.681
  751    H51  4EM 101           H51      PYA 142  -0.920  -9.654   3.780
  752    H50  4EM 101           H50      PYA 142  -0.216 -11.837   4.996
  753    H48  4EM 101           H48      PYA 142  -2.125 -12.432   6.606
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1   6.088  15.096  -5.572
    2    H2   MET   1           2H       MET   1   5.924  13.613  -4.775
    3    H3   MET   1           3H       MET   1   7.459  14.218  -5.133
    4    HA   MET   1           HA       MET   1   6.959  14.486  -2.831
    5    HB2  MET   1           2HB      MET   1   7.480  16.866  -2.626
    6    HB3  MET   1           1HB      MET   1   8.390  16.170  -3.954
    7    HG2  MET   1           2HG      MET   1   6.859  17.195  -5.578
    8    HG3  MET   1           1HG      MET   1   5.862  17.830  -4.270
    9    HE1  MET   1           3HE      MET   1   8.302  20.470  -2.626
   10    HE2  MET   1           1HE      MET   1   8.178  18.770  -2.169
   11    HE3  MET   1           2HE      MET   1   6.723  19.697  -2.527
   12    H    ASP   2           H        ASP   2   4.219  14.912  -4.794
   13    HA   ASP   2           HA       ASP   2   2.644  16.125  -2.594
   14    HB2  ASP   2           2HB      ASP   2   0.922  16.637  -4.155
   15    HB3  ASP   2           1HB      ASP   2   2.413  17.006  -5.001
   16    H    GLY   3           H        GLY   3   0.367  15.112  -2.395
   17    HA2  GLY   3           2HA      GLY   3   0.863  12.551  -1.212
   18    HA3  GLY   3           1HA      GLY   3  -0.635  13.463  -1.170
   19    H    GLU   4           H        GLU   4  -0.667  13.546  -4.208
   20    HA   GLU   4           HA       GLU   4  -1.980  10.955  -4.556
   21    HB2  GLU   4           2HB      GLU   4  -1.801  13.337  -6.432
   22    HB3  GLU   4           1HB      GLU   4  -2.801  11.906  -6.699
   23    HG2  GLU   4           2HG      GLU   4  -4.079  12.406  -4.647
   24    HG3  GLU   4           1HG      GLU   4  -3.068  13.818  -4.355
   25    H    GLU   5           H        GLU   5   0.976  12.513  -5.461
   26    HA   GLU   5           HA       GLU   5   1.848  10.689  -7.463
   27    HB2  GLU   5           2HB      GLU   5   2.974  12.890  -7.076
   28    HB3  GLU   5           1HB      GLU   5   3.522  12.318  -5.503
   29    HG2  GLU   5           2HG      GLU   5   4.676  10.402  -6.841
   30    HG3  GLU   5           1HG      GLU   5   4.419  11.434  -8.248
   31    H    VAL   6           H        VAL   6   2.186  10.764  -3.886
   32    HA   VAL   6           HA       VAL   6   3.975   8.553  -3.759
   33    HB   VAL   6           HB       VAL   6   3.599   8.407  -1.388
   34   HG11  VAL   6          1HG1      VAL   6   4.052  10.723  -0.671
   35   HG12  VAL   6          2HG1      VAL   6   3.544  11.312  -2.257
   36   HG13  VAL   6          3HG1      VAL   6   4.972  10.281  -2.113
   37   HG21  VAL   6          3HG2      VAL   6   1.182  10.223  -1.712
   38   HG22  VAL   6          1HG2      VAL   6   1.850   9.666  -0.175
   39   HG23  VAL   6          2HG2      VAL   6   1.137   8.511  -1.301
   40    H    LYS   7           H        LYS   7   0.509   8.783  -3.947
   41    HA   LYS   7           HA       LYS   7  -0.166   6.153  -3.172
   42    HB2  LYS   7           2HB      LYS   7  -1.629   8.105  -4.977
   43    HB3  LYS   7           1HB      LYS   7  -2.310   6.583  -4.416
   44    HG2  LYS   7           2HG      LYS   7  -1.987   7.444  -2.043
   45    HG3  LYS   7           1HG      LYS   7  -1.597   9.013  -2.757
   46    HD2  LYS   7           2HD      LYS   7  -4.208   7.479  -3.013
   47    HD3  LYS   7           1HD      LYS   7  -3.948   8.987  -2.139
   48    HE2  LYS   7           2HE      LYS   7  -3.524  10.159  -4.253
   49    HE3  LYS   7           1HE      LYS   7  -3.707   8.651  -5.151
   50    HZ1  LYS   7           3HZ      LYS   7  -5.994   8.536  -4.488
   51    HZ2  LYS   7           1HZ      LYS   7  -5.701  10.043  -5.188
   52    HZ3  LYS   7           2HZ      LYS   7  -5.845   9.906  -3.513
   53    H    GLU   8           H        GLU   8   0.315   7.558  -6.452
   54    HA   GLU   8           HA       GLU   8  -0.054   5.118  -7.838
   55    HB2  GLU   8           2HB      GLU   8   0.905   6.185  -9.796
   56    HB3  GLU   8           1HB      GLU   8  -0.133   7.340  -8.972
   57    HG2  GLU   8           2HG      GLU   8   1.806   8.473  -8.031
   58    HG3  GLU   8           1HG      GLU   8   2.888   7.282  -8.748
   59    H    LYS   9           H        LYS   9   2.776   6.576  -6.301
   60    HA   LYS   9           HA       LYS   9   4.702   4.738  -7.326
   61    HB2  LYS   9           2HB      LYS   9   4.843   6.498  -4.857
   62    HB3  LYS   9           1HB      LYS   9   6.199   5.594  -5.526
   63    HG2  LYS   9           2HG      LYS   9   5.946   6.908  -7.651
   64    HG3  LYS   9           1HG      LYS   9   4.726   7.892  -6.842
   65    HD2  LYS   9           2HD      LYS   9   7.672   7.647  -6.153
   66    HD3  LYS   9           1HD      LYS   9   6.816   9.075  -6.731
   67    HE2  LYS   9           2HE      LYS   9   5.531   9.130  -4.602
   68    HE3  LYS   9           1HE      LYS   9   6.465   7.750  -4.015
   69    HZ1  LYS   9           3HZ      LYS   9   7.513  10.446  -4.710
   70    HZ2  LYS   9           1HZ      LYS   9   8.485   9.122  -4.294
   71    HZ3  LYS   9           2HZ      LYS   9   7.404   9.759  -3.165
   72    H    ILE  10           H        ILE  10   2.447   4.522  -4.652
   73    HA   ILE  10           HA       ILE  10   3.612   2.238  -3.386
   74    HB   ILE  10           HB       ILE  10   0.641   2.918  -3.606
   75   HG12  ILE  10          2HG1      ILE  10   1.764   4.794  -2.562
   76   HG13  ILE  10          1HG1      ILE  10   0.896   3.913  -1.315
   77   HG21  ILE  10          1HG2      ILE  10   0.375   1.534  -1.560
   78   HG22  ILE  10          2HG2      ILE  10   2.081   1.088  -1.658
   79   HG23  ILE  10          3HG2      ILE  10   0.964   0.598  -2.932
   80   HD11  ILE  10          3HD1      ILE  10   3.048   4.628  -0.496
   81   HD12  ILE  10          1HD1      ILE  10   3.870   3.832  -1.836
   82   HD13  ILE  10          2HD1      ILE  10   3.031   2.870  -0.611
   83    H    ARG  11           H        ARG  11   1.218   2.670  -5.959
   84    HA   ARG  11           HA       ARG  11   0.691  -0.095  -6.444
   85    HB2  ARG  11           2HB      ARG  11   0.280   2.208  -8.395
   86    HB3  ARG  11           1HB      ARG  11  -0.554   0.653  -8.399
   87    HG2  ARG  11           2HG      ARG  11  -0.785   2.848  -6.337
   88    HG3  ARG  11           1HG      ARG  11  -2.010   2.362  -7.509
   89    HD2  ARG  11           2HD      ARG  11  -0.952   0.463  -5.395
   90    HD3  ARG  11           1HD      ARG  11  -2.296   1.556  -5.106
   91    HE   ARG  11           HE       ARG  11  -2.832   0.097  -7.450
   92   HH11  ARG  11          1HH1      ARG  11  -2.587  -0.408  -3.998
   93   HH12  ARG  11          2HH1      ARG  11  -3.711  -1.724  -3.983
   94   HH21  ARG  11          1HH2      ARG  11  -4.353  -1.598  -7.418
   95   HH22  ARG  11          2HH2      ARG  11  -4.716  -2.400  -5.921
   96    H    ARG  12           H        ARG  12   2.963   2.201  -7.773
   97    HA   ARG  12           HA       ARG  12   4.016   0.572  -9.841
   98    HB2  ARG  12           2HB      ARG  12   5.266   2.880  -8.301
   99    HB3  ARG  12           1HB      ARG  12   6.035   2.105  -9.676
  100    HG2  ARG  12           2HG      ARG  12   3.467   3.708  -9.657
  101    HG3  ARG  12           1HG      ARG  12   4.992   4.147 -10.420
  102    HD2  ARG  12           2HD      ARG  12   3.248   1.802 -11.225
  103    HD3  ARG  12           1HD      ARG  12   3.280   3.368 -12.042
  104    HE   ARG  12           HE       ARG  12   5.896   2.262 -11.908
  105   HH11  ARG  12          1HH1      ARG  12   2.879   1.861 -13.671
  106   HH12  ARG  12          2HH1      ARG  12   3.648   1.201 -15.075
  107   HH21  ARG  12          1HH2      ARG  12   6.874   1.349 -13.738
  108   HH22  ARG  12          2HH2      ARG  12   5.909   0.914 -15.108
  109    H    TYR  13           H        TYR  13   5.289   1.367  -6.616
  110    HA   TYR  13           HA       TYR  13   7.485  -0.276  -6.478
  111    HB2  TYR  13           2HB      TYR  13   6.999   1.368  -4.763
  112    HB3  TYR  13           1HB      TYR  13   5.549   0.510  -4.278
  113    HD1  TYR  13           HD1      TYR  13   9.241  -0.168  -4.630
  114    HD2  TYR  13           HD2      TYR  13   5.723  -0.733  -2.276
  115    HE1  TYR  13           HE1      TYR  13  10.576  -1.304  -2.910
  116    HE2  TYR  13           HE2      TYR  13   7.057  -1.872  -0.556
  117    HH   TYR  13           HH       TYR  13  10.431  -1.765  -0.464
  118    H    ILE  14           H        ILE  14   4.152  -1.216  -5.781
  119    HA   ILE  14           HA       ILE  14   4.594  -3.865  -4.906
  120    HB   ILE  14           HB       ILE  14   2.162  -2.686  -6.330
  121   HG12  ILE  14          2HG1      ILE  14   2.594  -3.167  -3.342
  122   HG13  ILE  14          1HG1      ILE  14   2.833  -1.609  -4.118
  123   HG21  ILE  14          1HG2      ILE  14   0.909  -4.617  -5.368
  124   HG22  ILE  14          2HG2      ILE  14   2.433  -5.291  -4.774
  125   HG23  ILE  14          3HG2      ILE  14   2.145  -5.131  -6.508
  126   HD11  ILE  14          3HD1      ILE  14   0.708  -1.675  -3.022
  127   HD12  ILE  14          1HD1      ILE  14   0.246  -3.130  -3.900
  128   HD13  ILE  14          2HD1      ILE  14   0.454  -1.603  -4.766
  129    H    MET  15           H        MET  15   3.618  -2.682  -8.170
  130    HA   MET  15           HA       MET  15   3.964  -5.113  -9.538
  131    HB2  MET  15           2HB      MET  15   3.725  -2.211 -10.319
  132    HB3  MET  15           1HB      MET  15   4.281  -3.339 -11.555
  133    HG2  MET  15           2HG      MET  15   1.722  -3.599  -9.964
  134    HG3  MET  15           1HG      MET  15   1.858  -3.062 -11.641
  135    HE1  MET  15           3HE      MET  15   0.374  -6.768 -11.912
  136    HE2  MET  15           1HE      MET  15   0.055  -5.069 -12.263
  137    HE3  MET  15           2HE      MET  15   0.052  -5.642 -10.591
  138    H    GLU  16           H        GLU  16   6.208  -2.325  -9.580
  139    HA   GLU  16           HA       GLU  16   8.256  -3.263 -11.087
  140    HB2  GLU  16           2HB      GLU  16   8.601  -1.469  -8.658
  141    HB3  GLU  16           1HB      GLU  16   9.710  -1.604 -10.018
  142    HG2  GLU  16           2HG      GLU  16   6.935  -0.407 -10.014
  143    HG3  GLU  16           1HG      GLU  16   8.460   0.434 -10.227
  144    H    ASP  17           H        ASP  17   7.978  -3.588  -7.547
  145    HA   ASP  17           HA       ASP  17  10.493  -5.137  -7.470
  146    HB2  ASP  17           2HB      ASP  17   9.000  -3.678  -5.257
  147    HB3  ASP  17           1HB      ASP  17  10.450  -4.644  -5.006
  148    H    LEU  18           H        LEU  18   7.248  -5.174  -5.922
  149    HA   LEU  18           HA       LEU  18   7.765  -7.687  -4.637
  150    HB2  LEU  18           2HB      LEU  18   5.232  -6.042  -4.835
  151    HB3  LEU  18           1HB      LEU  18   5.328  -7.537  -3.933
  152    HG   LEU  18           HG       LEU  18   5.593  -5.861  -2.290
  153   HD11  LEU  18          1HD1      LEU  18   7.304  -7.633  -2.028
  154   HD12  LEU  18          2HD1      LEU  18   7.848  -6.090  -1.383
  155   HD13  LEU  18          3HD1      LEU  18   8.462  -6.652  -2.938
  156   HD21  LEU  18          3HD2      LEU  18   7.085  -3.931  -2.412
  157   HD22  LEU  18          1HD2      LEU  18   5.930  -3.917  -3.739
  158   HD23  LEU  18          2HD2      LEU  18   7.601  -4.403  -4.032
  159    H    ILE  19           H        ILE  19   5.984  -6.839  -7.560
  160    HA   ILE  19           HA       ILE  19   5.369  -9.633  -8.152
  161    HB   ILE  19           HB       ILE  19   4.983  -7.058  -9.737
  162   HG12  ILE  19          2HG1      ILE  19   2.585  -7.654  -9.723
  163   HG13  ILE  19          1HG1      ILE  19   2.946  -9.148  -8.889
  164   HG21  ILE  19          1HG2      ILE  19   4.007  -8.372 -11.604
  165   HG22  ILE  19          2HG2      ILE  19   4.519  -9.862 -10.806
  166   HG23  ILE  19          3HG2      ILE  19   5.725  -8.707 -11.382
  167   HD11  ILE  19          3HD1      ILE  19   3.258  -6.381  -7.784
  168   HD12  ILE  19          1HD1      ILE  19   3.633  -7.878  -6.928
  169   HD13  ILE  19          2HD1      ILE  19   1.974  -7.532  -7.412
  170    H    GLY  20           H        GLY  20   7.403  -7.075  -9.586
  171    HA2  GLY  20           2HA      GLY  20   9.829  -7.742  -9.948
  172    HA3  GLY  20           1HA      GLY  20   9.174  -9.125 -10.820
  173    HA   PRO  21           HA       PRO  21   9.922  -5.460 -13.751
  174    HB2  PRO  21           2HB      PRO  21  11.548  -6.780 -15.546
  175    HB3  PRO  21           1HB      PRO  21  12.173  -5.984 -14.089
  176    HG2  PRO  21           2HG      PRO  21  11.557  -8.889 -14.520
  177    HG3  PRO  21           1HG      PRO  21  12.981  -8.135 -13.763
  178    HD2  PRO  21           2HD      PRO  21  10.974  -9.162 -12.265
  179    HD3  PRO  21           1HD      PRO  21  11.877  -7.714 -11.759
  180    H    SER  22           H        SER  22   8.872  -8.769 -14.104
  181    HA   SER  22           HA       SER  22   7.562  -8.373 -16.694
  182    HB2  SER  22           2HB      SER  22   7.498 -10.765 -14.809
  183    HB3  SER  22           1HB      SER  22   6.959 -10.737 -16.491
  184    HG   SER  22           HG       SER  22   9.393  -9.847 -16.564
  185    H    ALA  23           H        ALA  23   6.752  -6.728 -14.379
  186    HA   ALA  23           HA       ALA  23   4.283  -7.471 -13.242
  187    HB1  ALA  23           3HB      ALA  23   5.402  -4.716 -13.846
  188    HB2  ALA  23           1HB      ALA  23   5.690  -5.657 -12.378
  189    HB3  ALA  23           2HB      ALA  23   4.065  -5.075 -12.748
  190    H    LYS  24           H        LYS  24   2.539  -7.973 -14.418
  191    HA   LYS  24           HA       LYS  24   1.898  -6.861 -16.977
  192    HB2  LYS  24           2HB      LYS  24   0.178  -8.486 -15.056
  193    HB3  LYS  24           1HB      LYS  24  -0.271  -8.074 -16.711
  194    HG2  LYS  24           2HG      LYS  24   1.784  -9.329 -17.487
  195    HG3  LYS  24           1HG      LYS  24   2.010  -9.869 -15.821
  196    HD2  LYS  24           2HD      LYS  24  -0.390 -10.441 -17.600
  197    HD3  LYS  24           1HD      LYS  24   0.866 -11.588 -17.143
  198    HE2  LYS  24           2HE      LYS  24   0.153 -11.401 -14.779
  199    HE3  LYS  24           1HE      LYS  24  -1.126 -10.283 -15.259
  200    HZ1  LYS  24           3HZ      LYS  24  -0.864 -13.109 -16.134
  201    HZ2  LYS  24           1HZ      LYS  24  -2.076 -12.039 -16.626
  202    HZ3  LYS  24           2HZ      LYS  24  -1.969 -12.508 -15.009
  203    H    GLU  25           H        GLU  25   2.028  -4.691 -16.573
  204    HA   GLU  25           HA       GLU  25   0.711  -3.109 -14.680
  205    HB2  GLU  25           2HB      GLU  25   1.202  -1.249 -16.297
  206    HB3  GLU  25           1HB      GLU  25   2.571  -2.297 -15.982
  207    HG2  GLU  25           2HG      GLU  25   1.947  -3.561 -18.122
  208    HG3  GLU  25           1HG      GLU  25   0.852  -2.222 -18.462
  209    H    ASP  26           H        ASP  26  -0.438  -4.563 -17.584
  210    HA   ASP  26           HA       ASP  26  -2.656  -3.027 -18.264
  211    HB2  ASP  26           2HB      ASP  26  -2.343  -6.055 -18.492
  212    HB3  ASP  26           1HB      ASP  26  -3.492  -5.071 -19.396
  213    H    GLU  27           H        GLU  27  -2.097  -5.126 -15.635
  214    HA   GLU  27           HA       GLU  27  -4.912  -5.579 -14.932
  215    HB2  GLU  27           2HB      GLU  27  -2.381  -6.577 -13.571
  216    HB3  GLU  27           1HB      GLU  27  -4.007  -7.211 -13.390
  217    HG2  GLU  27           2HG      GLU  27  -2.261  -7.400 -15.860
  218    HG3  GLU  27           1HG      GLU  27  -2.650  -8.707 -14.744
  219    H    LEU  28           H        LEU  28  -2.415  -3.394 -14.200
  220    HA   LEU  28           HA       LEU  28  -2.932  -3.034 -11.388
  221    HB2  LEU  28           2HB      LEU  28  -0.661  -2.945 -12.479
  222    HB3  LEU  28           1HB      LEU  28  -1.125  -1.451 -13.259
  223    HG   LEU  28           HG       LEU  28   0.378  -1.241 -11.209
  224   HD11  LEU  28          1HD1      LEU  28  -0.679   0.754 -10.281
  225   HD12  LEU  28          2HD1      LEU  28  -2.224   0.304 -11.001
  226   HD13  LEU  28          3HD1      LEU  28  -0.857   0.732 -12.032
  227   HD21  LEU  28          3HD2      LEU  28  -2.132  -1.968  -9.652
  228   HD22  LEU  28          1HD2      LEU  28  -0.606  -1.403  -8.969
  229   HD23  LEU  28          2HD2      LEU  28  -0.677  -2.961  -9.788
  230    H    ASP  29           H        ASP  29  -4.582  -1.850 -10.682
  231    HA   ASP  29           HA       ASP  29  -4.828   0.936 -11.576
  232    HB2  ASP  29           2HB      ASP  29  -7.067  -1.073 -11.448
  233    HB3  ASP  29           1HB      ASP  29  -7.417   0.491 -10.732
  234    H    ASP  30           H        ASP  30  -6.274   2.070  -9.802
  235    HA   ASP  30           HA       ASP  30  -4.890   1.812  -7.286
  236    HB2  ASP  30           2HB      ASP  30  -6.175   3.745  -6.582
  237    HB3  ASP  30           1HB      ASP  30  -5.616   4.023  -8.223
  238    H    GLN  31           H        GLN  31  -8.158   1.140  -8.483
  239    HA   GLN  31           HA       GLN  31  -9.212   0.249  -5.952
  240    HB2  GLN  31           2HB      GLN  31 -10.340  -0.054  -8.762
  241    HB3  GLN  31           1HB      GLN  31 -11.219  -0.396  -7.274
  242    HG2  GLN  31           2HG      GLN  31 -11.046   1.988  -6.639
  243    HG3  GLN  31           1HG      GLN  31 -10.199   2.325  -8.150
  244   HE21  GLN  31          1HE2      GLN  31 -11.773   3.727  -8.955
  245   HE22  GLN  31          2HE2      GLN  31 -13.357   3.205  -9.412
  246    H    THR  32           H        THR  32  -7.277  -1.245  -8.357
  247    HA   THR  32           HA       THR  32  -8.250  -3.833  -8.495
  248    HB   THR  32           HB       THR  32  -5.372  -2.899  -8.602
  249    HG1  THR  32           HG1      THR  32  -6.143  -3.734 -10.933
  250   HG21  THR  32          3HG2      THR  32  -4.919  -5.115  -9.705
  251   HG22  THR  32          1HG2      THR  32  -6.536  -5.650  -9.227
  252   HG23  THR  32          2HG2      THR  32  -5.329  -5.268  -7.995
  253    HA   PRO  33           HA       PRO  33  -7.783  -4.775  -4.101
  254    HB2  PRO  33           2HB      PRO  33  -9.123  -7.147  -4.115
  255    HB3  PRO  33           1HB      PRO  33  -9.954  -5.594  -4.294
  256    HG2  PRO  33           2HG      PRO  33  -9.171  -7.549  -6.422
  257    HG3  PRO  33           1HG      PRO  33 -10.705  -6.680  -6.211
  258    HD2  PRO  33           2HD      PRO  33  -8.776  -5.865  -7.949
  259    HD3  PRO  33           1HD      PRO  33  -9.887  -4.733  -7.146
  260    H    LEU  34           H        LEU  34  -5.722  -5.161  -3.691
  261    HA   LEU  34           HA       LEU  34  -3.941  -6.884  -4.974
  262    HB2  LEU  34           2HB      LEU  34  -3.769  -5.764  -2.158
  263    HB3  LEU  34           1HB      LEU  34  -2.422  -6.348  -3.124
  264    HG   LEU  34           HG       LEU  34  -4.103  -3.923  -3.866
  265   HD11  LEU  34          1HD1      LEU  34  -2.238  -2.546  -3.077
  266   HD12  LEU  34          2HD1      LEU  34  -1.398  -3.987  -2.495
  267   HD13  LEU  34          3HD1      LEU  34  -2.928  -3.493  -1.760
  268   HD21  LEU  34          3HD2      LEU  34  -2.260  -3.410  -5.424
  269   HD22  LEU  34          1HD2      LEU  34  -3.002  -4.962  -5.803
  270   HD23  LEU  34          2HD2      LEU  34  -1.445  -4.910  -4.970
  271    H    LEU  35           H        LEU  35  -5.456  -7.192  -1.760
  272    HA   LEU  35           HA       LEU  35  -4.531  -9.732  -1.022
  273    HB2  LEU  35           2HB      LEU  35  -7.140  -8.341  -0.342
  274    HB3  LEU  35           1HB      LEU  35  -6.577  -9.798   0.464
  275    HG   LEU  35           HG       LEU  35  -5.039  -7.173   0.503
  276   HD11  LEU  35          1HD1      LEU  35  -5.903  -6.867   2.769
  277   HD12  LEU  35          2HD1      LEU  35  -6.912  -8.305   2.595
  278   HD13  LEU  35          3HD1      LEU  35  -7.213  -6.881   1.591
  279   HD21  LEU  35          3HD2      LEU  35  -4.759  -9.683   2.202
  280   HD22  LEU  35          1HD2      LEU  35  -3.828  -8.192   2.390
  281   HD23  LEU  35          2HD2      LEU  35  -3.641  -9.168   0.935
  282    H    GLU  36           H        GLU  36  -7.459  -8.799  -2.774
  283    HA   GLU  36           HA       GLU  36  -8.689 -11.346  -2.867
  284    HB2  GLU  36           2HB      GLU  36  -9.797  -9.091  -3.225
  285    HB3  GLU  36           1HB      GLU  36  -9.055  -9.050  -4.815
  286    HG2  GLU  36           2HG      GLU  36 -11.336  -9.715  -5.061
  287    HG3  GLU  36           1HG      GLU  36 -10.320 -11.107  -5.422
  288    H    TRP  37           H        TRP  37  -6.281  -9.777  -4.871
  289    HA   TRP  37           HA       TRP  37  -6.465 -11.799  -7.019
  290    HB2  TRP  37           2HB      TRP  37  -4.917  -9.203  -6.700
  291    HB3  TRP  37           1HB      TRP  37  -4.596 -10.314  -8.026
  292    HD1  TRP  37           HD1      TRP  37  -8.215  -9.565  -6.899
  293    HE1  TRP  37           HE1      TRP  37  -9.414  -8.313  -8.789
  294    HE3  TRP  37           HE3      TRP  37  -4.247  -8.823 -10.016
  295    HZ2  TRP  37           HZ2      TRP  37  -8.779  -7.162 -11.278
  296    HZ3  TRP  37           HZ3      TRP  37  -4.627  -7.640 -12.129
  297    HH2  TRP  37           HH2      TRP  37  -6.842  -6.823 -12.757
  298    H    GLY  38           H        GLY  38  -5.068 -11.682  -4.050
  299    HA2  GLY  38           2HA      GLY  38  -3.522 -13.031  -3.023
  300    HA3  GLY  38           1HA      GLY  38  -3.290 -13.871  -4.547
  301    H    ILE  39           H        ILE  39  -2.853 -10.465  -4.616
  302    HA   ILE  39           HA       ILE  39  -0.132 -10.601  -5.452
  303    HB   ILE  39           HB       ILE  39  -1.909  -8.236  -4.693
  304   HG12  ILE  39          2HG1      ILE  39  -1.092  -9.276  -7.444
  305   HG13  ILE  39          1HG1      ILE  39  -2.667  -9.516  -6.702
  306   HG21  ILE  39          1HG2      ILE  39   0.810  -8.121  -6.034
  307   HG22  ILE  39          2HG2      ILE  39   0.432  -7.570  -4.400
  308   HG23  ILE  39          3HG2      ILE  39  -0.276  -6.752  -5.793
  309   HD11  ILE  39          3HD1      ILE  39  -2.786  -7.788  -8.366
  310   HD12  ILE  39          1HD1      ILE  39  -1.475  -6.893  -7.599
  311   HD13  ILE  39          2HD1      ILE  39  -3.027  -7.066  -6.774
  312    H    LEU  40           H        LEU  40  -1.806  -9.890  -2.468
  313    HA   LEU  40           HA       LEU  40   0.717  -9.411  -1.017
  314    HB2  LEU  40           2HB      LEU  40  -2.139  -8.997  -0.090
  315    HB3  LEU  40           1HB      LEU  40  -0.681  -8.546   0.780
  316    HG   LEU  40           HG       LEU  40  -1.740  -7.305  -1.774
  317   HD11  LEU  40          1HD1      LEU  40  -2.890  -6.573   0.234
  318   HD12  LEU  40          2HD1      LEU  40  -1.905  -5.267  -0.420
  319   HD13  LEU  40          3HD1      LEU  40  -1.351  -6.157   1.002
  320   HD21  LEU  40          3HD2      LEU  40   0.175  -5.756  -1.693
  321   HD22  LEU  40          1HD2      LEU  40   0.686  -7.418  -1.975
  322   HD23  LEU  40          2HD2      LEU  40   0.883  -6.693  -0.372
  323    H    ASN  41           H        ASN  41   1.444 -10.777   0.459
  324    HA   ASN  41           HA       ASN  41  -0.134 -12.651   1.921
  325    HB2  ASN  41           2HB      ASN  41  -0.007 -13.907  -0.209
  326    HB3  ASN  41           1HB      ASN  41   1.744 -13.775  -0.204
  327   HD21  ASN  41          1HD2      ASN  41   2.011 -16.026  -0.259
  328   HD22  ASN  41          2HD2      ASN  41   1.682 -17.035   1.103
  329    H    SER  42           H        SER  42   1.136 -10.829   3.069
  330    HA   SER  42           HA       SER  42   2.407 -10.352   4.840
  331    HB2  SER  42           3HB      SER  42   1.941 -12.645   5.582
  332    HB3  SER  42           2HB      SER  42   3.363 -13.222   4.707
  333    H    MET  43           H        MET  43   4.579 -12.486   2.957
  334    HA   MET  43           HA       MET  43   7.024 -11.476   3.525
  335    HB2  MET  43           2HB      MET  43   6.152 -12.251   0.713
  336    HB3  MET  43           1HB      MET  43   7.785 -12.338   1.360
  337    HG2  MET  43           2HG      MET  43   5.434 -14.065   2.194
  338    HG3  MET  43           1HG      MET  43   6.767 -14.551   1.156
  339    HE1  MET  43           3HE      MET  43   5.385 -14.620   4.674
  340    HE2  MET  43           1HE      MET  43   6.107 -13.017   4.807
  341    HE3  MET  43           2HE      MET  43   6.768 -14.367   5.738
  342    H    ASN  44           H        ASN  44   4.888 -10.275   1.048
  343    HA   ASN  44           HA       ASN  44   6.593  -8.071   0.229
  344    HB2  ASN  44           2HB      ASN  44   4.598  -7.681  -1.373
  345    HB3  ASN  44           1HB      ASN  44   5.513  -9.169  -1.569
  346   HD21  ASN  44          1HD2      ASN  44   3.970 -10.504  -2.405
  347   HD22  ASN  44          2HD2      ASN  44   2.468 -10.887  -1.640
  348    H    ILE  45           H        ILE  45   3.742  -8.560   2.190
  349    HA   ILE  45           HA       ILE  45   2.649  -5.971   2.311
  350    HB   ILE  45           HB       ILE  45   2.484  -8.495   3.922
  351   HG12  ILE  45          2HG1      ILE  45   0.343  -6.720   2.701
  352   HG13  ILE  45          1HG1      ILE  45   1.078  -8.111   1.909
  353   HG21  ILE  45          1HG2      ILE  45   0.992  -7.564   5.646
  354   HG22  ILE  45          2HG2      ILE  45   1.333  -5.935   5.051
  355   HG23  ILE  45          3HG2      ILE  45   2.629  -6.910   5.758
  356   HD11  ILE  45          3HD1      ILE  45  -1.089  -8.664   2.765
  357   HD12  ILE  45          1HD1      ILE  45  -0.626  -8.144   4.385
  358   HD13  ILE  45          2HD1      ILE  45   0.147  -9.561   3.657
  359    H    VAL  46           H        VAL  46   5.231  -7.497   4.123
  360    HA   VAL  46           HA       VAL  46   5.453  -5.505   6.162
  361    HB   VAL  46           HB       VAL  46   7.512  -7.591   5.350
  362   HG11  VAL  46          1HG1      VAL  46   8.292  -7.397   7.691
  363   HG12  VAL  46          2HG1      VAL  46   7.082  -6.144   7.990
  364   HG13  VAL  46          3HG1      VAL  46   8.402  -5.847   6.856
  365   HG21  VAL  46          3HG2      VAL  46   6.510  -9.061   7.041
  366   HG22  VAL  46          1HG2      VAL  46   5.318  -8.644   5.812
  367   HG23  VAL  46          2HG2      VAL  46   5.267  -7.857   7.386
  368    H    LYS  47           H        LYS  47   6.618  -5.802   2.926
  369    HA   LYS  47           HA       LYS  47   8.631  -3.747   3.028
  370    HB2  LYS  47           2HB      LYS  47   7.196  -5.121   0.736
  371    HB3  LYS  47           1HB      LYS  47   8.218  -3.724   0.437
  372    HG2  LYS  47           2HG      LYS  47   9.431  -5.813   0.024
  373    HG3  LYS  47           1HG      LYS  47  10.156  -4.887   1.343
  374    HD2  LYS  47           2HD      LYS  47   9.075  -6.345   2.990
  375    HD3  LYS  47           1HD      LYS  47   8.286  -7.247   1.696
  376    HE2  LYS  47           2HE      LYS  47  10.397  -8.105   0.920
  377    HE3  LYS  47           1HE      LYS  47  11.295  -7.061   2.032
  378    HZ1  LYS  47           3HZ      LYS  47  11.143  -9.310   2.874
  379    HZ2  LYS  47           1HZ      LYS  47   9.457  -9.259   2.800
  380    HZ3  LYS  47           2HZ      LYS  47  10.280  -8.262   3.882
  381    H    LEU  48           H        LEU  48   5.139  -3.848   2.357
  382    HA   LEU  48           HA       LEU  48   4.829  -1.128   1.606
  383    HB2  LEU  48           2HB      LEU  48   2.895  -3.105   2.857
  384    HB3  LEU  48           1HB      LEU  48   2.426  -1.431   2.615
  385    HG   LEU  48           HG       LEU  48   1.552  -2.752   0.785
  386   HD11  LEU  48          1HD1      LEU  48   2.485  -1.571  -1.170
  387   HD12  LEU  48          2HD1      LEU  48   3.882  -1.067  -0.218
  388   HD13  LEU  48          3HD1      LEU  48   2.269  -0.478   0.194
  389   HD21  LEU  48          3HD2      LEU  48   2.939  -4.013  -0.798
  390   HD22  LEU  48          1HD2      LEU  48   3.102  -4.661   0.832
  391   HD23  LEU  48          2HD2      LEU  48   4.384  -3.656   0.153
  392    H    MET  49           H        MET  49   4.943  -2.700   4.776
  393    HA   MET  49           HA       MET  49   4.179  -0.552   6.431
  394    HB2  MET  49           2HB      MET  49   6.251  -2.675   7.133
  395    HB3  MET  49           1HB      MET  49   5.336  -1.693   8.268
  396    HG2  MET  49           2HG      MET  49   3.286  -2.847   7.669
  397    HG3  MET  49           1HG      MET  49   4.149  -3.779   6.433
  398    HE1  MET  49           3HE      MET  49   3.909  -6.758   8.860
  399    HE2  MET  49           1HE      MET  49   3.862  -6.207   7.187
  400    HE3  MET  49           2HE      MET  49   2.641  -5.667   8.327
  401    H    VAL  50           H        VAL  50   7.437  -1.598   5.384
  402    HA   VAL  50           HA       VAL  50   8.800   0.574   6.699
  403    HB   VAL  50           HB       VAL  50   9.910  -1.613   6.443
  404   HG11  VAL  50          1HG1      VAL  50  10.825  -2.377   4.284
  405   HG12  VAL  50          2HG1      VAL  50  10.011  -1.043   3.458
  406   HG13  VAL  50          3HG1      VAL  50   9.063  -2.307   4.249
  407   HG21  VAL  50          3HG2      VAL  50  11.347   0.362   6.730
  408   HG22  VAL  50          1HG2      VAL  50  11.414   0.584   4.977
  409   HG23  VAL  50          2HG2      VAL  50  12.142  -0.842   5.717
  410    H    TYR  51           H        TYR  51   7.534   0.044   3.475
  411    HA   TYR  51           HA       TYR  51   9.098   1.913   2.014
  412    HB2  TYR  51           2HB      TYR  51   7.534   0.158   0.984
  413    HB3  TYR  51           1HB      TYR  51   6.191   1.199   1.405
  414    HD1  TYR  51           HD1      TYR  51   9.517   1.475  -0.357
  415    HD2  TYR  51           HD2      TYR  51   5.409   2.650  -0.302
  416    HE1  TYR  51           HE1      TYR  51   9.839   2.709  -2.456
  417    HE2  TYR  51           HE2      TYR  51   5.741   3.876  -2.405
  418    HH   TYR  51           HH       TYR  51   7.613   4.937  -3.644
  419    H    ILE  52           H        ILE  52   5.902   2.125   3.422
  420    HA   ILE  52           HA       ILE  52   5.382   4.864   2.859
  421    HB   ILE  52           HB       ILE  52   4.104   2.922   4.835
  422   HG12  ILE  52          2HG1      ILE  52   3.087   3.717   2.070
  423   HG13  ILE  52          1HG1      ILE  52   4.144   2.332   2.308
  424   HG21  ILE  52          1HG2      ILE  52   2.994   5.532   3.783
  425   HG22  ILE  52          2HG2      ILE  52   3.558   5.244   5.424
  426   HG23  ILE  52          3HG2      ILE  52   2.139   4.388   4.823
  427   HD11  ILE  52          3HD1      ILE  52   1.409   2.669   3.525
  428   HD12  ILE  52          1HD1      ILE  52   2.471   1.265   3.691
  429   HD13  ILE  52          2HD1      ILE  52   1.818   1.695   2.111
  430    H    ARG  53           H        ARG  53   6.681   3.134   5.629
  431    HA   ARG  53           HA       ARG  53   6.918   5.203   7.518
  432    HB2  ARG  53           2HB      ARG  53   7.183   2.882   8.144
  433    HB3  ARG  53           1HB      ARG  53   8.538   2.688   7.038
  434    HG2  ARG  53           2HG      ARG  53   9.909   4.196   8.437
  435    HG3  ARG  53           1HG      ARG  53   8.559   4.401   9.553
  436    HD2  ARG  53           2HD      ARG  53   8.647   2.049  10.167
  437    HD3  ARG  53           1HD      ARG  53   9.872   1.734   8.930
  438    HE   ARG  53           HE       ARG  53  11.093   3.593  10.395
  439   HH11  ARG  53          1HH1      ARG  53   9.421   0.682  11.415
  440   HH12  ARG  53          2HH1      ARG  53  10.405   0.465  12.830
  441   HH21  ARG  53          1HH2      ARG  53  12.397   3.310  12.192
  442   HH22  ARG  53          2HH2      ARG  53  12.116   1.977  13.270
  443    H    ASP  54           H        ASP  54   8.931   4.343   4.765
  444    HA   ASP  54           HA       ASP  54  11.065   6.228   5.471
  445    HB2  ASP  54           2HB      ASP  54  11.727   4.053   4.564
  446    HB3  ASP  54           1HB      ASP  54  10.723   4.294   3.142
  447    H    GLU  55           H        GLU  55   8.402   5.944   3.203
  448    HA   GLU  55           HA       GLU  55   9.359   7.986   1.376
  449    HB2  GLU  55           2HB      GLU  55   8.147   5.908   0.627
  450    HB3  GLU  55           1HB      GLU  55   6.694   6.505   1.413
  451    HG2  GLU  55           2HG      GLU  55   6.592   6.878  -0.984
  452    HG3  GLU  55           1HG      GLU  55   6.634   8.417  -0.130
  453    H    MET  56           H        MET  56   6.240   7.635   3.125
  454    HA   MET  56           HA       MET  56   5.867  10.539   3.164
  455    HB2  MET  56           2HB      MET  56   4.061   8.215   3.921
  456    HB3  MET  56           1HB      MET  56   3.620   9.889   4.259
  457    HG2  MET  56           2HG      MET  56   2.555   9.184   2.218
  458    HG3  MET  56           1HG      MET  56   3.774  10.397   1.848
  459    HE1  MET  56           3HE      MET  56   4.000   5.931   0.723
  460    HE2  MET  56           1HE      MET  56   2.560   6.751   1.330
  461    HE3  MET  56           2HE      MET  56   3.915   6.423   2.413
  462    H    GLY  57           H        GLY  57   7.167   8.150   5.198
  463    HA2  GLY  57           2HA      GLY  57   8.164   8.346   7.261
  464    HA3  GLY  57           1HA      GLY  57   7.670  10.032   7.322
  465    H    VAL  58           H        VAL  58   5.547   7.213   6.896
  466    HA   VAL  58           HA       VAL  58   4.676   7.356   9.717
  467    HB   VAL  58           HB       VAL  58   3.053   8.794   8.594
  468   HG11  VAL  58          1HG1      VAL  58   3.334   8.079   6.267
  469   HG12  VAL  58          2HG1      VAL  58   1.626   8.040   6.720
  470   HG13  VAL  58          3HG1      VAL  58   2.551   6.537   6.632
  471   HG21  VAL  58          3HG2      VAL  58   1.810   6.082   9.119
  472   HG22  VAL  58          1HG2      VAL  58   0.946   7.623   9.099
  473   HG23  VAL  58          2HG2      VAL  58   2.167   7.308  10.336
  474    H    SER  59           H        SER  59   4.480   5.314  10.562
  475    HA   SER  59           HA       SER  59   4.973   3.040   8.755
  476    HB2  SER  59           2HB      SER  59   6.574   3.444  10.613
  477    HB3  SER  59           1HB      SER  59   5.259   3.271  11.780
  478    HG   SER  59           HG       SER  59   6.239   1.303   9.985
  479    H    ILE  60           H        ILE  60   3.609   1.260   8.670
  480    HA   ILE  60           HA       ILE  60   1.028   1.307  10.030
  481    HB   ILE  60           HB       ILE  60   2.186  -0.847   8.204
  482   HG12  ILE  60          2HG1      ILE  60   1.720   1.400   7.065
  483   HG13  ILE  60          1HG1      ILE  60   0.852   0.022   6.398
  484   HG21  ILE  60          1HG2      ILE  60   0.522  -1.783   9.720
  485   HG22  ILE  60          2HG2      ILE  60  -0.158  -1.690   8.099
  486   HG23  ILE  60          3HG2      ILE  60  -0.630  -0.506   9.318
  487   HD11  ILE  60          3HD1      ILE  60  -1.179   0.698   7.580
  488   HD12  ILE  60          1HD1      ILE  60  -0.570   2.003   6.561
  489   HD13  ILE  60          2HD1      ILE  60  -0.313   2.058   8.303
  490    HA   PRO  61           HA       PRO  61   2.948  -1.263  13.327
  491    HB2  PRO  61           2HB      PRO  61   0.912  -1.012  15.128
  492    HB3  PRO  61           1HB      PRO  61   2.042   0.320  14.807
  493    HG2  PRO  61           2HG      PRO  61  -0.722  -0.096  13.710
  494    HG3  PRO  61           1HG      PRO  61   0.008   1.376  14.392
  495    HD2  PRO  61           2HD      PRO  61  -0.164   0.920  11.713
  496    HD3  PRO  61           1HD      PRO  61   1.148   1.873  12.441
  497    H    SER  62           H        SER  62   2.232  -3.261  14.528
  498    HA   SER  62           HA       SER  62   1.137  -5.181  12.744
  499    HB2  SER  62           2HB      SER  62   1.380  -6.754  14.715
  500    HB3  SER  62           1HB      SER  62   2.846  -5.871  14.292
  501    HG   SER  62           HG       SER  62   2.183  -5.962  16.601
  502    H    THR  63           H        THR  63  -0.276  -3.275  15.311
  503    HA   THR  63           HA       THR  63  -2.685  -4.779  15.658
  504    HB   THR  63           HB       THR  63  -1.777  -3.178  17.349
  505    HG1  THR  63           HG1      THR  63  -3.779  -2.559  18.033
  506   HG21  THR  63          3HG2      THR  63  -2.816  -1.009  15.494
  507   HG22  THR  63          1HG2      THR  63  -1.114  -1.333  15.846
  508   HG23  THR  63          2HG2      THR  63  -2.191  -0.774  17.127
  509    H    HIS  64           H        HIS  64  -1.556  -2.856  13.115
  510    HA   HIS  64           HA       HIS  64  -4.263  -2.460  11.979
  511    HB2  HIS  64           2HB      HIS  64  -1.741  -0.808  11.648
  512    HB3  HIS  64           1HB      HIS  64  -3.098  -0.688  10.528
  513    HD1  HIS  64           HD1      HIS  64  -4.663  -1.181  13.701
  514    HD2  HIS  64           HD2      HIS  64  -2.773   2.029  11.853
  515    HE1  HIS  64           HE1      HIS  64  -5.496   0.859  14.889
  516    HE2  HIS  64           HE2      HIS  64  -4.508   2.794  13.612
  517    H    ILE  65           H        ILE  65  -2.099  -4.760  11.848
  518    HA   ILE  65           HA       ILE  65  -1.988  -5.007   8.924
  519    HB   ILE  65           HB       ILE  65  -1.050  -6.967  11.063
  520   HG12  ILE  65          2HG1      ILE  65   0.306  -4.966  11.167
  521   HG13  ILE  65          1HG1      ILE  65   1.255  -6.193  10.336
  522   HG21  ILE  65          1HG2      ILE  65  -1.597  -8.128   8.961
  523   HG22  ILE  65          2HG2      ILE  65   0.146  -8.125   9.234
  524   HG23  ILE  65          3HG2      ILE  65  -0.566  -7.018   8.056
  525   HD11  ILE  65          3HD1      ILE  65   0.723  -5.155   8.187
  526   HD12  ILE  65          1HD1      ILE  65   1.485  -4.008   9.297
  527   HD13  ILE  65          2HD1      ILE  65  -0.254  -3.936   9.014
  528    H    THR  66           H        THR  66  -4.065  -5.097   8.346
  529    HA   THR  66           HA       THR  66  -5.458  -7.589   8.734
  530    HB   THR  66           HB       THR  66  -6.233  -6.311  10.690
  531    HG1  THR  66           HG1      THR  66  -7.736  -7.685   9.755
  532   HG21  THR  66          3HG2      THR  66  -7.542  -4.254  10.474
  533   HG22  THR  66          1HG2      THR  66  -7.258  -4.245   8.721
  534   HG23  THR  66          2HG2      THR  66  -5.913  -4.028   9.841
  535    H    GLY  67           H        GLY  67  -7.525  -7.570   7.387
  536    HA2  GLY  67           2HA      GLY  67  -6.732  -7.225   4.731
  537    HA3  GLY  67           1HA      GLY  67  -8.342  -7.662   5.266
  538    H    LYS  68           H        LYS  68  -9.085  -5.331   6.626
  539    HA   LYS  68           HA       LYS  68 -10.214  -3.845   4.545
  540    HB2  LYS  68           2HB      LYS  68 -10.995  -2.282   6.287
  541    HB3  LYS  68           1HB      LYS  68 -11.250  -3.963   6.741
  542    HG2  LYS  68           2HG      LYS  68  -9.472  -3.926   8.334
  543    HG3  LYS  68           1HG      LYS  68  -8.836  -2.403   7.709
  544    HD2  LYS  68           2HD      LYS  68  -9.987  -2.038   9.848
  545    HD3  LYS  68           1HD      LYS  68 -10.837  -1.213   8.540
  546    HE2  LYS  68           2HE      LYS  68 -12.376  -2.331  10.116
  547    HE3  LYS  68           1HE      LYS  68 -12.518  -2.978   8.481
  548    HZ1  LYS  68           3HZ      LYS  68 -11.183  -4.858   9.126
  549    HZ2  LYS  68           1HZ      LYS  68 -12.496  -4.712  10.174
  550    HZ3  LYS  68           2HZ      LYS  68 -10.958  -4.228  10.679
  551    H    TYR  69           H        TYR  69  -7.150  -3.394   6.139
  552    HA   TYR  69           HA       TYR  69  -6.857  -0.608   5.273
  553    HB2  TYR  69           2HB      TYR  69  -5.084  -2.379   6.990
  554    HB3  TYR  69           1HB      TYR  69  -4.685  -0.718   6.552
  555    HD1  TYR  69           HD2      TYR  69  -7.757   0.223   6.868
  556    HD2  TYR  69           HD1      TYR  69  -5.004  -1.849   9.399
  557    HE1  TYR  69           HE2      TYR  69  -8.946   1.046   8.840
  558    HE2  TYR  69           HE1      TYR  69  -6.198  -1.006  11.368
  559    HH   TYR  69           HH       TYR  69  -9.253   0.472  11.186
  560    H    PHE  70           H        PHE  70  -5.925  -3.766   4.232
  561    HA   PHE  70           HA       PHE  70  -3.903  -2.623   2.357
  562    HB2  PHE  70           2HB      PHE  70  -3.929  -5.322   3.759
  563    HB3  PHE  70           1HB      PHE  70  -2.892  -4.986   2.386
  564    HD1  PHE  70           HD1      PHE  70  -0.996  -3.424   2.579
  565    HD2  PHE  70           HD2      PHE  70  -3.441  -4.334   5.970
  566    HE1  PHE  70           HE1      PHE  70   0.714  -2.480   4.071
  567    HE2  PHE  70           HE2      PHE  70  -1.726  -3.390   7.451
  568    HZ   PHE  70           HZ       PHE  70   0.355  -2.459   6.507
  569    H    LYS  71           H        LYS  71  -6.953  -3.287   2.126
  570    HA   LYS  71           HA       LYS  71  -7.423  -5.320   0.297
  571    HB2  LYS  71           2HB      LYS  71  -8.693  -2.577   0.391
  572    HB3  LYS  71           1HB      LYS  71  -9.278  -3.876  -0.639
  573    HG2  LYS  71           2HG      LYS  71  -9.903  -5.208   1.276
  574    HG3  LYS  71           1HG      LYS  71  -9.134  -4.057   2.380
  575    HD2  LYS  71           2HD      LYS  71 -11.598  -3.781   2.294
  576    HD3  LYS  71           1HD      LYS  71 -10.738  -2.329   1.782
  577    HE2  LYS  71           2HE      LYS  71 -11.125  -3.060  -0.618
  578    HE3  LYS  71           1HE      LYS  71 -12.142  -4.358   0.009
  579    HZ1  LYS  71           3HZ      LYS  71 -13.553  -2.645   1.034
  580    HZ2  LYS  71           1HZ      LYS  71 -13.477  -2.498  -0.649
  581    HZ3  LYS  71           2HZ      LYS  71 -12.590  -1.446   0.329
  582    H    ASP  72           H        ASP  72  -6.463  -1.984  -0.362
  583    HA   ASP  72           HA       ASP  72  -5.015  -2.452  -2.737
  584    HB2  ASP  72           2HB      ASP  72  -6.544  -1.402  -4.400
  585    HB3  ASP  72           1HB      ASP  72  -7.236  -2.878  -3.745
  586    H    LEU  73           H        LEU  73  -5.546   0.139  -3.953
  587    HA   LEU  73           HA       LEU  73  -3.752   1.669  -2.382
  588    HB2  LEU  73           2HB      LEU  73  -3.913   1.880  -4.851
  589    HB3  LEU  73           1HB      LEU  73  -5.480   2.644  -4.680
  590    HG   LEU  73           HG       LEU  73  -4.446   4.569  -3.506
  591   HD11  LEU  73          1HD1      LEU  73  -2.587   3.408  -2.375
  592   HD12  LEU  73          2HD1      LEU  73  -1.983   4.767  -3.315
  593   HD13  LEU  73          3HD1      LEU  73  -1.799   3.127  -3.932
  594   HD21  LEU  73          3HD2      LEU  73  -3.135   5.492  -5.414
  595   HD22  LEU  73          1HD2      LEU  73  -4.634   4.727  -5.930
  596   HD23  LEU  73          2HD2      LEU  73  -3.100   3.884  -6.143
  597    H    ASN  74           H        ASN  74  -7.215   1.870  -2.931
  598    HA   ASN  74           HA       ASN  74  -7.617   4.377  -1.613
  599    HB2  ASN  74           2HB      ASN  74  -9.622   2.160  -2.224
  600    HB3  ASN  74           1HB      ASN  74 -10.045   3.793  -1.715
  601   HD21  ASN  74          1HD2      ASN  74  -9.052   1.794  -4.347
  602   HD22  ASN  74          2HD2      ASN  74  -9.124   3.005  -5.575
  603    H    ALA  75           H        ALA  75  -7.774   0.997  -0.550
  604    HA   ALA  75           HA       ALA  75  -8.713   1.410   2.089
  605    HB1  ALA  75           3HB      ALA  75  -6.897  -0.770   1.005
  606    HB2  ALA  75           1HB      ALA  75  -8.666  -0.795   1.032
  607    HB3  ALA  75           2HB      ALA  75  -7.758  -0.828   2.543
  608    H    ILE  76           H        ILE  76  -5.392   1.045   0.861
  609    HA   ILE  76           HA       ILE  76  -3.999   1.627   3.258
  610    HB   ILE  76           HB       ILE  76  -3.099   1.749   0.347
  611   HG12  ILE  76          2HG1      ILE  76  -2.562  -0.289   2.547
  612   HG13  ILE  76          1HG1      ILE  76  -3.693  -0.519   1.217
  613   HG21  ILE  76          1HG2      ILE  76  -1.333   1.970   2.818
  614   HG22  ILE  76          2HG2      ILE  76  -1.666   3.271   1.677
  615   HG23  ILE  76          3HG2      ILE  76  -0.760   1.856   1.146
  616   HD11  ILE  76          3HD1      ILE  76  -0.697  -0.283   1.018
  617   HD12  ILE  76          1HD1      ILE  76  -1.799  -0.465  -0.353
  618   HD13  ILE  76          2HD1      ILE  76  -1.665  -1.751   0.851
  619    H    SER  77           H        SER  77  -5.399   3.684   0.795
  620    HA   SER  77           HA       SER  77  -3.985   6.074   1.460
  621    HB2  SER  77           2HB      SER  77  -5.152   5.777  -0.736
  622    HB3  SER  77           1HB      SER  77  -6.705   5.821   0.098
  623    HG   SER  77           HG       SER  77  -5.109   7.946   0.732
  624    H    ARG  78           H        ARG  78  -7.168   4.753   2.426
  625    HA   ARG  78           HA       ARG  78  -7.943   6.955   4.055
  626    HB2  ARG  78           2HB      ARG  78  -8.768   4.035   4.310
  627    HB3  ARG  78           1HB      ARG  78  -9.555   5.379   5.134
  628    HG2  ARG  78           2HG      ARG  78  -9.465   4.883   2.149
  629    HG3  ARG  78           1HG      ARG  78 -10.866   4.712   3.203
  630    HD2  ARG  78           2HD      ARG  78 -10.852   7.148   3.628
  631    HD3  ARG  78           1HD      ARG  78  -9.414   7.319   2.608
  632    HE   ARG  78           HE       ARG  78 -11.622   6.074   1.253
  633   HH11  ARG  78          1HH1      ARG  78 -10.226   9.177   2.112
  634   HH12  ARG  78          2HH1      ARG  78 -11.007  10.027   0.820
  635   HH21  ARG  78          1HH2      ARG  78 -12.627   7.187  -0.445
  636   HH22  ARG  78          2HH2      ARG  78 -12.376   8.893  -0.638
  637    H    THR  79           H        THR  79  -6.103   4.048   4.695
  638    HA   THR  79           HA       THR  79  -5.917   4.351   7.514
  639    HB   THR  79           HB       THR  79  -4.012   2.783   5.728
  640    HG1  THR  79           HG1      THR  79  -5.747   1.671   5.252
  641   HG21  THR  79          3HG2      THR  79  -3.278   2.941   8.093
  642   HG22  THR  79          1HG2      THR  79  -3.820   1.304   7.724
  643   HG23  THR  79          2HG2      THR  79  -4.870   2.393   8.630
  644    H    VAL  80           H        VAL  80  -3.739   5.180   4.843
  645    HA   VAL  80           HA       VAL  80  -1.545   5.879   6.527
  646    HB   VAL  80           HB       VAL  80  -1.392   5.023   4.121
  647   HG11  VAL  80          1HG1      VAL  80  -1.994   7.911   3.382
  648   HG12  VAL  80          2HG1      VAL  80  -3.018   6.508   3.050
  649   HG13  VAL  80          3HG1      VAL  80  -1.434   6.653   2.284
  650   HG21  VAL  80          3HG2      VAL  80   0.641   6.303   3.593
  651   HG22  VAL  80          1HG2      VAL  80   0.573   5.870   5.300
  652   HG23  VAL  80          2HG2      VAL  80   0.201   7.522   4.795
  653    H    GLU  81           H        GLU  81  -4.220   7.686   5.086
  654    HA   GLU  81           HA       GLU  81  -3.153  10.285   5.684
  655    HB2  GLU  81           2HB      GLU  81  -5.990   9.433   5.022
  656    HB3  GLU  81           1HB      GLU  81  -5.455  11.105   5.163
  657    HG2  GLU  81           2HG      GLU  81  -4.607   9.072   3.087
  658    HG3  GLU  81           1HG      GLU  81  -5.568  10.524   2.837
  659    H    GLN  82           H        GLN  82  -5.549   8.149   7.280
  660    HA   GLN  82           HA       GLN  82  -6.209   9.996   9.343
  661    HB2  GLN  82           2HB      GLN  82  -7.312   8.191  10.504
  662    HB3  GLN  82           1HB      GLN  82  -7.663   8.054   8.788
  663    HG2  GLN  82           2HG      GLN  82  -6.018   6.237   8.593
  664    HG3  GLN  82           1HG      GLN  82  -5.648   6.379  10.312
  665   HE21  GLN  82          1HE2      GLN  82  -6.655   4.071   8.818
  666   HE22  GLN  82          2HE2      GLN  82  -8.152   3.616   9.546
  667    H    LEU  83           H        LEU  83  -3.679   7.547   9.037
  668    HA   LEU  83           HA       LEU  83  -2.812   7.543  11.739
  669    HB2  LEU  83           2HB      LEU  83  -1.320   6.862   9.196
  670    HB3  LEU  83           1HB      LEU  83  -0.632   6.653  10.800
  671    HG   LEU  83           HG       LEU  83  -3.105   5.217   9.765
  672   HD11  LEU  83          1HD1      LEU  83  -0.282   4.196  10.218
  673   HD12  LEU  83          2HD1      LEU  83  -1.034   4.494   8.649
  674   HD13  LEU  83          3HD1      LEU  83  -1.672   3.231   9.700
  675   HD21  LEU  83          3HD2      LEU  83  -1.588   4.858  12.377
  676   HD22  LEU  83          1HD2      LEU  83  -2.930   3.856  11.808
  677   HD23  LEU  83          2HD2      LEU  83  -3.203   5.549  12.204
  678    H    LYS  84           H        LYS  84  -1.893   9.580   8.998
  679    HA   LYS  84           HA       LYS  84   0.133  11.028  10.411
  680    HB2  LYS  84           2HB      LYS  84  -1.557  11.853   8.025
  681    HB3  LYS  84           1HB      LYS  84  -0.188  12.780   8.633
  682    HG2  LYS  84           2HG      LYS  84   1.327  10.918   8.106
  683    HG3  LYS  84           1HG      LYS  84  -0.039   9.960   7.521
  684    HD2  LYS  84           2HD      LYS  84   0.993  12.568   6.341
  685    HD3  LYS  84           1HD      LYS  84   1.130  10.957   5.628
  686    HE2  LYS  84           2HE      LYS  84  -1.329  10.834   5.422
  687    HE3  LYS  84           1HE      LYS  84  -1.477  12.441   6.136
  688    HZ1  LYS  84           3HZ      LYS  84  -0.076  11.824   3.594
  689    HZ2  LYS  84           1HZ      LYS  84  -0.303  13.358   4.263
  690    HZ3  LYS  84           2HZ      LYS  84  -1.633  12.467   3.722
  691    H    ALA  85           H        ALA  85  -3.381  11.406  10.130
  692    HA   ALA  85           HA       ALA  85  -3.599  13.869  11.551
  693    HB1  ALA  85           3HB      ALA  85  -5.972  13.290  11.810
  694    HB2  ALA  85           1HB      ALA  85  -5.644  11.627  11.330
  695    HB3  ALA  85           2HB      ALA  85  -5.438  12.939  10.162
  696    H    GLU  86           H        GLU  86  -3.458  10.488  12.547
  697    HA   GLU  86           HA       GLU  86  -4.098  10.916  15.313
  698    HB2  GLU  86           2HB      GLU  86  -2.840   8.508  13.933
  699    HB3  GLU  86           1HB      GLU  86  -3.431   8.524  15.591
  700    HG2  GLU  86           2HG      GLU  86  -5.079   8.792  13.064
  701    HG3  GLU  86           1HG      GLU  86  -5.038   7.425  14.162
  702    H    SER  87           H        SER  87  -1.141  10.629  13.436
  703    HA   SER  87           HA       SER  87   0.577  10.361  15.792
  704    HB2  SER  87           2HB      SER  87   0.968   8.921  13.802
  705    HB3  SER  87           1HB      SER  87   1.291  10.353  12.825
  706    HG   SER  87           HG       SER  87   2.739   9.575  15.137
  707    H    ALA  88           H        ALA  88  -0.252  12.785  13.358
  708    HA   ALA  88           HA       ALA  88   1.839  14.635  14.394
  709    HB1  ALA  88           3HB      ALA  88   0.402  14.713  11.722
  710    HB2  ALA  88           1HB      ALA  88   2.032  14.098  12.000
  711    HB3  ALA  88           2HB      ALA  88   1.682  15.810  12.254
  712    H    LEU  89           H        LEU  89   1.207  16.969  14.127
  713    HA   LEU  89           HA       LEU  89  -1.112  17.466  15.762
  714    HB2  LEU  89           2HB      LEU  89  -0.317  19.665  16.029
  715    HB3  LEU  89           1HB      LEU  89   1.108  18.650  16.010
  716    HG   LEU  89           HG       LEU  89   0.165  20.368  13.667
  717   HD11  LEU  89          1HD1      LEU  89   0.913  21.726  15.580
  718   HD12  LEU  89          2HD1      LEU  89   2.039  21.845  14.229
  719   HD13  LEU  89          3HD1      LEU  89   2.437  20.833  15.621
  720   HD21  LEU  89          3HD2      LEU  89   1.468  18.414  12.910
  721   HD22  LEU  89          1HD2      LEU  89   2.771  18.844  14.026
  722   HD23  LEU  89          2HD2      LEU  89   2.373  19.907  12.674
  723    H    GLU  90           H        GLU  90  -0.796  17.091  12.476
  724    HA   GLU  90           HA       GLU  90  -2.343  19.193  11.375
  725    HB2  GLU  90           2HB      GLU  90  -1.811  16.385  10.301
  726    HB3  GLU  90           1HB      GLU  90  -2.435  17.729   9.349
  727    HG2  GLU  90           2HG      GLU  90   0.290  17.603  10.675
  728    HG3  GLU  90           1HG      GLU  90  -0.033  17.348   8.961
  729   H281  4EM 101          2H28      PYA 142   2.666 -11.192   9.101
  730   H283  4EM 101          3H28      PYA 142   2.853 -12.534  10.241
  731   H303  4EM 101          3H30      PYA 142   0.217 -12.160   7.595
  732   H301  4EM 101          1H30      PYA 142   0.380 -10.531   8.269
  733   H302  4EM 101          2H30      PYA 142  -1.029 -11.534   8.677
  734   H312  4EM 101          2H31      PYA 142   0.894 -10.223  10.667
  735   H313  4EM 101          3H31      PYA 142  -0.509 -11.195  11.102
  736   H311  4EM 101          1H31      PYA 142   1.080 -11.617  11.751
  737    H32  4EM 101           H32      PYA 142   0.592 -14.214   9.132
  738    H33  4EM 101           H33      PYA 142   0.538 -14.946  11.353
  739    H36  4EM 101           H36      PYA 142  -1.124 -13.324  12.133
  740   H373  4EM 101          3H37      PYA 142  -3.684 -13.886  10.730
  741   H372  4EM 101          2H37      PYA 142  -3.421 -13.903  12.480
  742   H382  4EM 101          2H38      PYA 142  -3.020 -11.355  10.912
  743   H383  4EM 101          3H38      PYA 142  -3.312 -11.556  12.637
  744    H41  4EM 101           H41      PYA 142  -4.552 -11.872   9.531
  745   H423  4EM 101          3H42      PYA 142  -6.753 -10.427   9.364
  746   H422  4EM 101          2H42      PYA 142  -7.379 -11.945  10.012
  747   H433  4EM 101          3H43      PYA 142  -7.411 -11.843   7.478
  748   H432  4EM 101          2H43      PYA 142  -6.426 -13.171   8.118
  749    H44  4EM 101           H44      PYA 142  -4.777 -12.308   7.134
  750    H49  4EM 101           H49      PYA 142  -3.446  -8.196   7.420
  751    H51  4EM 101           H51      PYA 142  -1.177  -8.700   6.203
  752    H50  4EM 101           H50      PYA 142  -1.409 -10.978   4.965
  753    H48  4EM 101           H48      PYA 142  -3.781 -11.830   5.442
  Start of MODEL   11
    1    H1   MET   1           1H       MET   1   6.531  15.259  -0.491
    2    H2   MET   1           2H       MET   1   5.959  15.925  -1.930
    3    H3   MET   1           3H       MET   1   7.446  15.127  -1.903
    4    HA   MET   1           HA       MET   1   5.733  13.792  -2.933
    5    HB2  MET   1           2HB      MET   1   6.089  11.706  -1.534
    6    HB3  MET   1           1HB      MET   1   7.564  12.572  -1.921
    7    HG2  MET   1           2HG      MET   1   6.128  12.612   0.740
    8    HG3  MET   1           1HG      MET   1   7.614  11.737   0.379
    9    HE1  MET   1           3HE      MET   1   9.323  13.887  -1.301
   10    HE2  MET   1           1HE      MET   1  10.014  12.992   0.049
   11    HE3  MET   1           2HE      MET   1  10.177  14.745  -0.019
   12    H    ASP   2           H        ASP   2   3.639  14.471  -3.034
   13    HA   ASP   2           HA       ASP   2   1.939  15.057  -0.830
   14    HB2  ASP   2           2HB      ASP   2   1.713  16.117  -3.104
   15    HB3  ASP   2           1HB      ASP   2   1.254  14.557  -3.783
   16    H    GLY   3           H        GLY   3  -0.153  14.003  -0.415
   17    HA2  GLY   3           2HA      GLY   3  -0.085  11.330   0.291
   18    HA3  GLY   3           1HA      GLY   3  -1.544  12.286   0.093
   19    H    GLU   4           H        GLU   4  -1.386  12.769  -2.717
   20    HA   GLU   4           HA       GLU   4  -2.157  10.153  -3.777
   21    HB2  GLU   4           2HB      GLU   4  -2.239  12.874  -5.145
   22    HB3  GLU   4           1HB      GLU   4  -2.976  11.393  -5.745
   23    HG2  GLU   4           2HG      GLU   4  -4.143  11.553  -3.277
   24    HG3  GLU   4           1HG      GLU   4  -3.912  13.263  -3.623
   25    H    GLU   5           H        GLU   5   0.403  12.474  -4.203
   26    HA   GLU   5           HA       GLU   5   1.659  11.544  -6.529
   27    HB2  GLU   5           2HB      GLU   5   2.212  13.675  -5.484
   28    HB3  GLU   5           1HB      GLU   5   2.801  12.849  -4.048
   29    HG2  GLU   5           2HG      GLU   5   4.568  13.794  -5.542
   30    HG3  GLU   5           1HG      GLU   5   4.750  12.093  -5.148
   31    H    VAL   6           H        VAL   6   1.799  10.354  -3.218
   32    HA   VAL   6           HA       VAL   6   3.847   8.414  -3.872
   33    HB   VAL   6           HB       VAL   6   3.952   9.433  -1.682
   34   HG11  VAL   6          1HG1      VAL   6   2.307   8.986   0.088
   35   HG12  VAL   6          2HG1      VAL   6   1.296   8.100  -1.053
   36   HG13  VAL   6          3HG1      VAL   6   1.554   9.833  -1.265
   37   HG21  VAL   6          3HG2      VAL   6   4.258   7.394  -0.346
   38   HG22  VAL   6          1HG2      VAL   6   4.852   7.164  -1.991
   39   HG23  VAL   6          2HG2      VAL   6   3.300   6.476  -1.506
   40    H    LYS   7           H        LYS   7   0.320   8.422  -3.499
   41    HA   LYS   7           HA       LYS   7  -0.098   5.668  -3.122
   42    HB2  LYS   7           2HB      LYS   7  -1.864   7.758  -4.420
   43    HB3  LYS   7           1HB      LYS   7  -2.386   6.084  -4.245
   44    HG2  LYS   7           2HG      LYS   7  -2.055   6.304  -1.763
   45    HG3  LYS   7           1HG      LYS   7  -1.729   8.021  -2.007
   46    HD2  LYS   7           2HD      LYS   7  -4.310   6.549  -2.655
   47    HD3  LYS   7           1HD      LYS   7  -4.058   7.723  -1.366
   48    HE2  LYS   7           2HE      LYS   7  -3.670   9.483  -3.062
   49    HE3  LYS   7           1HE      LYS   7  -3.971   8.315  -4.348
   50    HZ1  LYS   7           3HZ      LYS   7  -6.210   8.048  -3.565
   51    HZ2  LYS   7           1HZ      LYS   7  -5.904   9.686  -3.848
   52    HZ3  LYS   7           2HZ      LYS   7  -5.944   9.084  -2.260
   53    H    GLU   8           H        GLU   8   0.036   7.473  -6.181
   54    HA   GLU   8           HA       GLU   8  -0.231   5.300  -7.940
   55    HB2  GLU   8           2HB      GLU   8   0.851   6.774  -9.613
   56    HB3  GLU   8           1HB      GLU   8  -0.409   7.601  -8.700
   57    HG2  GLU   8           2HG      GLU   8   1.364   8.599  -7.236
   58    HG3  GLU   8           1HG      GLU   8   2.584   7.864  -8.279
   59    H    LYS   9           H        LYS   9   2.641   6.591  -6.280
   60    HA   LYS   9           HA       LYS   9   4.552   4.862  -7.509
   61    HB2  LYS   9           2HB      LYS   9   4.766   6.408  -4.903
   62    HB3  LYS   9           1HB      LYS   9   6.104   5.609  -5.722
   63    HG2  LYS   9           2HG      LYS   9   5.710   7.142  -7.691
   64    HG3  LYS   9           1HG      LYS   9   4.535   8.011  -6.700
   65    HD2  LYS   9           2HD      LYS   9   7.497   7.671  -6.106
   66    HD3  LYS   9           1HD      LYS   9   6.707   9.143  -6.658
   67    HE2  LYS   9           2HE      LYS   9   5.440   9.252  -4.537
   68    HE3  LYS   9           1HE      LYS   9   6.244   7.780  -3.973
   69    HZ1  LYS   9           3HZ      LYS   9   7.264   9.830  -3.135
   70    HZ2  LYS   9           1HZ      LYS   9   7.654  10.294  -4.713
   71    HZ3  LYS   9           2HZ      LYS   9   8.341   8.904  -4.034
   72    H    ILE  10           H        ILE  10   2.342   4.413  -4.860
   73    HA   ILE  10           HA       ILE  10   3.630   2.240  -3.530
   74    HB   ILE  10           HB       ILE  10   0.648   2.809  -3.837
   75   HG12  ILE  10          2HG1      ILE  10   1.691   4.669  -2.703
   76   HG13  ILE  10          1HG1      ILE  10   0.784   3.748  -1.512
   77   HG21  ILE  10          1HG2      ILE  10   0.943   0.478  -3.225
   78   HG22  ILE  10          2HG2      ILE  10   0.285   1.369  -1.852
   79   HG23  ILE  10          3HG2      ILE  10   1.995   0.932  -1.883
   80   HD11  ILE  10          3HD1      ILE  10   2.871   4.475  -0.588
   81   HD12  ILE  10          1HD1      ILE  10   3.771   3.753  -1.920
   82   HD13  ILE  10          2HD1      ILE  10   2.918   2.721  -0.761
   83    H    ARG  11           H        ARG  11   1.069   2.355  -5.971
   84    HA   ARG  11           HA       ARG  11   0.912  -0.418  -6.478
   85    HB2  ARG  11           2HB      ARG  11   0.021   1.957  -8.128
   86    HB3  ARG  11           1HB      ARG  11  -0.357   0.292  -8.550
   87    HG2  ARG  11           2HG      ARG  11  -1.174   1.709  -6.006
   88    HG3  ARG  11           1HG      ARG  11  -2.222   1.380  -7.384
   89    HD2  ARG  11           2HD      ARG  11  -0.860  -0.825  -5.787
   90    HD3  ARG  11           1HD      ARG  11  -2.454  -0.187  -5.400
   91    HE   ARG  11           HE       ARG  11  -3.245  -0.967  -7.540
   92   HH11  ARG  11          1HH1      ARG  11  -0.203  -2.400  -6.519
   93   HH12  ARG  11          2HH1      ARG  11  -0.394  -3.801  -7.520
   94   HH21  ARG  11          1HH2      ARG  11  -3.516  -2.839  -8.782
   95   HH22  ARG  11          2HH2      ARG  11  -2.277  -4.049  -8.805
   96    H    ARG  12           H        ARG  12   2.818   2.119  -8.063
   97    HA   ARG  12           HA       ARG  12   3.901   0.465 -10.118
   98    HB2  ARG  12           2HB      ARG  12   4.587   3.183  -9.020
   99    HB3  ARG  12           1HB      ARG  12   5.845   2.357  -9.929
  100    HG2  ARG  12           2HG      ARG  12   4.545   3.883 -11.365
  101    HG3  ARG  12           1HG      ARG  12   4.395   2.204 -11.890
  102    HD2  ARG  12           2HD      ARG  12   2.205   2.083 -10.699
  103    HD3  ARG  12           1HD      ARG  12   2.364   3.794 -10.302
  104    HE   ARG  12           HE       ARG  12   2.318   2.891 -13.107
  105   HH11  ARG  12          1HH1      ARG  12   0.916   4.797 -10.510
  106   HH12  ARG  12          2HH1      ARG  12  -0.202   5.621 -11.556
  107   HH21  ARG  12          1HH2      ARG  12   0.790   3.907 -14.445
  108   HH22  ARG  12          2HH2      ARG  12  -0.271   5.114 -13.784
  109    H    TYR  13           H        TYR  13   5.135   1.398  -6.901
  110    HA   TYR  13           HA       TYR  13   7.630   0.110  -6.970
  111    HB2  TYR  13           2HB      TYR  13   7.127   1.704  -5.206
  112    HB3  TYR  13           1HB      TYR  13   5.797   0.715  -4.610
  113    HD1  TYR  13           HD1      TYR  13   9.538   0.570  -5.137
  114    HD2  TYR  13           HD2      TYR  13   6.217  -0.758  -2.784
  115    HE1  TYR  13           HE1      TYR  13  11.075  -0.529  -3.567
  116    HE2  TYR  13           HE2      TYR  13   7.759  -1.840  -1.224
  117    HH   TYR  13           HH       TYR  13  10.134  -2.777  -1.348
  118    H    ILE  14           H        ILE  14   4.449  -1.186  -6.178
  119    HA   ILE  14           HA       ILE  14   5.208  -3.735  -5.255
  120    HB   ILE  14           HB       ILE  14   2.646  -2.890  -6.679
  121   HG12  ILE  14          2HG1      ILE  14   3.171  -3.253  -3.690
  122   HG13  ILE  14          1HG1      ILE  14   3.136  -1.692  -4.494
  123   HG21  ILE  14          1HG2      ILE  14   1.642  -4.934  -5.694
  124   HG22  ILE  14          2HG2      ILE  14   3.221  -5.415  -5.078
  125   HG23  ILE  14          3HG2      ILE  14   2.935  -5.323  -6.819
  126   HD11  ILE  14          3HD1      ILE  14   0.768  -2.092  -5.082
  127   HD12  ILE  14          1HD1      ILE  14   1.073  -2.076  -3.345
  128   HD13  ILE  14          2HD1      ILE  14   0.834  -3.610  -4.179
  129    H    MET  15           H        MET  15   4.286  -2.643  -8.558
  130    HA   MET  15           HA       MET  15   4.712  -5.216  -9.787
  131    HB2  MET  15           2HB      MET  15   4.786  -2.572 -11.300
  132    HB3  MET  15           1HB      MET  15   4.253  -4.149 -11.875
  133    HG2  MET  15           2HG      MET  15   2.835  -2.269 -10.005
  134    HG3  MET  15           1HG      MET  15   2.323  -2.799 -11.602
  135    HE1  MET  15           3HE      MET  15   1.135  -6.449 -10.927
  136    HE2  MET  15           1HE      MET  15   2.652  -5.871 -11.620
  137    HE3  MET  15           2HE      MET  15   1.124  -5.101 -12.066
  138    H    GLU  16           H        GLU  16   6.712  -2.354  -9.352
  139    HA   GLU  16           HA       GLU  16   8.858  -2.939 -11.074
  140    HB2  GLU  16           2HB      GLU  16   8.608  -1.183  -8.615
  141    HB3  GLU  16           1HB      GLU  16  10.128  -1.313  -9.487
  142    HG2  GLU  16           2HG      GLU  16   7.520  -0.342 -10.698
  143    HG3  GLU  16           1HG      GLU  16   8.798   0.700 -10.078
  144    H    ASP  17           H        ASP  17   8.692  -3.167  -7.534
  145    HA   ASP  17           HA       ASP  17  11.195  -4.692  -7.431
  146    HB2  ASP  17           2HB      ASP  17  10.951  -2.740  -5.952
  147    HB3  ASP  17           1HB      ASP  17   9.475  -3.407  -5.259
  148    H    LEU  18           H        LEU  18   7.930  -4.931  -6.000
  149    HA   LEU  18           HA       LEU  18   8.366  -7.399  -4.712
  150    HB2  LEU  18           2HB      LEU  18   5.837  -5.886  -5.394
  151    HB3  LEU  18           1HB      LEU  18   5.765  -7.435  -4.586
  152    HG   LEU  18           HG       LEU  18   5.569  -5.706  -2.925
  153   HD11  LEU  18          1HD1      LEU  18   8.361  -6.891  -2.719
  154   HD12  LEU  18          2HD1      LEU  18   6.860  -7.721  -2.298
  155   HD13  LEU  18          3HD1      LEU  18   7.353  -6.296  -1.399
  156   HD21  LEU  18          3HD2      LEU  18   8.217  -4.537  -3.849
  157   HD22  LEU  18          1HD2      LEU  18   7.255  -3.994  -2.471
  158   HD23  LEU  18          2HD2      LEU  18   6.627  -3.816  -4.107
  159    H    ILE  19           H        ILE  19   6.720  -6.737  -7.835
  160    HA   ILE  19           HA       ILE  19   6.527  -9.586  -8.411
  161    HB   ILE  19           HB       ILE  19   5.819  -7.172 -10.135
  162   HG12  ILE  19          2HG1      ILE  19   3.477  -8.044 -10.001
  163   HG13  ILE  19          1HG1      ILE  19   4.022  -9.340  -8.965
  164   HG21  ILE  19          1HG2      ILE  19   5.595 -10.119 -10.856
  165   HG22  ILE  19          2HG2      ILE  19   6.664  -8.935 -11.610
  166   HG23  ILE  19          3HG2      ILE  19   4.918  -8.790 -11.803
  167   HD11  ILE  19          3HD1      ILE  19   4.548  -7.730  -7.224
  168   HD12  ILE  19          1HD1      ILE  19   2.862  -7.642  -7.733
  169   HD13  ILE  19          2HD1      ILE  19   4.013  -6.421  -8.285
  170    H    GLY  20           H        GLY  20   8.256  -6.777  -9.833
  171    HA2  GLY  20           2HA      GLY  20  10.665  -6.960 -10.264
  172    HA3  GLY  20           1HA      GLY  20  10.387  -8.614 -10.800
  173    HA   PRO  21           HA       PRO  21  10.595  -5.829 -14.576
  174    HB2  PRO  21           2HB      PRO  21  11.931  -7.704 -16.145
  175    HB3  PRO  21           1HB      PRO  21  12.740  -6.526 -15.095
  176    HG2  PRO  21           2HG      PRO  21  12.099  -9.401 -14.532
  177    HG3  PRO  21           1HG      PRO  21  13.602  -8.495 -14.231
  178    HD2  PRO  21           2HD      PRO  21  11.865  -8.959 -12.243
  179    HD3  PRO  21           1HD      PRO  21  12.734  -7.410 -12.342
  180    H    SER  22           H        SER  22   9.536  -9.217 -14.195
  181    HA   SER  22           HA       SER  22   7.793  -9.118 -16.551
  182    HB2  SER  22           2HB      SER  22   7.977 -11.258 -14.382
  183    HB3  SER  22           1HB      SER  22   7.232 -11.426 -15.976
  184    HG   SER  22           HG       SER  22   9.335 -12.328 -15.912
  185    H    ALA  23           H        ALA  23   7.114  -7.030 -15.099
  186    HA   ALA  23           HA       ALA  23   5.279  -7.408 -12.957
  187    HB1  ALA  23           3HB      ALA  23   6.600  -5.385 -13.160
  188    HB2  ALA  23           1HB      ALA  23   4.883  -4.980 -13.231
  189    HB3  ALA  23           2HB      ALA  23   5.845  -5.001 -14.713
  190    H    LYS  24           H        LYS  24   3.247  -8.094 -13.138
  191    HA   LYS  24           HA       LYS  24   1.833  -8.323 -15.628
  192    HB2  LYS  24           2HB      LYS  24   0.862  -8.813 -12.788
  193    HB3  LYS  24           1HB      LYS  24   0.013  -9.291 -14.257
  194    HG2  LYS  24           2HG      LYS  24   1.909 -10.807 -14.838
  195    HG3  LYS  24           1HG      LYS  24   2.714 -10.354 -13.333
  196    HD2  LYS  24           2HD      LYS  24   0.030 -11.761 -13.577
  197    HD3  LYS  24           1HD      LYS  24   1.550 -12.503 -13.088
  198    HE2  LYS  24           2HE      LYS  24   1.597 -11.212 -11.037
  199    HE3  LYS  24           1HE      LYS  24   0.204 -10.257 -11.543
  200    HZ1  LYS  24           3HZ      LYS  24  -1.151 -12.253 -11.456
  201    HZ2  LYS  24           1HZ      LYS  24  -0.415 -11.951  -9.965
  202    HZ3  LYS  24           2HZ      LYS  24   0.183 -13.171 -10.969
  203    H    GLU  25           H        GLU  25   1.905  -6.096 -16.208
  204    HA   GLU  25           HA       GLU  25   0.956  -3.897 -14.748
  205    HB2  GLU  25           2HB      GLU  25   0.980  -2.701 -16.950
  206    HB3  GLU  25           1HB      GLU  25   2.438  -3.630 -16.663
  207    HG2  GLU  25           2HG      GLU  25   1.634  -5.438 -18.117
  208    HG3  GLU  25           1HG      GLU  25   0.130  -4.557 -18.386
  209    H    ASP  26           H        ASP  26  -0.735  -6.260 -16.586
  210    HA   ASP  26           HA       ASP  26  -3.110  -4.970 -17.253
  211    HB2  ASP  26           2HB      ASP  26  -2.457  -7.176 -18.141
  212    HB3  ASP  26           1HB      ASP  26  -2.587  -7.888 -16.533
  213    H    GLU  27           H        GLU  27  -2.029  -6.429 -14.264
  214    HA   GLU  27           HA       GLU  27  -4.613  -6.157 -12.912
  215    HB2  GLU  27           2HB      GLU  27  -1.997  -7.395 -11.966
  216    HB3  GLU  27           1HB      GLU  27  -3.515  -7.410 -11.066
  217    HG2  GLU  27           2HG      GLU  27  -4.566  -8.619 -13.022
  218    HG3  GLU  27           1HG      GLU  27  -2.950  -8.764 -13.719
  219    H    LEU  28           H        LEU  28  -2.536  -3.886 -13.601
  220    HA   LEU  28           HA       LEU  28  -2.261  -2.660 -10.977
  221    HB2  LEU  28           2HB      LEU  28  -0.507  -2.679 -12.906
  222    HB3  LEU  28           1HB      LEU  28  -1.460  -1.401 -13.621
  223    HG   LEU  28           HG       LEU  28   0.571  -0.642 -12.297
  224   HD11  LEU  28          1HD1      LEU  28  -0.463   1.243 -11.122
  225   HD12  LEU  28          2HD1      LEU  28  -2.042   0.461 -11.229
  226   HD13  LEU  28          3HD1      LEU  28  -1.222   0.994 -12.698
  227   HD21  LEU  28          3HD2      LEU  28   0.354  -2.351 -10.500
  228   HD22  LEU  28          1HD2      LEU  28  -1.034  -1.468  -9.861
  229   HD23  LEU  28          2HD2      LEU  28   0.564  -0.716  -9.891
  230    H    ASP  29           H        ASP  29  -3.897  -1.593 -10.192
  231    HA   ASP  29           HA       ASP  29  -5.043   0.679 -11.491
  232    HB2  ASP  29           2HB      ASP  29  -6.514  -1.276 -12.313
  233    HB3  ASP  29           1HB      ASP  29  -6.971  -1.514 -10.633
  234    H    ASP  30           H        ASP  30  -6.507   1.816  -9.906
  235    HA   ASP  30           HA       ASP  30  -5.222   1.735  -7.318
  236    HB2  ASP  30           2HB      ASP  30  -6.429   3.825  -6.861
  237    HB3  ASP  30           1HB      ASP  30  -5.617   3.898  -8.417
  238    H    GLN  31           H        GLN  31  -8.499   1.170  -8.585
  239    HA   GLN  31           HA       GLN  31  -9.495   0.409  -5.936
  240    HB2  GLN  31           2HB      GLN  31 -10.903   0.438  -8.633
  241    HB3  GLN  31           1HB      GLN  31 -11.676   0.074  -7.093
  242    HG2  GLN  31           2HG      GLN  31 -10.898   2.403  -6.339
  243    HG3  GLN  31           1HG      GLN  31 -10.541   2.709  -8.037
  244   HE21  GLN  31          1HE2      GLN  31 -13.302   0.859  -6.761
  245   HE22  GLN  31          2HE2      GLN  31 -14.515   1.951  -7.325
  246    H    THR  32           H        THR  32  -7.683  -1.203  -8.206
  247    HA   THR  32           HA       THR  32  -8.774  -3.774  -8.321
  248    HB   THR  32           HB       THR  32  -5.915  -2.796  -8.369
  249    HG1  THR  32           HG1      THR  32  -7.857  -3.465 -10.159
  250   HG21  THR  32          3HG2      THR  32  -5.178  -5.119  -8.954
  251   HG22  THR  32          1HG2      THR  32  -6.763  -5.710  -8.433
  252   HG23  THR  32          2HG2      THR  32  -5.677  -4.952  -7.264
  253    HA   PRO  33           HA       PRO  33  -8.643  -4.787  -3.876
  254    HB2  PRO  33           2HB      PRO  33  -9.668  -7.344  -4.101
  255    HB3  PRO  33           1HB      PRO  33 -10.660  -5.873  -4.146
  256    HG2  PRO  33           2HG      PRO  33  -9.743  -7.581  -6.403
  257    HG3  PRO  33           1HG      PRO  33 -11.285  -6.742  -6.172
  258    HD2  PRO  33           2HD      PRO  33  -9.284  -5.811  -7.797
  259    HD3  PRO  33           1HD      PRO  33 -10.499  -4.765  -7.037
  260    H    LEU  34           H        LEU  34  -6.653  -5.064  -3.146
  261    HA   LEU  34           HA       LEU  34  -4.607  -6.351  -4.622
  262    HB2  LEU  34           2HB      LEU  34  -4.530  -5.087  -1.861
  263    HB3  LEU  34           1HB      LEU  34  -3.141  -5.476  -2.861
  264    HG   LEU  34           HG       LEU  34  -5.249  -3.387  -3.523
  265   HD11  LEU  34          1HD1      LEU  34  -2.376  -3.015  -2.619
  266   HD12  LEU  34          2HD1      LEU  34  -3.827  -2.658  -1.675
  267   HD13  LEU  34          3HD1      LEU  34  -3.480  -1.734  -3.135
  268   HD21  LEU  34          3HD2      LEU  34  -4.375  -4.362  -5.581
  269   HD22  LEU  34          1HD2      LEU  34  -2.715  -4.113  -5.029
  270   HD23  LEU  34          2HD2      LEU  34  -3.753  -2.728  -5.376
  271    H    LEU  35           H        LEU  35  -6.141  -7.109  -1.431
  272    HA   LEU  35           HA       LEU  35  -4.470  -9.397  -0.915
  273    HB2  LEU  35           2HB      LEU  35  -7.137  -8.563   0.257
  274    HB3  LEU  35           1HB      LEU  35  -6.414 -10.102   0.684
  275    HG   LEU  35           HG       LEU  35  -5.937  -8.519   2.434
  276   HD11  LEU  35          1HD1      LEU  35  -3.494  -8.612   2.576
  277   HD12  LEU  35          2HD1      LEU  35  -3.376  -8.979   0.855
  278   HD13  LEU  35          3HD1      LEU  35  -4.136 -10.131   1.957
  279   HD21  LEU  35          3HD2      LEU  35  -4.685  -6.700   0.357
  280   HD22  LEU  35          1HD2      LEU  35  -4.683  -6.447   2.105
  281   HD23  LEU  35          2HD2      LEU  35  -6.204  -6.425   1.217
  282    H    GLU  36           H        GLU  36  -7.576  -8.937  -2.471
  283    HA   GLU  36           HA       GLU  36  -8.349 -11.633  -2.798
  284    HB2  GLU  36           2HB      GLU  36  -9.968  -9.763  -3.004
  285    HB3  GLU  36           1HB      GLU  36  -9.140  -9.185  -4.448
  286    HG2  GLU  36           2HG      GLU  36  -9.729 -11.344  -5.588
  287    HG3  GLU  36           1HG      GLU  36 -10.650 -11.802  -4.156
  288    H    TRP  37           H        TRP  37  -6.292  -9.476  -4.729
  289    HA   TRP  37           HA       TRP  37  -6.140 -11.496  -6.921
  290    HB2  TRP  37           2HB      TRP  37  -5.229  -8.595  -6.751
  291    HB3  TRP  37           1HB      TRP  37  -4.841  -9.634  -8.116
  292    HD1  TRP  37           HD1      TRP  37  -8.354  -9.875  -6.594
  293    HE1  TRP  37           HE1      TRP  37 -10.065  -8.910  -8.216
  294    HE3  TRP  37           HE3      TRP  37  -5.149  -7.937 -10.056
  295    HZ2  TRP  37           HZ2      TRP  37 -10.078  -7.517 -10.664
  296    HZ3  TRP  37           HZ3      TRP  37  -6.104  -6.799 -12.022
  297    HH2  TRP  37           HH2      TRP  37  -8.514  -6.596 -12.314
  298    H    GLY  38           H        GLY  38  -4.618 -11.022  -4.052
  299    HA2  GLY  38           2HA      GLY  38  -2.815 -12.137  -3.158
  300    HA3  GLY  38           1HA      GLY  38  -2.494 -12.850  -4.731
  301    H    ILE  39           H        ILE  39  -2.708  -9.437  -4.586
  302    HA   ILE  39           HA       ILE  39  -0.105  -9.008  -5.681
  303    HB   ILE  39           HB       ILE  39  -2.295  -7.115  -4.683
  304   HG12  ILE  39          2HG1      ILE  39  -1.484  -7.980  -7.497
  305   HG13  ILE  39          1HG1      ILE  39  -2.937  -8.483  -6.643
  306   HG21  ILE  39          1HG2      ILE  39   0.175  -6.318  -6.252
  307   HG22  ILE  39          2HG2      ILE  39  -0.143  -5.926  -4.563
  308   HG23  ILE  39          3HG2      ILE  39  -1.173  -5.260  -5.831
  309   HD11  ILE  39          3HD1      ILE  39  -3.732  -6.146  -6.703
  310   HD12  ILE  39          1HD1      ILE  39  -3.469  -6.839  -8.305
  311   HD13  ILE  39          2HD1      ILE  39  -2.294  -5.711  -7.633
  312    H    LEU  40           H        LEU  40  -1.492  -8.885  -2.473
  313    HA   LEU  40           HA       LEU  40   0.989  -7.755  -1.319
  314    HB2  LEU  40           2HB      LEU  40  -1.793  -7.806  -0.146
  315    HB3  LEU  40           1HB      LEU  40  -0.381  -7.058   0.561
  316    HG   LEU  40           HG       LEU  40  -1.851  -6.149  -1.924
  317   HD11  LEU  40          1HD1      LEU  40  -3.017  -5.595   0.111
  318   HD12  LEU  40          2HD1      LEU  40  -2.320  -4.142  -0.594
  319   HD13  LEU  40          3HD1      LEU  40  -1.553  -4.882   0.814
  320   HD21  LEU  40          3HD2      LEU  40   0.526  -5.778  -2.294
  321   HD22  LEU  40          1HD2      LEU  40   0.676  -4.984  -0.722
  322   HD23  LEU  40          2HD2      LEU  40  -0.289  -4.242  -2.002
  323    H    ASN  41           H        ASN  41  -1.622  -9.566   0.227
  324    HA   ASN  41           HA       ASN  41  -1.590 -11.196   1.810
  325    HB2  ASN  41           2HB      ASN  41  -0.416 -12.591  -0.630
  326    HB3  ASN  41           1HB      ASN  41  -1.127 -13.437   0.741
  327   HD21  ASN  41          1HD2      ASN  41  -2.725 -14.377  -0.607
  328   HD22  ASN  41          2HD2      ASN  41  -4.062 -13.455  -1.206
  329    H    SER  42           H        SER  42   0.126  -9.956   3.003
  330    HA   SER  42           HA       SER  42   1.632 -10.086   4.643
  331    HB2  SER  42           3HB      SER  42   2.119 -12.963   3.813
  332    HB3  SER  42           2HB      SER  42   2.689 -12.235   5.310
  333    H    MET  43           H        MET  43   3.168 -12.059   2.053
  334    HA   MET  43           HA       MET  43   5.799 -11.447   2.723
  335    HB2  MET  43           2HB      MET  43   4.759 -12.286  -0.010
  336    HB3  MET  43           1HB      MET  43   6.417 -12.464   0.564
  337    HG2  MET  43           2HG      MET  43   3.989 -13.880   1.704
  338    HG3  MET  43           1HG      MET  43   5.189 -14.593   0.632
  339    HE1  MET  43           3HE      MET  43   5.638 -13.953   5.186
  340    HE2  MET  43           1HE      MET  43   4.146 -14.348   4.331
  341    HE3  MET  43           2HE      MET  43   4.851 -12.740   4.169
  342    H    ASN  44           H        ASN  44   3.682  -9.910   0.400
  343    HA   ASN  44           HA       ASN  44   5.702  -7.971  -0.469
  344    HB2  ASN  44           2HB      ASN  44   2.756  -8.158  -1.225
  345    HB3  ASN  44           1HB      ASN  44   3.961  -7.134  -2.003
  346   HD21  ASN  44          1HD2      ASN  44   2.692 -10.373  -1.757
  347   HD22  ASN  44          2HD2      ASN  44   3.626 -11.036  -3.039
  348    H    ILE  45           H        ILE  45   2.900  -8.142   1.658
  349    HA   ILE  45           HA       ILE  45   2.303  -5.449   2.113
  350    HB   ILE  45           HB       ILE  45   1.770  -8.029   3.502
  351   HG12  ILE  45          2HG1      ILE  45  -0.062  -5.650   3.081
  352   HG13  ILE  45          1HG1      ILE  45   0.240  -6.876   1.865
  353   HG21  ILE  45          1HG2      ILE  45   0.855  -7.122   5.584
  354   HG22  ILE  45          2HG2      ILE  45   1.447  -5.518   5.148
  355   HG23  ILE  45          3HG2      ILE  45   2.596  -6.823   5.464
  356   HD11  ILE  45          3HD1      ILE  45  -1.842  -7.314   2.935
  357   HD12  ILE  45          1HD1      ILE  45  -1.090  -7.272   4.531
  358   HD13  ILE  45          2HD1      ILE  45  -0.692  -8.572   3.401
  359    H    VAL  46           H        VAL  46   4.827  -7.424   3.585
  360    HA   VAL  46           HA       VAL  46   5.464  -5.717   5.762
  361    HB   VAL  46           HB       VAL  46   7.257  -7.764   4.392
  362   HG11  VAL  46          1HG1      VAL  46   7.434  -6.559   7.182
  363   HG12  VAL  46          2HG1      VAL  46   8.526  -6.206   5.841
  364   HG13  VAL  46          3HG1      VAL  46   8.489  -7.824   6.542
  365   HG21  VAL  46          3HG2      VAL  46   5.415  -8.118   6.791
  366   HG22  VAL  46          1HG2      VAL  46   6.514  -9.341   6.146
  367   HG23  VAL  46          2HG2      VAL  46   5.145  -8.785   5.182
  368    H    LYS  47           H        LYS  47   6.487  -5.793   2.402
  369    HA   LYS  47           HA       LYS  47   8.624  -3.902   2.612
  370    HB2  LYS  47           2HB      LYS  47   7.039  -4.870   0.215
  371    HB3  LYS  47           1HB      LYS  47   8.301  -3.646   0.074
  372    HG2  LYS  47           2HG      LYS  47   9.235  -5.766  -0.531
  373    HG3  LYS  47           1HG      LYS  47   9.941  -5.270   1.005
  374    HD2  LYS  47           2HD      LYS  47   8.507  -6.836   2.216
  375    HD3  LYS  47           1HD      LYS  47   7.656  -7.252   0.729
  376    HE2  LYS  47           2HE      LYS  47   9.274  -8.997   1.317
  377    HE3  LYS  47           1HE      LYS  47   9.744  -8.214  -0.190
  378    HZ1  LYS  47           3HZ      LYS  47  11.397  -6.971   0.962
  379    HZ2  LYS  47           1HZ      LYS  47  11.590  -8.596   1.363
  380    HZ3  LYS  47           2HZ      LYS  47  10.881  -7.540   2.465
  381    H    LEU  48           H        LEU  48   5.151  -3.670   2.125
  382    HA   LEU  48           HA       LEU  48   5.071  -0.867   1.543
  383    HB2  LEU  48           2HB      LEU  48   2.926  -2.814   2.455
  384    HB3  LEU  48           1HB      LEU  48   2.586  -1.097   2.314
  385    HG   LEU  48           HG       LEU  48   1.777  -2.124   0.310
  386   HD11  LEU  48          1HD1      LEU  48   4.410  -0.753  -0.383
  387   HD12  LEU  48          2HD1      LEU  48   2.871   0.048  -0.062
  388   HD13  LEU  48          3HD1      LEU  48   3.040  -0.988  -1.474
  389   HD21  LEU  48          3HD2      LEU  48   3.093  -3.492  -1.229
  390   HD22  LEU  48          1HD2      LEU  48   3.027  -4.240   0.367
  391   HD23  LEU  48          2HD2      LEU  48   4.491  -3.404  -0.152
  392    H    MET  49           H        MET  49   4.971  -2.749   4.560
  393    HA   MET  49           HA       MET  49   4.199  -0.775   6.409
  394    HB2  MET  49           2HB      MET  49   6.302  -2.934   6.919
  395    HB3  MET  49           1HB      MET  49   5.421  -2.040   8.150
  396    HG2  MET  49           2HG      MET  49   3.334  -3.136   7.465
  397    HG3  MET  49           1HG      MET  49   4.218  -4.028   6.215
  398    HE1  MET  49           3HE      MET  49   3.746  -6.958   8.771
  399    HE2  MET  49           1HE      MET  49   3.877  -6.582   7.051
  400    HE3  MET  49           2HE      MET  49   2.618  -5.825   8.027
  401    H    VAL  50           H        VAL  50   7.436  -1.686   5.276
  402    HA   VAL  50           HA       VAL  50   8.772   0.439   6.705
  403    HB   VAL  50           HB       VAL  50   9.832  -1.792   6.387
  404   HG11  VAL  50          1HG1      VAL  50  10.877  -2.394   4.216
  405   HG12  VAL  50          2HG1      VAL  50  10.077  -1.013   3.454
  406   HG13  VAL  50          3HG1      VAL  50   9.115  -2.343   4.112
  407   HG21  VAL  50          3HG2      VAL  50  11.426   0.502   5.204
  408   HG22  VAL  50          1HG2      VAL  50  12.107  -0.984   5.861
  409   HG23  VAL  50          2HG2      VAL  50  11.248   0.136   6.920
  410    H    TYR  51           H        TYR  51   7.500   0.021   3.458
  411    HA   TYR  51           HA       TYR  51   9.027   1.951   2.058
  412    HB2  TYR  51           2HB      TYR  51   7.394   0.309   0.974
  413    HB3  TYR  51           1HB      TYR  51   6.084   1.330   1.529
  414    HD1  TYR  51           HD1      TYR  51   9.120   1.312  -0.630
  415    HD2  TYR  51           HD2      TYR  51   5.449   3.305   0.261
  416    HE1  TYR  51           HE1      TYR  51   9.373   2.691  -2.651
  417    HE2  TYR  51           HE2      TYR  51   5.697   4.684  -1.750
  418    HH   TYR  51           HH       TYR  51   7.951   4.023  -4.208
  419    H    ILE  52           H        ILE  52   5.853   2.192   3.532
  420    HA   ILE  52           HA       ILE  52   5.363   4.964   3.086
  421    HB   ILE  52           HB       ILE  52   4.124   2.981   5.068
  422   HG12  ILE  52          2HG1      ILE  52   3.063   3.761   2.312
  423   HG13  ILE  52          1HG1      ILE  52   4.124   2.378   2.551
  424   HG21  ILE  52          1HG2      ILE  52   2.964   5.587   4.045
  425   HG22  ILE  52          2HG2      ILE  52   3.557   5.297   5.673
  426   HG23  ILE  52          3HG2      ILE  52   2.132   4.429   5.093
  427   HD11  ILE  52          3HD1      ILE  52   1.404   2.730   3.794
  428   HD12  ILE  52          1HD1      ILE  52   2.477   1.338   3.986
  429   HD13  ILE  52          2HD1      ILE  52   1.807   1.722   2.401
  430    H    ARG  53           H        ARG  53   6.788   3.157   5.754
  431    HA   ARG  53           HA       ARG  53   7.125   5.142   7.717
  432    HB2  ARG  53           2HB      ARG  53   7.525   2.827   8.255
  433    HB3  ARG  53           1HB      ARG  53   8.711   2.659   6.972
  434    HG2  ARG  53           2HG      ARG  53   9.923   2.625   9.002
  435    HG3  ARG  53           1HG      ARG  53  10.227   4.206   8.289
  436    HD2  ARG  53           2HD      ARG  53   8.070   3.836  10.368
  437    HD3  ARG  53           1HD      ARG  53   9.751   3.998  10.849
  438    HE   ARG  53           HE       ARG  53   9.544   6.188   9.425
  439   HH11  ARG  53          1HH1      ARG  53   7.106   4.870  11.595
  440   HH12  ARG  53          2HH1      ARG  53   6.484   6.432  12.018
  441   HH21  ARG  53          1HH2      ARG  53   8.815   8.229  10.153
  442   HH22  ARG  53          2HH2      ARG  53   7.439   8.329  11.211
  443    H    ASP  54           H        ASP  54   9.275   4.144   5.092
  444    HA   ASP  54           HA       ASP  54  11.370   6.041   5.547
  445    HB2  ASP  54           2HB      ASP  54  11.803   3.867   4.498
  446    HB3  ASP  54           1HB      ASP  54  10.670   4.211   3.202
  447    H    GLU  55           H        GLU  55   8.490   5.972   3.564
  448    HA   GLU  55           HA       GLU  55   9.413   7.915   1.625
  449    HB2  GLU  55           2HB      GLU  55   8.186   5.884   0.951
  450    HB3  GLU  55           1HB      GLU  55   6.795   6.389   1.902
  451    HG2  GLU  55           2HG      GLU  55   6.421   6.768  -0.455
  452    HG3  GLU  55           1HG      GLU  55   6.446   8.294   0.417
  453    H    MET  56           H        MET  56   6.735   7.724   4.001
  454    HA   MET  56           HA       MET  56   6.376  10.676   3.748
  455    HB2  MET  56           2HB      MET  56   3.998  10.407   3.804
  456    HB3  MET  56           1HB      MET  56   4.612   9.336   2.566
  457    HG2  MET  56           2HG      MET  56   4.465   7.493   4.329
  458    HG3  MET  56           1HG      MET  56   3.548   8.654   5.292
  459    HE1  MET  56           3HE      MET  56   2.237   6.755   1.306
  460    HE2  MET  56           1HE      MET  56   3.580   6.216   2.312
  461    HE3  MET  56           2HE      MET  56   3.702   7.734   1.421
  462    H    GLY  57           H        GLY  57   7.413   8.365   5.793
  463    HA2  GLY  57           2HA      GLY  57   7.991   8.506   8.006
  464    HA3  GLY  57           1HA      GLY  57   7.199  10.071   8.093
  465    H    VAL  58           H        VAL  58   5.678   7.012   7.120
  466    HA   VAL  58           HA       VAL  58   4.162   6.899   9.683
  467    HB   VAL  58           HB       VAL  58   3.056   6.568   6.846
  468   HG11  VAL  58          1HG1      VAL  58   1.616   6.095   9.472
  469   HG12  VAL  58          2HG1      VAL  58   2.023   4.876   8.259
  470   HG13  VAL  58          3HG1      VAL  58   0.842   6.136   7.882
  471   HG21  VAL  58          3HG2      VAL  58   3.261   8.914   7.508
  472   HG22  VAL  58          1HG2      VAL  58   2.343   8.597   8.984
  473   HG23  VAL  58          2HG2      VAL  58   1.562   8.443   7.407
  474    H    SER  59           H        SER  59   4.873   5.018  10.610
  475    HA   SER  59           HA       SER  59   5.335   2.605   9.019
  476    HB2  SER  59           2HB      SER  59   5.700   1.614  11.388
  477    HB3  SER  59           1HB      SER  59   6.830   2.863  10.874
  478    HG   SER  59           HG       SER  59   4.585   3.207  12.581
  479    H    ILE  60           H        ILE  60   3.637   1.273   8.495
  480    HA   ILE  60           HA       ILE  60   1.053   1.381   9.758
  481    HB   ILE  60           HB       ILE  60   2.201  -0.937   8.124
  482   HG12  ILE  60          2HG1      ILE  60   2.154   1.302   6.856
  483   HG13  ILE  60          1HG1      ILE  60   1.247  -0.017   6.119
  484   HG21  ILE  60          1HG2      ILE  60   0.245  -1.579   9.447
  485   HG22  ILE  60          2HG2      ILE  60  -0.186  -1.524   7.742
  486   HG23  ILE  60          3HG2      ILE  60  -0.685  -0.215   8.816
  487   HD11  ILE  60          3HD1      ILE  60   0.100   2.284   7.704
  488   HD12  ILE  60          1HD1      ILE  60  -0.847   0.931   7.068
  489   HD13  ILE  60          2HD1      ILE  60  -0.010   2.029   5.964
  490    HA   PRO  61           HA       PRO  61   2.778  -0.979  13.282
  491    HB2  PRO  61           2HB      PRO  61   0.677  -0.655  15.007
  492    HB3  PRO  61           1HB      PRO  61   1.823   0.659  14.661
  493    HG2  PRO  61           2HG      PRO  61  -0.897   0.198  13.488
  494    HG3  PRO  61           1HG      PRO  61  -0.180   1.704  14.103
  495    HD2  PRO  61           2HD      PRO  61  -0.276   1.088  11.453
  496    HD3  PRO  61           1HD      PRO  61   1.026   2.071  12.156
  497    H    SER  62           H        SER  62   2.112  -2.860  14.484
  498    HA   SER  62           HA       SER  62   1.248  -4.928  12.802
  499    HB2  SER  62           2HB      SER  62   1.484  -6.286  14.961
  500    HB3  SER  62           1HB      SER  62   2.899  -5.370  14.454
  501    HG   SER  62           HG       SER  62   1.530  -5.199  16.752
  502    H    THR  63           H        THR  63  -0.526  -2.997  15.131
  503    HA   THR  63           HA       THR  63  -2.880  -4.628  15.237
  504    HB   THR  63           HB       THR  63  -2.410  -3.072  17.042
  505    HG1  THR  63           HG1      THR  63  -4.777  -2.387  15.594
  506   HG21  THR  63          3HG2      THR  63  -2.821  -0.810  15.052
  507   HG22  THR  63          1HG2      THR  63  -1.277  -1.278  15.773
  508   HG23  THR  63          2HG2      THR  63  -2.568  -0.635  16.788
  509    H    HIS  64           H        HIS  64  -1.747  -2.145  13.019
  510    HA   HIS  64           HA       HIS  64  -4.322  -1.991  11.598
  511    HB2  HIS  64           2HB      HIS  64  -1.779  -0.380  11.526
  512    HB3  HIS  64           1HB      HIS  64  -2.765  -0.420  10.070
  513    HD1  HIS  64           HD1      HIS  64  -2.900   0.756  13.671
  514    HD2  HIS  64           HD2      HIS  64  -5.069   1.126  10.150
  515    HE1  HIS  64           HE1      HIS  64  -4.605   2.544  14.114
  516    HE2  HIS  64           HE2      HIS  64  -5.937   2.725  11.982
  517    H    ILE  65           H        ILE  65  -2.097  -4.329  11.649
  518    HA   ILE  65           HA       ILE  65  -1.868  -4.747   8.761
  519    HB   ILE  65           HB       ILE  65  -0.961  -6.530  11.069
  520   HG12  ILE  65          2HG1      ILE  65   0.258  -4.401  11.062
  521   HG13  ILE  65          1HG1      ILE  65   1.327  -5.692  10.529
  522   HG21  ILE  65          1HG2      ILE  65   0.414  -7.717   9.385
  523   HG22  ILE  65          2HG2      ILE  65  -0.293  -6.728   8.102
  524   HG23  ILE  65          3HG2      ILE  65  -1.305  -7.845   9.018
  525   HD11  ILE  65          3HD1      ILE  65   1.629  -3.671   9.235
  526   HD12  ILE  65          1HD1      ILE  65  -0.064  -3.701   8.743
  527   HD13  ILE  65          2HD1      ILE  65   1.034  -4.981   8.211
  528    H    THR  66           H        THR  66  -3.995  -4.877   8.220
  529    HA   THR  66           HA       THR  66  -5.086  -7.528   8.296
  530    HB   THR  66           HB       THR  66  -6.260  -6.833  10.247
  531    HG1  THR  66           HG1      THR  66  -7.929  -7.652   9.241
  532   HG21  THR  66          3HG2      THR  66  -7.472  -4.714  10.480
  533   HG22  THR  66          1HG2      THR  66  -6.949  -4.228   8.866
  534   HG23  THR  66          2HG2      THR  66  -5.759  -4.422  10.157
  535    H    GLY  67           H        GLY  67  -6.715  -7.833   6.654
  536    HA2  GLY  67           2HA      GLY  67  -6.029  -6.613   4.208
  537    HA3  GLY  67           1HA      GLY  67  -7.370  -7.707   4.477
  538    H    LYS  68           H        LYS  68  -8.455  -5.667   6.571
  539    HA   LYS  68           HA       LYS  68 -10.287  -4.351   4.819
  540    HB2  LYS  68           2HB      LYS  68 -11.308  -3.399   6.762
  541    HB3  LYS  68           1HB      LYS  68 -10.825  -5.040   7.166
  542    HG2  LYS  68           2HG      LYS  68  -8.912  -4.229   8.434
  543    HG3  LYS  68           1HG      LYS  68  -9.218  -2.574   7.921
  544    HD2  LYS  68           2HD      LYS  68 -10.019  -2.677  10.151
  545    HD3  LYS  68           1HD      LYS  68 -11.466  -2.751   9.151
  546    HE2  LYS  68           2HE      LYS  68 -10.117  -5.182  10.373
  547    HE3  LYS  68           1HE      LYS  68 -11.472  -4.327  11.107
  548    HZ1  LYS  68           3HZ      LYS  68 -12.754  -4.829   9.066
  549    HZ2  LYS  68           1HZ      LYS  68 -12.293  -6.203   9.936
  550    HZ3  LYS  68           2HZ      LYS  68 -11.469  -5.784   8.529
  551    H    TYR  69           H        TYR  69  -7.247  -3.375   6.151
  552    HA   TYR  69           HA       TYR  69  -7.608  -0.541   5.431
  553    HB2  TYR  69           2HB      TYR  69  -5.387  -2.000   6.910
  554    HB3  TYR  69           1HB      TYR  69  -5.364  -0.273   6.548
  555    HD1  TYR  69           HD2      TYR  69  -8.191   0.529   7.074
  556    HD2  TYR  69           HD1      TYR  69  -5.643  -2.102   9.292
  557    HE1  TYR  69           HE2      TYR  69  -9.491   0.975   9.076
  558    HE2  TYR  69           HE1      TYR  69  -6.971  -1.641  11.307
  559    HH   TYR  69           HH       TYR  69  -9.984  -0.068  11.205
  560    H    PHE  70           H        PHE  70  -6.351  -3.389   4.133
  561    HA   PHE  70           HA       PHE  70  -4.606  -1.965   2.209
  562    HB2  PHE  70           2HB      PHE  70  -4.436  -4.750   3.422
  563    HB3  PHE  70           1HB      PHE  70  -3.558  -4.329   1.963
  564    HD1  PHE  70           HD2      PHE  70  -3.756  -3.748   5.626
  565    HD2  PHE  70           HD1      PHE  70  -1.570  -2.908   2.044
  566    HE1  PHE  70           HE2      PHE  70  -1.857  -2.946   6.965
  567    HE2  PHE  70           HE1      PHE  70   0.324  -2.109   3.388
  568    HZ   PHE  70           HZ       PHE  70   0.187  -2.124   5.849
  569    H    LYS  71           H        LYS  71  -7.651  -2.746   2.199
  570    HA   LYS  71           HA       LYS  71  -8.322  -4.842   0.543
  571    HB2  LYS  71           2HB      LYS  71  -9.674  -2.132   0.567
  572    HB3  LYS  71           1HB      LYS  71 -10.390  -3.613  -0.069
  573    HG2  LYS  71           2HG      LYS  71 -10.594  -4.577   2.084
  574    HG3  LYS  71           1HG      LYS  71  -9.485  -3.401   2.801
  575    HD2  LYS  71           2HD      LYS  71 -11.783  -2.907   3.452
  576    HD3  LYS  71           1HD      LYS  71 -11.143  -1.606   2.447
  577    HE2  LYS  71           2HE      LYS  71 -13.480  -2.175   1.880
  578    HE3  LYS  71           1HE      LYS  71 -12.394  -2.463   0.520
  579    HZ1  LYS  71           3HZ      LYS  71 -13.950  -4.262   0.783
  580    HZ2  LYS  71           1HZ      LYS  71 -13.452  -4.533   2.377
  581    HZ3  LYS  71           2HZ      LYS  71 -12.387  -4.817   1.091
  582    H    ASP  72           H        ASP  72  -7.548  -1.571  -0.431
  583    HA   ASP  72           HA       ASP  72  -6.417  -2.310  -2.952
  584    HB2  ASP  72           2HB      ASP  72  -7.932  -1.108  -4.424
  585    HB3  ASP  72           1HB      ASP  72  -8.874  -2.278  -3.507
  586    H    LEU  73           H        LEU  73  -6.115   0.094  -4.131
  587    HA   LEU  73           HA       LEU  73  -4.225   1.368  -2.430
  588    HB2  LEU  73           2HB      LEU  73  -3.980   1.313  -4.893
  589    HB3  LEU  73           1HB      LEU  73  -5.376   2.367  -5.053
  590    HG   LEU  73           HG       LEU  73  -4.093   4.147  -3.762
  591   HD11  LEU  73          1HD1      LEU  73  -1.641   3.894  -3.572
  592   HD12  LEU  73          2HD1      LEU  73  -1.772   2.223  -4.116
  593   HD13  LEU  73          3HD1      LEU  73  -2.503   2.715  -2.585
  594   HD21  LEU  73          3HD2      LEU  73  -4.256   4.291  -6.196
  595   HD22  LEU  73          1HD2      LEU  73  -2.872   3.211  -6.382
  596   HD23  LEU  73          2HD2      LEU  73  -2.657   4.809  -5.669
  597    H    ASN  74           H        ASN  74  -7.570   2.164  -3.262
  598    HA   ASN  74           HA       ASN  74  -7.502   4.781  -2.022
  599    HB2  ASN  74           2HB      ASN  74  -9.934   3.172  -2.896
  600    HB3  ASN  74           1HB      ASN  74  -9.915   4.884  -2.480
  601   HD21  ASN  74          1HD2      ASN  74 -10.857   3.843  -4.875
  602   HD22  ASN  74          2HD2      ASN  74  -9.845   4.403  -6.156
  603    H    ALA  75           H        ALA  75  -8.288   1.505  -0.978
  604    HA   ALA  75           HA       ALA  75  -9.424   2.241   1.566
  605    HB1  ALA  75           3HB      ALA  75  -8.045  -0.328   0.746
  606    HB2  ALA  75           1HB      ALA  75  -9.769   0.022   0.596
  607    HB3  ALA  75           2HB      ALA  75  -9.032  -0.099   2.195
  608    H    ILE  76           H        ILE  76  -6.165   1.465   0.447
  609    HA   ILE  76           HA       ILE  76  -4.751   1.907   2.870
  610    HB   ILE  76           HB       ILE  76  -3.785   2.084  -0.023
  611   HG12  ILE  76          2HG1      ILE  76  -3.454  -0.126   2.052
  612   HG13  ILE  76          1HG1      ILE  76  -4.577  -0.180   0.697
  613   HG21  ILE  76          1HG2      ILE  76  -2.091   2.043   2.513
  614   HG22  ILE  76          2HG2      ILE  76  -2.284   3.420   1.431
  615   HG23  ILE  76          3HG2      ILE  76  -1.464   1.968   0.861
  616   HD11  ILE  76          3HD1      ILE  76  -2.661  -1.534   0.255
  617   HD12  ILE  76          1HD1      ILE  76  -1.569  -0.184   0.551
  618   HD13  ILE  76          2HD1      ILE  76  -2.653  -0.157  -0.847
  619    H    SER  77           H        SER  77  -5.944   4.036   0.322
  620    HA   SER  77           HA       SER  77  -4.574   6.405   1.000
  621    HB2  SER  77           2HB      SER  77  -5.936   6.097  -1.089
  622    HB3  SER  77           1HB      SER  77  -7.403   6.182  -0.120
  623    HG   SER  77           HG       SER  77  -6.356   8.328   0.572
  624    H    ARG  78           H        ARG  78  -7.510   4.950   2.348
  625    HA   ARG  78           HA       ARG  78  -8.190   7.217   4.010
  626    HB2  ARG  78           2HB      ARG  78  -9.098   4.346   4.407
  627    HB3  ARG  78           1HB      ARG  78  -9.906   5.808   4.964
  628    HG2  ARG  78           2HG      ARG  78  -9.665   4.792   2.125
  629    HG3  ARG  78           1HG      ARG  78 -11.126   4.957   3.089
  630    HD2  ARG  78           2HD      ARG  78 -11.035   7.372   2.946
  631    HD3  ARG  78           1HD      ARG  78  -9.426   7.316   2.219
  632    HE   ARG  78           HE       ARG  78 -11.669   6.072   0.797
  633   HH11  ARG  78          1HH1      ARG  78  -9.372   8.718   0.967
  634   HH12  ARG  78          2HH1      ARG  78  -9.663   9.237  -0.665
  635   HH21  ARG  78          1HH2      ARG  78 -12.017   6.738  -1.331
  636   HH22  ARG  78          2HH2      ARG  78 -11.171   8.110  -1.973
  637    H    THR  79           H        THR  79  -6.491   4.174   4.446
  638    HA   THR  79           HA       THR  79  -6.212   4.323   7.273
  639    HB   THR  79           HB       THR  79  -4.599   2.627   5.332
  640    HG1  THR  79           HG1      THR  79  -6.440   1.661   4.994
  641   HG21  THR  79          3HG2      THR  79  -4.367   1.083   7.260
  642   HG22  THR  79          1HG2      THR  79  -5.264   2.202   8.286
  643   HG23  THR  79          2HG2      THR  79  -3.675   2.655   7.662
  644    H    VAL  80           H        VAL  80  -4.192   5.328   4.591
  645    HA   VAL  80           HA       VAL  80  -1.789   5.519   6.184
  646    HB   VAL  80           HB       VAL  80  -1.803   4.939   3.721
  647   HG11  VAL  80          1HG1      VAL  80  -2.275   7.916   3.261
  648   HG12  VAL  80          2HG1      VAL  80  -3.400   6.616   2.863
  649   HG13  VAL  80          3HG1      VAL  80  -1.851   6.732   2.022
  650   HG21  VAL  80          3HG2      VAL  80  -0.045   7.258   4.545
  651   HG22  VAL  80          1HG2      VAL  80   0.274   6.150   3.206
  652   HG23  VAL  80          2HG2      VAL  80   0.251   5.546   4.865
  653    H    GLU  81           H        GLU  81  -4.323   7.718   4.993
  654    HA   GLU  81           HA       GLU  81  -2.975  10.131   5.818
  655    HB2  GLU  81           2HB      GLU  81  -5.927   9.746   5.171
  656    HB3  GLU  81           1HB      GLU  81  -5.103  11.291   5.338
  657    HG2  GLU  81           2HG      GLU  81  -4.700   9.229   3.172
  658    HG3  GLU  81           1HG      GLU  81  -5.465  10.797   2.997
  659    H    GLN  82           H        GLN  82  -5.311   7.907   7.288
  660    HA   GLN  82           HA       GLN  82  -6.007   9.575   9.501
  661    HB2  GLN  82           2HB      GLN  82  -7.175   7.741  10.423
  662    HB3  GLN  82           1HB      GLN  82  -7.341   7.552   8.686
  663    HG2  GLN  82           2HG      GLN  82  -5.663   5.780   8.682
  664    HG3  GLN  82           1HG      GLN  82  -5.351   6.023  10.393
  665   HE21  GLN  82          1HE2      GLN  82  -6.926   5.347  11.909
  666   HE22  GLN  82          2HE2      GLN  82  -8.133   4.167  11.481
  667    H    LEU  83           H        LEU  83  -3.497   7.168   8.944
  668    HA   LEU  83           HA       LEU  83  -2.466   7.112  11.614
  669    HB2  LEU  83           2HB      LEU  83  -1.294   6.224   8.966
  670    HB3  LEU  83           1HB      LEU  83  -0.460   6.001  10.497
  671    HG   LEU  83           HG       LEU  83  -3.175   4.791   9.845
  672   HD11  LEU  83          1HD1      LEU  83  -0.456   3.458   9.863
  673   HD12  LEU  83          2HD1      LEU  83  -1.415   3.837   8.425
  674   HD13  LEU  83          3HD1      LEU  83  -2.016   2.665   9.602
  675   HD21  LEU  83          3HD2      LEU  83  -1.311   4.357  12.205
  676   HD22  LEU  83          1HD2      LEU  83  -2.763   3.408  11.863
  677   HD23  LEU  83          2HD2      LEU  83  -2.902   5.121  12.243
  678    H    LYS  84           H        LYS  84  -1.758   9.033   8.740
  679    HA   LYS  84           HA       LYS  84   0.447  10.496   9.769
  680    HB2  LYS  84           2HB      LYS  84  -1.751  11.489   7.910
  681    HB3  LYS  84           1HB      LYS  84  -0.232  12.327   8.227
  682    HG2  LYS  84           2HG      LYS  84   1.030  10.494   7.231
  683    HG3  LYS  84           1HG      LYS  84  -0.464   9.586   7.003
  684    HD2  LYS  84           2HD      LYS  84  -1.275  11.514   5.529
  685    HD3  LYS  84           1HD      LYS  84   0.381  12.131   5.586
  686    HE2  LYS  84           2HE      LYS  84   1.178   9.972   4.640
  687    HE3  LYS  84           1HE      LYS  84  -0.498   9.425   4.552
  688    HZ1  LYS  84           3HZ      LYS  84   0.167  10.215   2.411
  689    HZ2  LYS  84           1HZ      LYS  84   0.690  11.696   3.044
  690    HZ3  LYS  84           2HZ      LYS  84  -0.955  11.298   3.050
  691    H    ALA  85           H        ALA  85  -3.047  11.173   9.920
  692    HA   ALA  85           HA       ALA  85  -2.955  13.460  11.575
  693    HB1  ALA  85           3HB      ALA  85  -4.974  12.767  10.331
  694    HB2  ALA  85           1HB      ALA  85  -5.330  13.023  12.044
  695    HB3  ALA  85           2HB      ALA  85  -5.167  11.384  11.407
  696    H    GLU  86           H        GLU  86  -2.820  10.044  12.441
  697    HA   GLU  86           HA       GLU  86  -3.210  10.376  15.278
  698    HB2  GLU  86           2HB      GLU  86  -2.248   8.023  13.608
  699    HB3  GLU  86           1HB      GLU  86  -2.448   7.936  15.358
  700    HG2  GLU  86           2HG      GLU  86  -4.823   8.304  15.189
  701    HG3  GLU  86           1HG      GLU  86  -4.704   8.672  13.469
  702    H    SER  87           H        SER  87  -0.390   9.913  13.184
  703    HA   SER  87           HA       SER  87   1.426   9.612  15.454
  704    HB2  SER  87           2HB      SER  87   1.637   8.133  13.454
  705    HB3  SER  87           1HB      SER  87   2.005   9.542  12.459
  706    HG   SER  87           HG       SER  87   3.528   8.921  14.756
  707    H    ALA  88           H        ALA  88   0.522  12.087  13.157
  708    HA   ALA  88           HA       ALA  88   2.857  13.769  13.604
  709    HB1  ALA  88           3HB      ALA  88   1.766  13.707  11.393
  710    HB2  ALA  88           1HB      ALA  88   1.767  15.340  12.059
  711    HB3  ALA  88           2HB      ALA  88   0.287  14.373  12.084
  712    H    LEU  89           H        LEU  89   2.307  16.142  13.985
  713    HA   LEU  89           HA       LEU  89   1.399  16.566  16.622
  714    HB2  LEU  89           2HB      LEU  89   1.844  18.883  16.284
  715    HB3  LEU  89           1HB      LEU  89   3.102  17.971  15.476
  716    HG   LEU  89           HG       LEU  89   0.759  19.280  14.003
  717   HD11  LEU  89          1HD1      LEU  89   2.161  20.990  15.108
  718   HD12  LEU  89          2HD1      LEU  89   2.336  21.055  13.356
  719   HD13  LEU  89          3HD1      LEU  89   3.598  20.312  14.341
  720   HD21  LEU  89          3HD2      LEU  89   1.768  17.416  12.748
  721   HD22  LEU  89          1HD2      LEU  89   3.372  18.134  12.943
  722   HD23  LEU  89          2HD2      LEU  89   2.144  18.956  11.979
  723    H    GLU  90           H        GLU  90  -0.437  16.204  13.798
  724    HA   GLU  90           HA       GLU  90  -2.401  18.117  13.746
  725    HB2  GLU  90           2HB      GLU  90  -2.659  15.156  13.061
  726    HB3  GLU  90           1HB      GLU  90  -3.783  16.407  12.536
  727    HG2  GLU  90           2HG      GLU  90  -0.855  16.210  11.802
  728    HG3  GLU  90           1HG      GLU  90  -2.219  15.806  10.761
  729   H281  4EM 101          2H28      PYA 142   0.415 -11.237   7.283
  730   H283  4EM 101          3H28      PYA 142   1.513 -11.512   8.641
  731   H303  4EM 101          3H30      PYA 142  -1.986 -11.659   7.502
  732   H301  4EM 101          1H30      PYA 142  -2.649 -12.508   8.911
  733   H302  4EM 101          2H30      PYA 142  -1.651 -13.363   7.745
  734   H312  4EM 101          2H31      PYA 142  -0.977  -9.953   8.958
  735   H313  4EM 101          3H31      PYA 142  -1.636 -10.772  10.371
  736   H311  4EM 101          1H31      PYA 142   0.094 -10.412  10.294
  737    H32  4EM 101           H32      PYA 142  -0.025 -14.072   9.628
  738    H33  4EM 101           H33      PYA 142   1.728 -12.769  10.244
  739    H36  4EM 101           H36      PYA 142  -2.305 -14.505   9.794
  740   H373  4EM 101          3H37      PYA 142  -3.297 -14.668  12.474
  741   H372  4EM 101          2H37      PYA 142  -4.226 -13.550  11.475
  742   H382  4EM 101          2H38      PYA 142  -5.198 -15.824  11.550
  743   H383  4EM 101          3H38      PYA 142  -3.719 -16.461  10.851
  744    H41  4EM 101           H41      PYA 142  -4.897 -13.410   9.415
  745   H423  4EM 101          3H42      PYA 142  -6.753 -14.498   7.557
  746   H422  4EM 101          2H42      PYA 142  -5.150 -14.512   6.828
  747   H433  4EM 101          3H43      PYA 142  -6.502 -12.026   7.883
  748   H432  4EM 101          2H43      PYA 142  -6.580 -12.548   6.200
  749    H44  4EM 101           H44      PYA 142  -4.007 -12.520   6.838
  750    H49  4EM 101           H49      PYA 142  -3.537  -8.196   7.291
  751    H51  4EM 101           H51      PYA 142  -1.059  -8.116   6.441
  752    H50  4EM 101           H50      PYA 142  -0.529 -10.372   5.266
  753    H48  4EM 101           H48      PYA 142  -2.665 -11.795   5.395
  Start of MODEL   12
    1    H1   MET   1           1H       MET   1   6.788  14.525   3.230
    2    H2   MET   1           2H       MET   1   6.303  15.774   2.218
    3    H3   MET   1           3H       MET   1   6.266  14.187   1.657
    4    HA   MET   1           HA       MET   1   4.570  13.653   3.340
    5    HB2  MET   1           2HB      MET   1   5.220  15.467   4.918
    6    HB3  MET   1           1HB      MET   1   4.633  16.673   3.783
    7    HG2  MET   1           2HG      MET   1   3.045  16.344   5.574
    8    HG3  MET   1           1HG      MET   1   2.350  15.795   4.051
    9    HE1  MET   1           3HE      MET   1   5.007  13.902   6.308
   10    HE2  MET   1           1HE      MET   1   3.944  12.922   7.315
   11    HE3  MET   1           2HE      MET   1   3.949  14.678   7.488
   12    H    ASP   2           H        ASP   2   3.134  13.040   1.820
   13    HA   ASP   2           HA       ASP   2   1.797  14.994   0.074
   14    HB2  ASP   2           2HB      ASP   2   3.142  12.467  -1.010
   15    HB3  ASP   2           1HB      ASP   2   2.147  13.576  -1.941
   16    H    GLY   3           H        GLY   3   0.010  13.753  -1.216
   17    HA2  GLY   3           2HA      GLY   3  -1.222  11.590   0.431
   18    HA3  GLY   3           1HA      GLY   3  -2.136  12.938  -0.233
   19    H    GLU   4           H        GLU   4  -2.303  13.090  -2.612
   20    HA   GLU   4           HA       GLU   4  -3.037  10.476  -3.584
   21    HB2  GLU   4           2HB      GLU   4  -3.336  13.210  -4.876
   22    HB3  GLU   4           1HB      GLU   4  -3.938  11.710  -5.577
   23    HG2  GLU   4           2HG      GLU   4  -5.196  11.428  -3.295
   24    HG3  GLU   4           1HG      GLU   4  -4.898  13.154  -3.106
   25    H    GLU   5           H        GLU   5  -0.178  12.308  -3.969
   26    HA   GLU   5           HA       GLU   5   0.713  11.150  -6.440
   27    HB2  GLU   5           2HB      GLU   5   1.747  13.205  -5.455
   28    HB3  GLU   5           1HB      GLU   5   2.380  12.230  -4.134
   29    HG2  GLU   5           2HG      GLU   5   3.661  10.888  -5.850
   30    HG3  GLU   5           1HG      GLU   5   3.128  12.055  -7.062
   31    H    VAL   6           H        VAL   6   0.962  10.290  -3.010
   32    HA   VAL   6           HA       VAL   6   2.968   8.320  -3.257
   33    HB   VAL   6           HB       VAL   6   2.674   7.754  -1.016
   34   HG11  VAL   6          1HG1      VAL   6   3.210  10.109  -1.183
   35   HG12  VAL   6          2HG1      VAL   6   2.213   9.812   0.239
   36   HG13  VAL   6          3HG1      VAL   6   1.493  10.532  -1.203
   37   HG21  VAL   6          3HG2      VAL   6   0.596   7.964   0.325
   38   HG22  VAL   6          1HG2      VAL   6   0.385   6.877  -1.046
   39   HG23  VAL   6          2HG2      VAL   6  -0.268   8.510  -1.113
   40    H    LYS   7           H        LYS   7  -0.452   8.231  -3.672
   41    HA   LYS   7           HA       LYS   7  -1.164   5.603  -3.628
   42    HB2  LYS   7           2HB      LYS   7  -2.066   7.782  -5.551
   43    HB3  LYS   7           1HB      LYS   7  -2.889   6.243  -5.364
   44    HG2  LYS   7           2HG      LYS   7  -3.196   6.869  -2.891
   45    HG3  LYS   7           1HG      LYS   7  -2.661   8.489  -3.350
   46    HD2  LYS   7           2HD      LYS   7  -5.156   7.011  -4.249
   47    HD3  LYS   7           1HD      LYS   7  -5.045   8.559  -3.417
   48    HE2  LYS   7           2HE      LYS   7  -4.049   9.559  -5.459
   49    HE3  LYS   7           1HE      LYS   7  -4.214   8.015  -6.286
   50    HZ1  LYS   7           3HZ      LYS   7  -5.989   9.507  -6.865
   51    HZ2  LYS   7           1HZ      LYS   7  -6.456   9.677  -5.251
   52    HZ3  LYS   7           2HZ      LYS   7  -6.615   8.184  -6.033
   53    H    GLU   8           H        GLU   8  -0.065   7.277  -6.631
   54    HA   GLU   8           HA       GLU   8  -0.033   4.816  -8.125
   55    HB2  GLU   8           2HB      GLU   8   0.619   6.087 -10.026
   56    HB3  GLU   8           1HB      GLU   8  -0.580   7.001  -9.137
   57    HG2  GLU   8           2HG      GLU   8   0.837   8.711  -9.658
   58    HG3  GLU   8           1HG      GLU   8   1.588   8.215  -8.146
   59    H    LYS   9           H        LYS   9   2.264   6.403  -6.119
   60    HA   LYS   9           HA       LYS   9   4.604   5.025  -7.123
   61    HB2  LYS   9           2HB      LYS   9   4.206   6.545  -4.515
   62    HB3  LYS   9           1HB      LYS   9   5.748   5.983  -5.157
   63    HG2  LYS   9           2HG      LYS   9   5.372   7.465  -7.167
   64    HG3  LYS   9           1HG      LYS   9   3.949   8.121  -6.353
   65    HD2  LYS   9           2HD      LYS   9   6.815   8.261  -5.333
   66    HD3  LYS   9           1HD      LYS   9   5.913   9.581  -6.072
   67    HE2  LYS   9           2HE      LYS   9   4.372   9.642  -4.211
   68    HE3  LYS   9           1HE      LYS   9   5.108   8.207  -3.490
   69    HZ1  LYS   9           3HZ      LYS   9   5.961  10.062  -2.364
   70    HZ2  LYS   9           1HZ      LYS   9   6.316  10.905  -3.785
   71    HZ3  LYS   9           2HZ      LYS   9   7.208   9.529  -3.358
   72    H    ILE  10           H        ILE  10   2.106   4.352  -4.743
   73    HA   ILE  10           HA       ILE  10   3.432   2.095  -3.508
   74    HB   ILE  10           HB       ILE  10   0.441   2.681  -3.685
   75   HG12  ILE  10          2HG1      ILE  10   1.480   4.510  -2.496
   76   HG13  ILE  10          1HG1      ILE  10   0.647   3.512  -1.321
   77   HG21  ILE  10          1HG2      ILE  10   1.898   0.754  -1.851
   78   HG22  ILE  10          2HG2      ILE  10   0.801   0.333  -3.168
   79   HG23  ILE  10          3HG2      ILE  10   0.182   1.163  -1.741
   80   HD11  ILE  10          3HD1      ILE  10   2.763   4.266  -0.456
   81   HD12  ILE  10          1HD1      ILE  10   3.621   3.577  -1.831
   82   HD13  ILE  10          2HD1      ILE  10   2.809   2.518  -0.672
   83    H    ARG  11           H        ARG  11   0.981   2.550  -6.030
   84    HA   ARG  11           HA       ARG  11   0.567  -0.038  -6.953
   85    HB2  ARG  11           2HB      ARG  11   0.671   2.551  -8.550
   86    HB3  ARG  11           1HB      ARG  11   0.066   1.030  -9.200
   87    HG2  ARG  11           2HG      ARG  11  -1.785   1.031  -7.642
   88    HG3  ARG  11           1HG      ARG  11  -1.127   2.443  -6.803
   89    HD2  ARG  11           2HD      ARG  11  -2.974   3.099  -8.284
   90    HD3  ARG  11           1HD      ARG  11  -1.459   3.816  -8.828
   91    HE   ARG  11           HE       ARG  11  -1.557   1.648 -10.353
   92   HH11  ARG  11          1HH1      ARG  11  -4.024   4.075  -9.763
   93   HH12  ARG  11          2HH1      ARG  11  -4.780   3.847 -11.306
   94   HH21  ARG  11          1HH2      ARG  11  -2.568   1.358 -12.356
   95   HH22  ARG  11          2HH2      ARG  11  -3.951   2.316 -12.758
   96    H    ARG  12           H        ARG  12   3.074   2.279  -7.995
   97    HA   ARG  12           HA       ARG  12   4.369   0.519  -9.789
   98    HB2  ARG  12           2HB      ARG  12   4.965   3.213  -8.681
   99    HB3  ARG  12           1HB      ARG  12   6.393   2.285  -9.116
  100    HG2  ARG  12           2HG      ARG  12   5.715   3.679 -11.001
  101    HG3  ARG  12           1HG      ARG  12   5.525   1.975 -11.407
  102    HD2  ARG  12           2HD      ARG  12   3.066   2.242 -10.784
  103    HD3  ARG  12           1HD      ARG  12   3.353   3.984 -10.745
  104    HE   ARG  12           HE       ARG  12   3.893   2.371 -13.164
  105   HH11  ARG  12          1HH1      ARG  12   2.209   5.079 -11.666
  106   HH12  ARG  12          2HH1      ARG  12   1.582   5.671 -13.170
  107   HH21  ARG  12          1HH2      ARG  12   2.982   3.101 -15.091
  108   HH22  ARG  12          2HH2      ARG  12   2.023   4.544 -15.112
  109    H    TYR  13           H        TYR  13   5.253   1.422  -6.411
  110    HA   TYR  13           HA       TYR  13   7.598  -0.030  -6.188
  111    HB2  TYR  13           2HB      TYR  13   6.916   1.526  -4.432
  112    HB3  TYR  13           1HB      TYR  13   5.549   0.502  -3.994
  113    HD1  TYR  13           HD1      TYR  13   9.302   0.121  -4.412
  114    HD2  TYR  13           HD2      TYR  13   5.859  -0.805  -2.051
  115    HE1  TYR  13           HE1      TYR  13  10.723  -1.077  -2.806
  116    HE2  TYR  13           HE2      TYR  13   7.286  -1.985  -0.453
  117    HH   TYR  13           HH       TYR  13   9.653  -3.208  -0.641
  118    H    ILE  14           H        ILE  14   4.310  -1.240  -5.574
  119    HA   ILE  14           HA       ILE  14   4.967  -3.838  -4.709
  120    HB   ILE  14           HB       ILE  14   2.433  -2.914  -6.140
  121   HG12  ILE  14          2HG1      ILE  14   2.951  -3.217  -3.141
  122   HG13  ILE  14          1HG1      ILE  14   2.930  -1.676  -3.989
  123   HG21  ILE  14          1HG2      ILE  14   2.662  -5.356  -6.220
  124   HG22  ILE  14          2HG2      ILE  14   1.366  -4.904  -5.118
  125   HG23  ILE  14          3HG2      ILE  14   2.929  -5.414  -4.476
  126   HD11  ILE  14          3HD1      ILE  14   0.859  -2.017  -2.828
  127   HD12  ILE  14          1HD1      ILE  14   0.608  -3.566  -3.632
  128   HD13  ILE  14          2HD1      ILE  14   0.557  -2.066  -4.565
  129    H    MET  15           H        MET  15   4.105  -2.657  -7.985
  130    HA   MET  15           HA       MET  15   4.350  -5.241  -9.211
  131    HB2  MET  15           2HB      MET  15   4.257  -2.471 -10.476
  132    HB3  MET  15           1HB      MET  15   4.058  -3.994 -11.344
  133    HG2  MET  15           2HG      MET  15   2.243  -2.862  -9.219
  134    HG3  MET  15           1HG      MET  15   1.903  -3.002 -10.939
  135    HE1  MET  15           3HE      MET  15   2.916  -5.966 -11.641
  136    HE2  MET  15           1HE      MET  15   1.377  -5.272 -12.161
  137    HE3  MET  15           2HE      MET  15   1.414  -6.853 -11.384
  138    H    GLU  16           H        GLU  16   6.531  -2.417  -9.156
  139    HA   GLU  16           HA       GLU  16   8.430  -3.373 -10.998
  140    HB2  GLU  16           2HB      GLU  16   8.870  -1.326  -8.801
  141    HB3  GLU  16           1HB      GLU  16   9.883  -1.552 -10.220
  142    HG2  GLU  16           2HG      GLU  16   7.103  -0.379 -10.063
  143    HG3  GLU  16           1HG      GLU  16   8.586   0.382 -10.613
  144    H    ASP  17           H        ASP  17   8.218  -3.517  -7.469
  145    HA   ASP  17           HA       ASP  17  10.818  -4.936  -7.322
  146    HB2  ASP  17           2HB      ASP  17  10.663  -2.905  -5.955
  147    HB3  ASP  17           1HB      ASP  17   9.198  -3.499  -5.183
  148    H    LEU  18           H        LEU  18   7.604  -5.074  -5.719
  149    HA   LEU  18           HA       LEU  18   8.125  -7.528  -4.389
  150    HB2  LEU  18           2HB      LEU  18   5.520  -6.066  -4.892
  151    HB3  LEU  18           1HB      LEU  18   5.604  -7.548  -3.969
  152    HG   LEU  18           HG       LEU  18   6.986  -6.435  -2.256
  153   HD11  LEU  18          1HD1      LEU  18   7.342  -4.020  -2.235
  154   HD12  LEU  18          2HD1      LEU  18   6.628  -3.877  -3.841
  155   HD13  LEU  18          3HD1      LEU  18   8.149  -4.745  -3.624
  156   HD21  LEU  18          3HD2      LEU  18   4.436  -4.941  -2.922
  157   HD22  LEU  18          1HD2      LEU  18   5.240  -4.965  -1.349
  158   HD23  LEU  18          2HD2      LEU  18   4.560  -6.449  -2.009
  159    H    ILE  19           H        ILE  19   6.382  -6.818  -7.424
  160    HA   ILE  19           HA       ILE  19   6.008  -9.643  -8.038
  161    HB   ILE  19           HB       ILE  19   5.395  -7.098  -9.589
  162   HG12  ILE  19          2HG1      ILE  19   3.045  -7.981  -9.591
  163   HG13  ILE  19          1HG1      ILE  19   3.581  -9.346  -8.640
  164   HG21  ILE  19          1HG2      ILE  19   6.267  -8.664 -11.251
  165   HG22  ILE  19          2HG2      ILE  19   4.523  -8.461 -11.467
  166   HG23  ILE  19          3HG2      ILE  19   5.151  -9.916 -10.688
  167   HD11  ILE  19          3HD1      ILE  19   3.571  -6.470  -7.766
  168   HD12  ILE  19          1HD1      ILE  19   4.116  -7.843  -6.793
  169   HD13  ILE  19          2HD1      ILE  19   2.427  -7.729  -7.287
  170    H    GLY  20           H        GLY  20   7.864  -6.897  -9.320
  171    HA2  GLY  20           2HA      GLY  20  10.294  -7.277  -9.732
  172    HA3  GLY  20           1HA      GLY  20   9.830  -8.763 -10.559
  173    HA   PRO  21           HA       PRO  21  10.163  -5.023 -13.494
  174    HB2  PRO  21           2HB      PRO  21  12.033  -6.080 -15.228
  175    HB3  PRO  21           1HB      PRO  21  12.466  -5.208 -13.744
  176    HG2  PRO  21           2HG      PRO  21  12.290  -8.170 -14.187
  177    HG3  PRO  21           1HG      PRO  21  13.564  -7.220 -13.387
  178    HD2  PRO  21           2HD      PRO  21  11.681  -8.521 -11.954
  179    HD3  PRO  21           1HD      PRO  21  12.335  -6.947 -11.430
  180    H    SER  22           H        SER  22   9.486  -8.396 -13.859
  181    HA   SER  22           HA       SER  22   8.171  -8.131 -16.470
  182    HB2  SER  22           2HB      SER  22   8.370 -10.506 -14.571
  183    HB3  SER  22           1HB      SER  22   7.821 -10.554 -16.247
  184    HG   SER  22           HG       SER  22  10.284  -9.408 -15.947
  185    H    ALA  23           H        ALA  23   7.134  -6.412 -14.559
  186    HA   ALA  23           HA       ALA  23   5.036  -7.383 -12.938
  187    HB1  ALA  23           3HB      ALA  23   6.176  -5.284 -12.489
  188    HB2  ALA  23           1HB      ALA  23   4.445  -5.001 -12.698
  189    HB3  ALA  23           2HB      ALA  23   5.570  -4.602 -14.001
  190    H    LYS  24           H        LYS  24   2.973  -7.846 -13.403
  191    HA   LYS  24           HA       LYS  24   1.939  -7.663 -16.093
  192    HB2  LYS  24           2HB      LYS  24   0.722  -8.825 -13.546
  193    HB3  LYS  24           1HB      LYS  24  -0.077  -8.843 -15.114
  194    HG2  LYS  24           2HG      LYS  24   0.854 -10.990 -14.922
  195    HG3  LYS  24           1HG      LYS  24   1.972 -10.129 -15.979
  196    HD2  LYS  24           2HD      LYS  24   3.438  -9.722 -13.949
  197    HD3  LYS  24           1HD      LYS  24   2.354 -10.778 -13.034
  198    HE2  LYS  24           2HE      LYS  24   4.321 -12.023 -13.801
  199    HE3  LYS  24           1HE      LYS  24   2.871 -12.639 -14.592
  200    HZ1  LYS  24           3HZ      LYS  24   4.694 -12.407 -16.147
  201    HZ2  LYS  24           1HZ      LYS  24   4.848 -10.765 -15.793
  202    HZ3  LYS  24           2HZ      LYS  24   3.455 -11.341 -16.563
  203    H    GLU  25           H        GLU  25   1.967  -5.405 -16.242
  204    HA   GLU  25           HA       GLU  25   0.761  -3.468 -14.642
  205    HB2  GLU  25           2HB      GLU  25   0.761  -2.059 -16.739
  206    HB3  GLU  25           1HB      GLU  25   2.286  -2.856 -16.401
  207    HG2  GLU  25           2HG      GLU  25   1.960  -4.493 -18.113
  208    HG3  GLU  25           1HG      GLU  25   0.272  -4.034 -18.332
  209    H    ASP  26           H        ASP  26  -0.648  -5.621 -16.946
  210    HA   ASP  26           HA       ASP  26  -3.031  -4.293 -17.617
  211    HB2  ASP  26           2HB      ASP  26  -2.501  -7.297 -17.544
  212    HB3  ASP  26           1HB      ASP  26  -3.762  -6.491 -18.475
  213    H    GLU  27           H        GLU  27  -2.127  -6.403 -14.989
  214    HA   GLU  27           HA       GLU  27  -4.826  -6.691 -13.893
  215    HB2  GLU  27           2HB      GLU  27  -2.146  -7.797 -12.929
  216    HB3  GLU  27           1HB      GLU  27  -3.722  -8.219 -12.264
  217    HG2  GLU  27           2HG      GLU  27  -4.387  -9.146 -14.457
  218    HG3  GLU  27           1HG      GLU  27  -2.786  -8.757 -15.089
  219    H    LEU  28           H        LEU  28  -2.201  -4.589 -13.539
  220    HA   LEU  28           HA       LEU  28  -2.665  -3.822 -10.800
  221    HB2  LEU  28           2HB      LEU  28  -0.415  -3.814 -11.863
  222    HB3  LEU  28           1HB      LEU  28  -0.926  -2.555 -12.961
  223    HG   LEU  28           HG       LEU  28   0.548  -1.935 -10.908
  224   HD11  LEU  28          1HD1      LEU  28  -0.411   0.288 -10.679
  225   HD12  LEU  28          2HD1      LEU  28  -1.899  -0.265 -11.449
  226   HD13  LEU  28          3HD1      LEU  28  -0.391  -0.236 -12.362
  227   HD21  LEU  28          3HD2      LEU  28  -0.743  -3.094  -9.154
  228   HD22  LEU  28          1HD2      LEU  28  -2.119  -2.018  -9.444
  229   HD23  LEU  28          2HD2      LEU  28  -0.599  -1.373  -8.822
  230    H    ASP  29           H        ASP  29  -4.094  -2.391 -10.141
  231    HA   ASP  29           HA       ASP  29  -4.599   0.095 -11.497
  232    HB2  ASP  29           2HB      ASP  29  -6.305  -1.691 -12.480
  233    HB3  ASP  29           1HB      ASP  29  -7.078  -1.586 -10.903
  234    H    ASP  30           H        ASP  30  -6.096   1.462 -10.100
  235    HA   ASP  30           HA       ASP  30  -5.277   1.192  -7.334
  236    HB2  ASP  30           2HB      ASP  30  -6.249   3.453  -7.058
  237    HB3  ASP  30           1HB      ASP  30  -5.094   3.377  -8.379
  238    H    GLN  31           H        GLN  31  -8.142   0.835  -9.233
  239    HA   GLN  31           HA       GLN  31  -9.968   0.486  -6.978
  240    HB2  GLN  31           2HB      GLN  31 -10.471   0.159  -9.970
  241    HB3  GLN  31           1HB      GLN  31 -11.689   0.377  -8.714
  242    HG2  GLN  31           2HG      GLN  31 -11.087   2.669  -8.386
  243    HG3  GLN  31           1HG      GLN  31  -9.596   2.488  -9.313
  244   HE21  GLN  31          1HE2      GLN  31  -9.753   2.201 -11.618
  245   HE22  GLN  31          2HE2      GLN  31 -11.112   2.855 -12.473
  246    H    THR  32           H        THR  32  -7.682  -1.452  -8.353
  247    HA   THR  32           HA       THR  32  -9.178  -3.954  -8.445
  248    HB   THR  32           HB       THR  32  -6.233  -3.296  -8.812
  249    HG1  THR  32           HG1      THR  32  -8.102  -2.964 -10.415
  250   HG21  THR  32          3HG2      THR  32  -7.535  -6.036  -9.049
  251   HG22  THR  32          1HG2      THR  32  -6.353  -5.561  -7.831
  252   HG23  THR  32          2HG2      THR  32  -5.884  -5.637  -9.532
  253    HA   PRO  33           HA       PRO  33  -8.447  -4.584  -3.985
  254    HB2  PRO  33           2HB      PRO  33  -9.515  -7.136  -3.830
  255    HB3  PRO  33           1HB      PRO  33 -10.487  -5.653  -3.852
  256    HG2  PRO  33           2HG      PRO  33  -9.926  -7.558  -6.069
  257    HG3  PRO  33           1HG      PRO  33 -11.418  -6.681  -5.678
  258    HD2  PRO  33           2HD      PRO  33  -9.700  -5.910  -7.663
  259    HD3  PRO  33           1HD      PRO  33 -10.756  -4.777  -6.796
  260    H    LEU  34           H        LEU  34  -6.352  -4.799  -3.551
  261    HA   LEU  34           HA       LEU  34  -4.489  -6.315  -5.012
  262    HB2  LEU  34           2HB      LEU  34  -4.200  -4.960  -2.301
  263    HB3  LEU  34           1HB      LEU  34  -2.873  -5.727  -3.141
  264    HG   LEU  34           HG       LEU  34  -2.676  -3.357  -3.413
  265   HD11  LEU  34          1HD1      LEU  34  -2.623  -3.055  -5.841
  266   HD12  LEU  34          2HD1      LEU  34  -3.627  -4.490  -6.058
  267   HD13  LEU  34          3HD1      LEU  34  -2.001  -4.638  -5.387
  268   HD21  LEU  34          3HD2      LEU  34  -4.320  -1.916  -4.481
  269   HD22  LEU  34          1HD2      LEU  34  -4.928  -2.630  -2.989
  270   HD23  LEU  34          2HD2      LEU  34  -5.456  -3.265  -4.548
  271    H    LEU  35           H        LEU  35  -5.708  -6.808  -1.655
  272    HA   LEU  35           HA       LEU  35  -4.342  -9.196  -1.087
  273    HB2  LEU  35           2HB      LEU  35  -6.901  -8.018   0.002
  274    HB3  LEU  35           1HB      LEU  35  -6.468  -9.651   0.473
  275    HG   LEU  35           HG       LEU  35  -5.784  -8.065   2.194
  276   HD11  LEU  35          1HD1      LEU  35  -3.412  -8.666   2.455
  277   HD12  LEU  35          2HD1      LEU  35  -3.349  -9.210   0.777
  278   HD13  LEU  35          3HD1      LEU  35  -4.375 -10.049   1.943
  279   HD21  LEU  35          3HD2      LEU  35  -4.061  -6.723   0.095
  280   HD22  LEU  35          1HD2      LEU  35  -4.064  -6.363   1.824
  281   HD23  LEU  35          2HD2      LEU  35  -5.505  -6.053   0.861
  282    H    GLU  36           H        GLU  36  -7.543  -8.736  -2.530
  283    HA   GLU  36           HA       GLU  36  -8.379 -11.427  -2.590
  284    HB2  GLU  36           2HB      GLU  36  -9.936  -9.482  -2.798
  285    HB3  GLU  36           1HB      GLU  36  -9.280  -9.132  -4.394
  286    HG2  GLU  36           2HG      GLU  36 -10.096 -11.374  -5.154
  287    HG3  GLU  36           1HG      GLU  36 -10.846 -11.590  -3.573
  288    H    TRP  37           H        TRP  37  -6.533  -9.495  -4.908
  289    HA   TRP  37           HA       TRP  37  -6.567 -11.595  -6.963
  290    HB2  TRP  37           2HB      TRP  37  -5.324  -8.824  -6.810
  291    HB3  TRP  37           1HB      TRP  37  -4.923  -9.925  -8.120
  292    HD1  TRP  37           HD1      TRP  37  -8.402  -8.980  -6.597
  293    HE1  TRP  37           HE1      TRP  37  -9.923  -8.220  -8.507
  294    HE3  TRP  37           HE3      TRP  37  -5.092  -9.375 -10.495
  295    HZ2  TRP  37           HZ2      TRP  37  -9.774  -7.839 -11.306
  296    HZ3  TRP  37           HZ3      TRP  37  -5.869  -8.793 -12.758
  297    HH2  TRP  37           HH2      TRP  37  -8.160  -8.043 -13.154
  298    H    GLY  38           H        GLY  38  -5.004 -11.367  -4.113
  299    HA2  GLY  38           2HA      GLY  38  -3.250 -12.491  -3.178
  300    HA3  GLY  38           1HA      GLY  38  -3.035 -13.334  -4.707
  301    H    ILE  39           H        ILE  39  -2.955  -9.883  -4.601
  302    HA   ILE  39           HA       ILE  39  -0.287  -9.747  -5.677
  303    HB   ILE  39           HB       ILE  39  -2.278  -7.568  -4.890
  304   HG12  ILE  39          2HG1      ILE  39  -1.542  -8.628  -7.659
  305   HG13  ILE  39          1HG1      ILE  39  -3.029  -8.997  -6.798
  306   HG21  ILE  39          1HG2      ILE  39  -0.899  -5.966  -6.130
  307   HG22  ILE  39          2HG2      ILE  39   0.308  -7.216  -6.435
  308   HG23  ILE  39          3HG2      ILE  39   0.001  -6.667  -4.785
  309   HD11  ILE  39          3HD1      ILE  39  -3.666  -6.617  -6.931
  310   HD12  ILE  39          1HD1      ILE  39  -3.423  -7.355  -8.514
  311   HD13  ILE  39          2HD1      ILE  39  -2.188  -6.292  -7.843
  312    H    LEU  40           H        LEU  40  -1.874  -9.228  -2.584
  313    HA   LEU  40           HA       LEU  40   0.739  -8.682  -1.281
  314    HB2  LEU  40           2HB      LEU  40  -2.022  -7.804  -0.337
  315    HB3  LEU  40           1HB      LEU  40  -0.492  -7.435   0.442
  316    HG   LEU  40           HG       LEU  40  -1.413  -6.398  -2.264
  317   HD11  LEU  40          1HD1      LEU  40  -2.589  -5.319  -0.440
  318   HD12  LEU  40          2HD1      LEU  40  -1.440  -4.195  -1.158
  319   HD13  LEU  40          3HD1      LEU  40  -1.066  -4.963   0.388
  320   HD21  LEU  40          3HD2      LEU  40   0.617  -5.031  -2.255
  321   HD22  LEU  40          1HD2      LEU  40   0.994  -6.751  -2.292
  322   HD23  LEU  40          2HD2      LEU  40   1.170  -5.840  -0.785
  323    H    ASN  41           H        ASN  41   1.359 -10.007   0.279
  324    HA   ASN  41           HA       ASN  41  -0.306 -11.258   2.183
  325    HB2  ASN  41           2HB      ASN  41  -0.660 -12.812   0.164
  326    HB3  ASN  41           1HB      ASN  41   1.032 -13.250   0.290
  327   HD21  ASN  41          1HD2      ASN  41  -2.101 -13.378   1.883
  328   HD22  ASN  41          2HD2      ASN  41  -1.725 -14.697   2.938
  329    H    SER  42           H        SER  42   1.064 -12.680   3.674
  330    HA   SER  42           HA       SER  42   2.731 -11.447   5.203
  331    HB2  SER  42           3HB      SER  42   2.132 -13.816   5.516
  332    HB3  SER  42           2HB      SER  42   3.337 -14.284   4.318
  333    H    MET  43           H        MET  43   4.169 -13.035   2.396
  334    HA   MET  43           HA       MET  43   6.859 -12.654   3.077
  335    HB2  MET  43           2HB      MET  43   5.794 -12.954   0.246
  336    HB3  MET  43           1HB      MET  43   7.386 -13.393   0.847
  337    HG2  MET  43           2HG      MET  43   6.220 -15.419   0.594
  338    HG3  MET  43           1HG      MET  43   6.235 -15.090   2.329
  339    HE1  MET  43           3HE      MET  43   3.821 -13.147  -0.167
  340    HE2  MET  43           1HE      MET  43   2.459 -14.266  -0.244
  341    HE3  MET  43           2HE      MET  43   4.008 -14.715  -0.961
  342    H    ASN  44           H        ASN  44   4.727 -10.841   0.871
  343    HA   ASN  44           HA       ASN  44   6.845  -8.823   0.478
  344    HB2  ASN  44           2HB      ASN  44   5.889  -8.328  -1.664
  345    HB3  ASN  44           1HB      ASN  44   6.131 -10.060  -1.542
  346   HD21  ASN  44          1HD2      ASN  44   4.393  -8.485  -3.301
  347   HD22  ASN  44          2HD2      ASN  44   2.811  -9.108  -3.072
  348    H    ILE  45           H        ILE  45   4.034  -9.198   2.212
  349    HA   ILE  45           HA       ILE  45   2.781  -6.639   1.760
  350    HB   ILE  45           HB       ILE  45   1.718  -8.834   2.680
  351   HG12  ILE  45          2HG1      ILE  45   0.929  -6.289   4.168
  352   HG13  ILE  45          1HG1      ILE  45   0.534  -6.574   2.475
  353   HG21  ILE  45          1HG2      ILE  45   1.597  -9.084   5.119
  354   HG22  ILE  45          2HG2      ILE  45   2.704  -7.726   5.330
  355   HG23  ILE  45          3HG2      ILE  45   3.267  -9.209   4.557
  356   HD11  ILE  45          3HD1      ILE  45  -0.754  -8.570   3.116
  357   HD12  ILE  45          1HD1      ILE  45  -1.355  -7.106   3.903
  358   HD13  ILE  45          2HD1      ILE  45  -0.376  -8.257   4.815
  359    H    VAL  46           H        VAL  46   5.421  -7.737   3.672
  360    HA   VAL  46           HA       VAL  46   5.458  -5.691   5.689
  361    HB   VAL  46           HB       VAL  46   7.670  -7.596   4.809
  362   HG11  VAL  46          1HG1      VAL  46   7.336  -6.094   7.428
  363   HG12  VAL  46          2HG1      VAL  46   8.539  -5.746   6.183
  364   HG13  VAL  46          3HG1      VAL  46   8.602  -7.270   7.069
  365   HG21  VAL  46          3HG2      VAL  46   6.911  -9.068   6.641
  366   HG22  VAL  46          1HG2      VAL  46   5.630  -8.825   5.451
  367   HG23  VAL  46          2HG2      VAL  46   5.581  -7.962   6.989
  368    H    LYS  47           H        LYS  47   6.535  -5.939   2.434
  369    HA   LYS  47           HA       LYS  47   8.619  -4.005   2.381
  370    HB2  LYS  47           2HB      LYS  47   6.795  -5.098   0.213
  371    HB3  LYS  47           1HB      LYS  47   7.976  -3.841  -0.130
  372    HG2  LYS  47           2HG      LYS  47   8.836  -6.014  -0.779
  373    HG3  LYS  47           1HG      LYS  47   9.802  -5.333   0.533
  374    HD2  LYS  47           2HD      LYS  47   8.744  -6.812   2.145
  375    HD3  LYS  47           1HD      LYS  47   7.614  -7.394   0.925
  376    HE2  LYS  47           2HE      LYS  47   9.365  -9.045   1.286
  377    HE3  LYS  47           1HE      LYS  47   9.503  -8.377  -0.339
  378    HZ1  LYS  47           3HZ      LYS  47  11.636  -8.583   0.779
  379    HZ2  LYS  47           1HZ      LYS  47  11.129  -7.530   1.992
  380    HZ3  LYS  47           2HZ      LYS  47  11.291  -6.978   0.405
  381    H    LEU  48           H        LEU  48   5.111  -3.801   2.143
  382    HA   LEU  48           HA       LEU  48   4.929  -1.040   1.457
  383    HB2  LEU  48           2HB      LEU  48   2.933  -2.878   2.836
  384    HB3  LEU  48           1HB      LEU  48   2.569  -1.216   2.420
  385    HG   LEU  48           HG       LEU  48   1.561  -2.560   0.737
  386   HD11  LEU  48          1HD1      LEU  48   2.645  -0.537  -0.156
  387   HD12  LEU  48          2HD1      LEU  48   2.639  -1.832  -1.346
  388   HD13  LEU  48          3HD1      LEU  48   4.125  -1.450  -0.476
  389   HD21  LEU  48          3HD2      LEU  48   2.723  -4.240  -0.619
  390   HD22  LEU  48          1HD2      LEU  48   2.759  -4.666   1.091
  391   HD23  LEU  48          2HD2      LEU  48   4.200  -4.000   0.317
  392    H    MET  49           H        MET  49   5.024  -2.784   4.538
  393    HA   MET  49           HA       MET  49   4.294  -0.725   6.300
  394    HB2  MET  49           2HB      MET  49   6.305  -2.939   6.925
  395    HB3  MET  49           1HB      MET  49   5.334  -2.048   8.086
  396    HG2  MET  49           2HG      MET  49   3.313  -3.154   7.313
  397    HG3  MET  49           1HG      MET  49   4.217  -3.971   6.029
  398    HE1  MET  49           3HE      MET  49   2.544  -5.878   7.676
  399    HE2  MET  49           1HE      MET  49   3.635  -7.067   8.389
  400    HE3  MET  49           2HE      MET  49   3.824  -6.595   6.700
  401    H    VAL  50           H        VAL  50   7.515  -1.762   5.204
  402    HA   VAL  50           HA       VAL  50   8.995   0.273   6.597
  403    HB   VAL  50           HB       VAL  50  10.009  -1.921   6.101
  404   HG11  VAL  50          1HG1      VAL  50   9.914  -1.128   3.167
  405   HG12  VAL  50          2HG1      VAL  50   8.985  -2.423   3.935
  406   HG13  VAL  50          3HG1      VAL  50  10.742  -2.546   3.822
  407   HG21  VAL  50          3HG2      VAL  50  12.216  -1.198   5.249
  408   HG22  VAL  50          1HG2      VAL  50  11.565  -0.051   6.422
  409   HG23  VAL  50          2HG2      VAL  50  11.503   0.320   4.699
  410    H    TYR  51           H        TYR  51   7.518   0.061   3.421
  411    HA   TYR  51           HA       TYR  51   9.094   2.031   2.068
  412    HB2  TYR  51           2HB      TYR  51   7.718   0.317   0.873
  413    HB3  TYR  51           1HB      TYR  51   6.257   1.139   1.408
  414    HD1  TYR  51           HD1      TYR  51   9.367   1.642  -0.633
  415    HD2  TYR  51           HD2      TYR  51   5.365   2.940   0.098
  416    HE1  TYR  51           HE1      TYR  51   9.458   3.041  -2.646
  417    HE2  TYR  51           HE2      TYR  51   5.460   4.342  -1.918
  418    HH   TYR  51           HH       TYR  51   7.107   5.433  -3.339
  419    H    ILE  52           H        ILE  52   5.805   2.162   3.427
  420    HA   ILE  52           HA       ILE  52   5.437   4.949   2.987
  421    HB   ILE  52           HB       ILE  52   3.914   2.991   4.773
  422   HG12  ILE  52          2HG1      ILE  52   2.030   3.488   3.063
  423   HG13  ILE  52          1HG1      ILE  52   3.258   4.265   2.079
  424   HG21  ILE  52          1HG2      ILE  52   3.206   5.872   4.219
  425   HG22  ILE  52          2HG2      ILE  52   3.734   5.207   5.762
  426   HG23  ILE  52          3HG2      ILE  52   2.192   4.705   5.076
  427   HD11  ILE  52          3HD1      ILE  52   4.395   2.158   1.799
  428   HD12  ILE  52          1HD1      ILE  52   2.697   2.013   1.340
  429   HD13  ILE  52          2HD1      ILE  52   3.252   1.368   2.891
  430    H    ARG  53           H        ARG  53   6.747   3.033   5.618
  431    HA   ARG  53           HA       ARG  53   6.985   4.974   7.648
  432    HB2  ARG  53           2HB      ARG  53   7.268   2.536   7.990
  433    HB3  ARG  53           1HB      ARG  53   8.755   2.581   7.055
  434    HG2  ARG  53           2HG      ARG  53   9.832   3.967   8.778
  435    HG3  ARG  53           1HG      ARG  53   8.328   4.013   9.705
  436    HD2  ARG  53           2HD      ARG  53   8.444   1.503   9.899
  437    HD3  ARG  53           1HD      ARG  53  10.020   1.564   9.102
  438    HE   ARG  53           HE       ARG  53  10.726   3.016  11.020
  439   HH11  ARG  53          1HH1      ARG  53   8.160   0.662  11.441
  440   HH12  ARG  53          2HH1      ARG  53   8.441   0.487  13.144
  441   HH21  ARG  53          1HH2      ARG  53  11.069   2.813  13.247
  442   HH22  ARG  53          2HH2      ARG  53  10.094   1.713  14.169
  443    H    ASP  54           H        ASP  54   8.955   4.324   4.822
  444    HA   ASP  54           HA       ASP  54  11.172   6.021   5.685
  445    HB2  ASP  54           2HB      ASP  54  11.693   3.932   4.484
  446    HB3  ASP  54           1HB      ASP  54  10.694   4.431   3.120
  447    H    GLU  55           H        GLU  55   8.867   5.944   2.969
  448    HA   GLU  55           HA       GLU  55   9.763   8.407   1.827
  449    HB2  GLU  55           2HB      GLU  55   8.965   6.510   0.445
  450    HB3  GLU  55           1HB      GLU  55   7.353   6.669   1.137
  451    HG2  GLU  55           2HG      GLU  55   7.117   8.896   0.107
  452    HG3  GLU  55           1HG      GLU  55   8.752   8.786  -0.532
  453    H    MET  56           H        MET  56   6.593   7.465   3.285
  454    HA   MET  56           HA       MET  56   5.786  10.264   3.524
  455    HB2  MET  56           2HB      MET  56   4.423   7.619   4.074
  456    HB3  MET  56           1HB      MET  56   3.745   9.087   4.768
  457    HG2  MET  56           2HG      MET  56   2.667   8.462   2.644
  458    HG3  MET  56           1HG      MET  56   3.432  10.046   2.578
  459    HE1  MET  56           3HE      MET  56   4.854   6.331   2.120
  460    HE2  MET  56           1HE      MET  56   4.887   6.279   0.359
  461    HE3  MET  56           2HE      MET  56   3.345   6.416   1.207
  462    H    GLY  57           H        GLY  57   7.372   7.929   5.501
  463    HA2  GLY  57           2HA      GLY  57   8.555   8.350   7.449
  464    HA3  GLY  57           1HA      GLY  57   7.754   9.904   7.608
  465    H    VAL  58           H        VAL  58   5.673   7.165   7.158
  466    HA   VAL  58           HA       VAL  58   5.133   7.019  10.080
  467    HB   VAL  58           HB       VAL  58   3.464   8.551   9.183
  468   HG11  VAL  58          1HG1      VAL  58   1.834   7.927   7.424
  469   HG12  VAL  58          2HG1      VAL  58   2.699   6.410   7.163
  470   HG13  VAL  58          3HG1      VAL  58   3.486   7.947   6.798
  471   HG21  VAL  58          3HG2      VAL  58   2.183   5.845   9.672
  472   HG22  VAL  58          1HG2      VAL  58   1.397   7.414   9.847
  473   HG23  VAL  58          2HG2      VAL  58   2.721   6.964  10.925
  474    H    SER  59           H        SER  59   5.352   4.970  10.730
  475    HA   SER  59           HA       SER  59   5.458   2.721   8.971
  476    HB2  SER  59           2HB      SER  59   6.764   2.926  11.129
  477    HB3  SER  59           1HB      SER  59   5.253   2.776  12.025
  478    HG   SER  59           HG       SER  59   5.301   0.694  11.722
  479    H    ILE  60           H        ILE  60   3.824   1.262   8.459
  480    HA   ILE  60           HA       ILE  60   1.203   1.361   9.727
  481    HB   ILE  60           HB       ILE  60   2.403  -0.750   7.858
  482   HG12  ILE  60          2HG1      ILE  60   1.902   1.572   6.847
  483   HG13  ILE  60          1HG1      ILE  60   1.141   0.195   6.056
  484   HG21  ILE  60          1HG2      ILE  60   0.074  -1.627   7.650
  485   HG22  ILE  60          2HG2      ILE  60  -0.442  -0.525   8.931
  486   HG23  ILE  60          3HG2      ILE  60   0.729  -1.797   9.276
  487   HD11  ILE  60          3HD1      ILE  60  -0.983   0.701   7.132
  488   HD12  ILE  60          1HD1      ILE  60  -0.369   2.118   6.278
  489   HD13  ILE  60          2HD1      ILE  60  -0.233   2.021   8.032
  490    HA   PRO  61           HA       PRO  61   3.082  -1.107  13.085
  491    HB2  PRO  61           2HB      PRO  61   1.018  -0.880  14.879
  492    HB3  PRO  61           1HB      PRO  61   2.175   0.435  14.587
  493    HG2  PRO  61           2HG      PRO  61  -0.588   0.089  13.507
  494    HG3  PRO  61           1HG      PRO  61   0.199   1.554  14.130
  495    HD2  PRO  61           2HD      PRO  61  -0.059   0.989  11.461
  496    HD3  PRO  61           1HD      PRO  61   1.264   1.978  12.113
  497    H    SER  62           H        SER  62   2.473  -3.077  14.250
  498    HA   SER  62           HA       SER  62   1.481  -5.086  12.534
  499    HB2  SER  62           2HB      SER  62   3.171  -5.555  14.246
  500    HB3  SER  62           1HB      SER  62   2.037  -5.160  15.535
  501    HG   SER  62           HG       SER  62   0.949  -7.037  13.991
  502    H    THR  63           H        THR  63  -0.043  -3.249  15.107
  503    HA   THR  63           HA       THR  63  -2.457  -4.725  15.353
  504    HB   THR  63           HB       THR  63  -1.666  -3.176  17.099
  505    HG1  THR  63           HG1      THR  63  -3.933  -3.655  16.894
  506   HG21  THR  63          3HG2      THR  63  -0.760  -1.379  15.661
  507   HG22  THR  63          1HG2      THR  63  -1.884  -0.748  16.868
  508   HG23  THR  63          2HG2      THR  63  -2.403  -0.931  15.192
  509    H    HIS  64           H        HIS  64  -1.369  -2.706  12.818
  510    HA   HIS  64           HA       HIS  64  -4.112  -2.376  11.719
  511    HB2  HIS  64           2HB      HIS  64  -1.653  -0.645  11.282
  512    HB3  HIS  64           1HB      HIS  64  -3.138  -0.507  10.342
  513    HD1  HIS  64           HD1      HIS  64  -4.649  -1.118  13.387
  514    HD2  HIS  64           HD2      HIS  64  -2.373   2.084  12.027
  515    HE1  HIS  64           HE1      HIS  64  -5.218   0.803  14.896
  516    HE2  HIS  64           HE2      HIS  64  -3.710   2.671  14.161
  517    H    ILE  65           H        ILE  65  -1.931  -4.621  11.513
  518    HA   ILE  65           HA       ILE  65  -1.826  -4.830   8.596
  519    HB   ILE  65           HB       ILE  65  -1.038  -6.966  10.628
  520   HG12  ILE  65          2HG1      ILE  65   0.400  -5.035  10.976
  521   HG13  ILE  65          1HG1      ILE  65   1.329  -6.251  10.103
  522   HG21  ILE  65          1HG2      ILE  65  -0.523  -6.725   7.631
  523   HG22  ILE  65          2HG2      ILE  65  -1.518  -7.934   8.447
  524   HG23  ILE  65          3HG2      ILE  65   0.227  -7.928   8.683
  525   HD11  ILE  65          3HD1      ILE  65   0.986  -5.034   8.021
  526   HD12  ILE  65          1HD1      ILE  65   1.721  -4.005   9.251
  527   HD13  ILE  65          2HD1      ILE  65   0.006  -3.833   8.871
  528    H    THR  66           H        THR  66  -3.893  -4.918   7.938
  529    HA   THR  66           HA       THR  66  -5.143  -7.500   8.186
  530    HB   THR  66           HB       THR  66  -6.200  -6.374  10.079
  531    HG1  THR  66           HG1      THR  66  -7.613  -7.714   9.048
  532   HG21  THR  66          3HG2      THR  66  -5.885  -4.035   9.394
  533   HG22  THR  66          1HG2      THR  66  -7.565  -4.355   9.835
  534   HG23  THR  66          2HG2      THR  66  -7.109  -4.231   8.133
  535    H    GLY  67           H        GLY  67  -7.059  -7.631   6.709
  536    HA2  GLY  67           2HA      GLY  67  -6.307  -7.132   4.079
  537    HA3  GLY  67           1HA      GLY  67  -7.912  -7.594   4.611
  538    H    LYS  68           H        LYS  68  -8.735  -5.392   6.061
  539    HA   LYS  68           HA       LYS  68  -9.915  -3.931   3.978
  540    HB2  LYS  68           2HB      LYS  68 -10.905  -2.497   5.681
  541    HB3  LYS  68           1HB      LYS  68 -10.974  -4.184   6.162
  542    HG2  LYS  68           2HG      LYS  68  -9.543  -3.900   7.957
  543    HG3  LYS  68           1HG      LYS  68  -8.635  -2.603   7.177
  544    HD2  LYS  68           2HD      LYS  68  -9.888  -1.738   9.109
  545    HD3  LYS  68           1HD      LYS  68 -10.489  -1.020   7.615
  546    HE2  LYS  68           2HE      LYS  68 -12.308  -1.611   9.162
  547    HE3  LYS  68           1HE      LYS  68 -12.424  -2.524   7.657
  548    HZ1  LYS  68           3HZ      LYS  68 -11.279  -3.551  10.199
  549    HZ2  LYS  68           1HZ      LYS  68 -11.476  -4.427   8.764
  550    HZ3  LYS  68           2HZ      LYS  68 -12.827  -3.883   9.614
  551    H    TYR  69           H        TYR  69  -6.993  -3.128   5.778
  552    HA   TYR  69           HA       TYR  69  -7.005  -0.325   5.025
  553    HB2  TYR  69           2HB      TYR  69  -4.961  -2.041   6.470
  554    HB3  TYR  69           1HB      TYR  69  -4.674  -0.346   6.079
  555    HD1  TYR  69           HD2      TYR  69  -7.563   0.667   6.678
  556    HD2  TYR  69           HD1      TYR  69  -4.897  -1.844   8.877
  557    HE1  TYR  69           HE2      TYR  69  -8.629   1.368   8.765
  558    HE2  TYR  69           HE1      TYR  69  -5.967  -1.132  10.962
  559    HH   TYR  69           HH       TYR  69  -8.896   0.637  11.014
  560    H    PHE  70           H        PHE  70  -5.457  -3.266   3.963
  561    HA   PHE  70           HA       PHE  70  -3.941  -1.848   1.845
  562    HB2  PHE  70           2HB      PHE  70  -3.725  -4.660   2.977
  563    HB3  PHE  70           1HB      PHE  70  -2.820  -4.115   1.573
  564    HD1  PHE  70           HD1      PHE  70  -1.042  -2.388   1.801
  565    HD2  PHE  70           HD2      PHE  70  -3.052  -3.951   5.237
  566    HE1  PHE  70           HE1      PHE  70   0.725  -1.492   3.246
  567    HE2  PHE  70           HE2      PHE  70  -1.271  -3.058   6.674
  568    HZ   PHE  70           HZ       PHE  70   0.617  -1.821   5.673
  569    H    LYS  71           H        LYS  71  -6.918  -2.899   2.130
  570    HA   LYS  71           HA       LYS  71  -7.476  -4.995   0.444
  571    HB2  LYS  71           2HB      LYS  71  -8.929  -3.331   2.107
  572    HB3  LYS  71           1HB      LYS  71  -9.566  -2.849   0.550
  573    HG2  LYS  71           2HG      LYS  71  -9.457  -5.762   1.359
  574    HG3  LYS  71           1HG      LYS  71 -10.768  -4.729   1.914
  575    HD2  LYS  71           2HD      LYS  71 -10.084  -5.094  -1.026
  576    HD3  LYS  71           1HD      LYS  71 -11.239  -6.114  -0.170
  577    HE2  LYS  71           2HE      LYS  71 -12.668  -4.218   0.293
  578    HE3  LYS  71           1HE      LYS  71 -11.478  -3.098  -0.378
  579    HZ1  LYS  71           3HZ      LYS  71 -12.827  -5.229  -1.948
  580    HZ2  LYS  71           1HZ      LYS  71 -11.821  -4.006  -2.539
  581    HZ3  LYS  71           2HZ      LYS  71 -13.330  -3.617  -1.895
  582    H    ASP  72           H        ASP  72  -7.331  -1.595  -0.244
  583    HA   ASP  72           HA       ASP  72  -6.843  -2.033  -3.066
  584    HB2  ASP  72           2HB      ASP  72  -9.154  -0.325  -2.013
  585    HB3  ASP  72           1HB      ASP  72  -8.431  -0.036  -3.588
  586    H    LEU  73           H        LEU  73  -6.315   0.197  -4.017
  587    HA   LEU  73           HA       LEU  73  -4.241   1.361  -2.456
  588    HB2  LEU  73           2HB      LEU  73  -4.188   1.226  -4.928
  589    HB3  LEU  73           1HB      LEU  73  -5.529   2.362  -5.006
  590    HG   LEU  73           HG       LEU  73  -4.024   4.023  -3.748
  591   HD11  LEU  73          1HD1      LEU  73  -2.394   2.427  -2.873
  592   HD12  LEU  73          2HD1      LEU  73  -1.600   3.632  -3.881
  593   HD13  LEU  73          3HD1      LEU  73  -1.886   2.011  -4.514
  594   HD21  LEU  73          3HD2      LEU  73  -4.500   4.385  -6.052
  595   HD22  LEU  73          1HD2      LEU  73  -3.373   3.125  -6.554
  596   HD23  LEU  73          2HD2      LEU  73  -2.769   4.612  -5.838
  597    H    ASN  74           H        ASN  74  -7.499   2.416  -3.377
  598    HA   ASN  74           HA       ASN  74  -7.521   4.940  -2.117
  599    HB2  ASN  74           2HB      ASN  74 -10.060   4.608  -2.045
  600    HB3  ASN  74           1HB      ASN  74  -9.312   4.503  -3.628
  601   HD21  ASN  74          1HD2      ASN  74  -9.210   2.510  -4.684
  602   HD22  ASN  74          2HD2      ASN  74 -10.188   1.173  -4.198
  603    H    ALA  75           H        ALA  75  -8.245   1.691  -0.887
  604    HA   ALA  75           HA       ALA  75  -9.004   2.356   1.734
  605    HB1  ALA  75           3HB      ALA  75  -8.406   0.037   2.294
  606    HB2  ALA  75           1HB      ALA  75  -7.526  -0.112   0.775
  607    HB3  ALA  75           2HB      ALA  75  -9.278   0.111   0.758
  608    H    ILE  76           H        ILE  76  -5.775   1.767   0.357
  609    HA   ILE  76           HA       ILE  76  -4.247   2.193   2.722
  610    HB   ILE  76           HB       ILE  76  -3.438   2.361  -0.212
  611   HG12  ILE  76          2HG1      ILE  76  -2.937   0.209   1.879
  612   HG13  ILE  76          1HG1      ILE  76  -4.189   0.114   0.642
  613   HG21  ILE  76          1HG2      ILE  76  -1.854   3.725   1.117
  614   HG22  ILE  76          2HG2      ILE  76  -1.069   2.259   0.534
  615   HG23  ILE  76          3HG2      ILE  76  -1.591   2.370   2.216
  616   HD11  ILE  76          3HD1      ILE  76  -1.207   0.114   0.223
  617   HD12  ILE  76          1HD1      ILE  76  -2.412   0.110  -1.075
  618   HD13  ILE  76          2HD1      ILE  76  -2.325  -1.243   0.054
  619    H    SER  77           H        SER  77  -5.420   4.430   0.207
  620    HA   SER  77           HA       SER  77  -3.762   6.606   1.079
  621    HB2  SER  77           2HB      SER  77  -5.048   7.981  -0.494
  622    HB3  SER  77           1HB      SER  77  -4.569   6.468  -1.245
  623    HG   SER  77           HG       SER  77  -7.036   6.401  -0.044
  624    H    ARG  78           H        ARG  78  -6.856   5.355   2.129
  625    HA   ARG  78           HA       ARG  78  -7.472   7.752   3.682
  626    HB2  ARG  78           2HB      ARG  78  -8.841   5.065   3.943
  627    HB3  ARG  78           1HB      ARG  78  -9.443   6.632   4.454
  628    HG2  ARG  78           2HG      ARG  78  -9.489   5.347   1.763
  629    HG3  ARG  78           1HG      ARG  78 -10.720   6.277   2.588
  630    HD2  ARG  78           2HD      ARG  78  -8.314   7.368   1.106
  631    HD3  ARG  78           1HD      ARG  78  -9.997   7.436   0.588
  632    HE   ARG  78           HE       ARG  78  -9.452   8.781   3.103
  633   HH11  ARG  78          1HH1      ARG  78  -9.627   9.133  -0.389
  634   HH12  ARG  78          2HH1      ARG  78  -9.821  10.852  -0.327
  635   HH21  ARG  78          1HH2      ARG  78  -9.553  11.056   3.147
  636   HH22  ARG  78          2HH2      ARG  78  -9.778  11.937   1.669
  637    H    THR  79           H        THR  79  -5.947   4.601   4.162
  638    HA   THR  79           HA       THR  79  -5.883   4.691   7.038
  639    HB   THR  79           HB       THR  79  -4.039   3.077   5.218
  640    HG1  THR  79           HG1      THR  79  -5.740   1.941   4.754
  641   HG21  THR  79          3HG2      THR  79  -3.304   3.107   7.601
  642   HG22  THR  79          1HG2      THR  79  -3.912   1.513   7.145
  643   HG23  THR  79          2HG2      THR  79  -4.921   2.598   8.097
  644    H    VAL  80           H        VAL  80  -3.677   5.647   4.459
  645    HA   VAL  80           HA       VAL  80  -1.373   5.923   6.144
  646    HB   VAL  80           HB       VAL  80  -1.316   5.309   3.673
  647   HG11  VAL  80          1HG1      VAL  80  -1.831   8.268   3.199
  648   HG12  VAL  80          2HG1      VAL  80  -2.939   6.946   2.824
  649   HG13  VAL  80          3HG1      VAL  80  -1.398   7.073   1.973
  650   HG21  VAL  80          3HG2      VAL  80   0.394   7.697   4.456
  651   HG22  VAL  80          1HG2      VAL  80   0.743   6.547   3.159
  652   HG23  VAL  80          2HG2      VAL  80   0.721   6.006   4.838
  653    H    GLU  81           H        GLU  81  -3.893   8.081   4.952
  654    HA   GLU  81           HA       GLU  81  -2.603  10.540   5.685
  655    HB2  GLU  81           2HB      GLU  81  -4.752  11.622   5.201
  656    HB3  GLU  81           1HB      GLU  81  -4.330  10.479   3.929
  657    HG2  GLU  81           2HG      GLU  81  -5.944   8.879   4.716
  658    HG3  GLU  81           1HG      GLU  81  -6.250   9.823   6.171
  659    H    GLN  82           H        GLN  82  -4.941   8.378   7.245
  660    HA   GLN  82           HA       GLN  82  -5.652  10.166   9.340
  661    HB2  GLN  82           2HB      GLN  82  -6.877   8.346  10.357
  662    HB3  GLN  82           1HB      GLN  82  -7.137   8.278   8.620
  663    HG2  GLN  82           2HG      GLN  82  -5.590   6.416   8.410
  664    HG3  GLN  82           1HG      GLN  82  -5.154   6.541  10.111
  665   HE21  GLN  82          1HE2      GLN  82  -6.566   5.704  11.678
  666   HE22  GLN  82          2HE2      GLN  82  -7.901   4.689  11.264
  667    H    LEU  83           H        LEU  83  -3.206   7.641   9.030
  668    HA   LEU  83           HA       LEU  83  -2.505   7.376  11.749
  669    HB2  LEU  83           2HB      LEU  83  -0.796   6.995   9.269
  670    HB3  LEU  83           1HB      LEU  83  -0.347   6.454  10.881
  671    HG   LEU  83           HG       LEU  83  -2.722   5.428   9.287
  672   HD11  LEU  83          1HD1      LEU  83  -0.625   4.662   8.318
  673   HD12  LEU  83          2HD1      LEU  83  -1.439   3.327   9.128
  674   HD13  LEU  83          3HD1      LEU  83  -0.058   4.113   9.899
  675   HD21  LEU  83          3HD2      LEU  83  -3.194   5.357  11.677
  676   HD22  LEU  83          1HD2      LEU  83  -1.662   4.528  11.973
  677   HD23  LEU  83          2HD2      LEU  83  -2.937   3.733  11.047
  678    H    LYS  84           H        LYS  84  -1.372   9.581   9.251
  679    HA   LYS  84           HA       LYS  84   0.663  10.862  10.815
  680    HB2  LYS  84           2HB      LYS  84  -0.734  11.827   8.283
  681    HB3  LYS  84           1HB      LYS  84   0.746  12.504   8.954
  682    HG2  LYS  84           2HG      LYS  84   1.902  10.369   8.563
  683    HG3  LYS  84           1HG      LYS  84   0.424   9.682   7.900
  684    HD2  LYS  84           2HD      LYS  84   1.828  12.098   6.696
  685    HD3  LYS  84           1HD      LYS  84   2.166  10.441   6.210
  686    HE2  LYS  84           2HE      LYS  84   0.649  11.455   4.614
  687    HE3  LYS  84           1HE      LYS  84  -0.197  10.188   5.495
  688    HZ1  LYS  84           3HZ      LYS  84  -1.288  11.861   6.822
  689    HZ2  LYS  84           1HZ      LYS  84  -1.539  12.190   5.186
  690    HZ3  LYS  84           2HZ      LYS  84  -0.425  13.099   6.071
  691    H    ALA  85           H        ALA  85  -2.779  11.278  10.496
  692    HA   ALA  85           HA       ALA  85  -2.906  13.877  11.797
  693    HB1  ALA  85           3HB      ALA  85  -5.091  11.839  11.226
  694    HB2  ALA  85           1HB      ALA  85  -4.626  13.174  10.163
  695    HB3  ALA  85           2HB      ALA  85  -5.338  13.508  11.744
  696    H    GLU  86           H        GLU  86  -3.567  10.508  12.721
  697    HA   GLU  86           HA       GLU  86  -4.667  11.034  15.270
  698    HB2  GLU  86           2HB      GLU  86  -3.577   8.423  14.132
  699    HB3  GLU  86           1HB      GLU  86  -4.500   8.543  15.621
  700    HG2  GLU  86           2HG      GLU  86  -5.473   9.013  12.797
  701    HG3  GLU  86           1HG      GLU  86  -5.919   7.703  13.883
  702    H    SER  87           H        SER  87  -1.561   9.662  14.214
  703    HA   SER  87           HA       SER  87  -0.561   9.283  16.874
  704    HB2  SER  87           2HB      SER  87   0.969   9.217  14.240
  705    HB3  SER  87           1HB      SER  87   1.462   8.470  15.764
  706    HG   SER  87           HG       SER  87  -0.486   7.688  13.927
  707    H    ALA  88           H        ALA  88  -0.561  11.971  14.714
  708    HA   ALA  88           HA       ALA  88   1.702  13.324  15.990
  709    HB1  ALA  88           3HB      ALA  88   1.463  15.022  14.273
  710    HB2  ALA  88           1HB      ALA  88  -0.035  14.278  13.704
  711    HB3  ALA  88           2HB      ALA  88   1.496  13.419  13.534
  712    H    LEU  89           H        LEU  89  -1.552  14.559  15.130
  713    HA   LEU  89           HA       LEU  89  -1.203  16.409  17.413
  714    HB2  LEU  89           2HB      LEU  89  -2.412  18.058  15.956
  715    HB3  LEU  89           1HB      LEU  89  -0.819  17.551  15.426
  716    HG   LEU  89           HG       LEU  89  -2.074  15.951  13.784
  717   HD11  LEU  89          1HD1      LEU  89  -4.367  17.843  14.379
  718   HD12  LEU  89          2HD1      LEU  89  -4.332  16.107  14.696
  719   HD13  LEU  89          3HD1      LEU  89  -4.296  16.698  13.038
  720   HD21  LEU  89          3HD2      LEU  89  -0.792  17.911  13.043
  721   HD22  LEU  89          1HD2      LEU  89  -2.181  18.958  13.346
  722   HD23  LEU  89          2HD2      LEU  89  -2.255  17.729  12.080
  723    H    GLU  90           H        GLU  90  -3.468  14.176  15.970
  724    HA   GLU  90           HA       GLU  90  -5.801  15.248  17.251
  725    HB2  GLU  90           2HB      GLU  90  -5.872  14.120  15.054
  726    HB3  GLU  90           1HB      GLU  90  -5.279  12.634  15.792
  727    HG2  GLU  90           2HG      GLU  90  -7.636  12.538  15.368
  728    HG3  GLU  90           1HG      GLU  90  -7.301  12.434  17.088
  729   H281  4EM 101          2H28      PYA 142   2.060 -11.357   7.530
  730   H283  4EM 101          3H28      PYA 142   3.231 -10.129   7.999
  731   H303  4EM 101          3H30      PYA 142   1.289 -12.497  10.992
  732   H301  4EM 101          1H30      PYA 142   2.442 -13.264   9.889
  733   H302  4EM 101          2H30      PYA 142   0.871 -12.703   9.292
  734   H312  4EM 101          2H31      PYA 142   0.771 -10.064  10.773
  735   H313  4EM 101          3H31      PYA 142   1.583  -9.082   9.560
  736   H311  4EM 101          1H31      PYA 142   0.385 -10.285   9.060
  737    H32  4EM 101           H32      PYA 142   4.265 -11.431  10.481
  738    H33  4EM 101           H33      PYA 142   4.626  -9.267  11.032
  739    H36  4EM 101           H36      PYA 142   2.006  -9.185  12.124
  740   H373  4EM 101          3H37      PYA 142   2.306 -10.692  14.639
  741   H372  4EM 101          2H37      PYA 142   1.725  -9.043  14.461
  742   H382  4EM 101          2H38      PYA 142  -0.087 -10.583  15.107
  743   H383  4EM 101          3H38      PYA 142   0.217 -11.541  13.657
  744    H41  4EM 101           H41      PYA 142  -1.739 -11.256  12.607
  745   H423  4EM 101          3H42      PYA 142  -2.285  -8.722  11.324
  746   H422  4EM 101          2H42      PYA 142  -3.491  -9.199  12.518
  747   H433  4EM 101          3H43      PYA 142  -4.254  -9.844  10.321
  748   H432  4EM 101          2H43      PYA 142  -3.861 -11.299  11.238
  749    H44  4EM 101           H44      PYA 142  -1.911 -11.501  10.098
  750    H49  4EM 101           H49      PYA 142  -1.961  -9.500   6.042
  751    H51  4EM 101           H51      PYA 142  -0.061 -10.970   5.001
  752    H50  4EM 101           H50      PYA 142   0.640 -12.747   6.773
  753    H48  4EM 101           H48      PYA 142  -0.862 -12.382   8.816
  Start of MODEL   13
    1    H1   MET   1           1H       MET   1   7.141  16.202  -3.901
    2    H2   MET   1           2H       MET   1   5.985  17.310  -3.362
    3    H3   MET   1           3H       MET   1   5.568  16.152  -4.521
    4    HA   MET   1           HA       MET   1   5.870  14.389  -2.970
    5    HB2  MET   1           2HB      MET   1   7.680  15.535  -1.658
    6    HB3  MET   1           1HB      MET   1   6.465  16.576  -0.926
    7    HG2  MET   1           2HG      MET   1   7.115  14.770   0.578
    8    HG3  MET   1           1HG      MET   1   5.417  14.609   0.117
    9    HE1  MET   1           3HE      MET   1   7.176  12.326   1.462
   10    HE2  MET   1           1HE      MET   1   6.771  10.896   0.509
   11    HE3  MET   1           2HE      MET   1   5.500  12.011   1.008
   12    H    ASP   2           H        ASP   2   3.766  14.342  -3.761
   13    HA   ASP   2           HA       ASP   2   1.681  15.925  -2.377
   14    HB2  ASP   2           2HB      ASP   2   1.605  14.571  -5.118
   15    HB3  ASP   2           1HB      ASP   2   0.272  15.459  -4.393
   16    H    GLY   3           H        GLY   3  -0.296  14.833  -1.834
   17    HA2  GLY   3           2HA      GLY   3   0.073  12.288  -0.597
   18    HA3  GLY   3           1HA      GLY   3  -1.419  13.210  -0.677
   19    H    GLU   4           H        GLU   4  -1.383  13.289  -3.657
   20    HA   GLU   4           HA       GLU   4  -2.426  10.613  -4.194
   21    HB2  GLU   4           2HB      GLU   4  -2.459  13.136  -5.892
   22    HB3  GLU   4           1HB      GLU   4  -3.156  11.597  -6.392
   23    HG2  GLU   4           2HG      GLU   4  -4.545  11.749  -4.196
   24    HG3  GLU   4           1HG      GLU   4  -4.076  13.447  -4.185
   25    H    GLU   5           H        GLU   5   0.367  12.515  -4.962
   26    HA   GLU   5           HA       GLU   5   1.401  11.029  -7.151
   27    HB2  GLU   5           2HB      GLU   5   2.233  13.248  -6.642
   28    HB3  GLU   5           1HB      GLU   5   2.722  12.747  -5.026
   29    HG2  GLU   5           2HG      GLU   5   4.409  11.206  -6.110
   30    HG3  GLU   5           1HG      GLU   5   3.982  11.937  -7.657
   31    H    VAL   6           H        VAL   6   1.809  10.738  -3.611
   32    HA   VAL   6           HA       VAL   6   3.764   8.676  -3.706
   33    HB   VAL   6           HB       VAL   6   3.329   8.237  -1.328
   34   HG11  VAL   6          1HG1      VAL   6   4.780  10.132  -1.886
   35   HG12  VAL   6          2HG1      VAL   6   3.872  10.458  -0.411
   36   HG13  VAL   6          3HG1      VAL   6   3.384  11.215  -1.928
   37   HG21  VAL   6          3HG2      VAL   6   0.984  10.164  -1.559
   38   HG22  VAL   6          1HG2      VAL   6   1.591   9.460  -0.057
   39   HG23  VAL   6          2HG2      VAL   6   0.869   8.425  -1.290
   40    H    LYS   7           H        LYS   7   0.272   8.642  -3.906
   41    HA   LYS   7           HA       LYS   7  -0.363   6.009  -3.311
   42    HB2  LYS   7           2HB      LYS   7  -1.561   7.867  -5.394
   43    HB3  LYS   7           1HB      LYS   7  -2.239   6.286  -5.044
   44    HG2  LYS   7           2HG      LYS   7  -2.521   7.072  -2.634
   45    HG3  LYS   7           1HG      LYS   7  -2.116   8.693  -3.212
   46    HD2  LYS   7           2HD      LYS   7  -4.476   6.973  -4.080
   47    HD3  LYS   7           1HD      LYS   7  -4.543   8.469  -3.157
   48    HE2  LYS   7           2HE      LYS   7  -3.619   9.673  -5.154
   49    HE3  LYS   7           1HE      LYS   7  -3.711   8.176  -6.066
   50    HZ1  LYS   7           3HZ      LYS   7  -6.084   9.369  -4.765
   51    HZ2  LYS   7           1HZ      LYS   7  -6.028   8.206  -5.990
   52    HZ3  LYS   7           2HZ      LYS   7  -5.596   9.809  -6.323
   53    H    GLU   8           H        GLU   8   0.404   7.283  -6.580
   54    HA   GLU   8           HA       GLU   8   0.430   4.741  -7.842
   55    HB2  GLU   8           2HB      GLU   8   1.357   5.862  -9.799
   56    HB3  GLU   8           1HB      GLU   8   0.051   6.824  -9.122
   57    HG2  GLU   8           2HG      GLU   8   1.725   8.319  -8.055
   58    HG3  GLU   8           1HG      GLU   8   3.019   7.372  -8.788
   59    H    LYS   9           H        LYS   9   2.966   6.621  -6.207
   60    HA   LYS   9           HA       LYS   9   5.185   5.093  -7.119
   61    HB2  LYS   9           2HB      LYS   9   4.936   6.680  -4.538
   62    HB3  LYS   9           1HB      LYS   9   6.436   6.053  -5.208
   63    HG2  LYS   9           2HG      LYS   9   6.020   7.522  -7.249
   64    HG3  LYS   9           1HG      LYS   9   4.695   8.261  -6.349
   65    HD2  LYS   9           2HD      LYS   9   7.643   8.274  -5.596
   66    HD3  LYS   9           1HD      LYS   9   6.684   9.652  -6.122
   67    HE2  LYS   9           2HE      LYS   9   5.430   9.666  -4.069
   68    HE3  LYS   9           1HE      LYS   9   6.100   8.112  -3.574
   69    HZ1  LYS   9           3HZ      LYS   9   8.282   9.174  -3.439
   70    HZ2  LYS   9           1HZ      LYS   9   7.160   9.862  -2.384
   71    HZ3  LYS   9           2HZ      LYS   9   7.591  10.666  -3.808
   72    H    ILE  10           H        ILE  10   2.888   4.576  -4.500
   73    HA   ILE  10           HA       ILE  10   4.183   2.395  -3.205
   74    HB   ILE  10           HB       ILE  10   1.179   2.861  -3.505
   75   HG12  ILE  10          2HG1      ILE  10   2.135   4.811  -2.433
   76   HG13  ILE  10          1HG1      ILE  10   1.282   3.882  -1.215
   77   HG21  ILE  10          1HG2      ILE  10   0.918   1.477  -1.462
   78   HG22  ILE  10          2HG2      ILE  10   2.650   1.131  -1.493
   79   HG23  ILE  10          3HG2      ILE  10   1.612   0.566  -2.804
   80   HD11  ILE  10          3HD1      ILE  10   3.443   3.011  -0.398
   81   HD12  ILE  10          1HD1      ILE  10   3.346   4.771  -0.337
   82   HD13  ILE  10          2HD1      ILE  10   4.272   3.989  -1.615
   83    H    ARG  11           H        ARG  11   1.893   2.619  -5.913
   84    HA   ARG  11           HA       ARG  11   1.644  -0.217  -6.298
   85    HB2  ARG  11           2HB      ARG  11   0.900   1.962  -8.269
   86    HB3  ARG  11           1HB      ARG  11   0.348   0.294  -8.293
   87    HG2  ARG  11           2HG      ARG  11  -0.460   2.535  -6.457
   88    HG3  ARG  11           1HG      ARG  11  -1.468   1.506  -7.465
   89    HD2  ARG  11           2HD      ARG  11  -0.146   0.813  -4.830
   90    HD3  ARG  11           1HD      ARG  11  -1.863   0.887  -5.206
   91    HE   ARG  11           HE       ARG  11  -1.243  -1.092  -6.788
   92   HH11  ARG  11          1HH1      ARG  11  -0.014  -0.518  -3.552
   93   HH12  ARG  11          2HH1      ARG  11   0.249  -2.194  -3.212
   94   HH21  ARG  11          1HH2      ARG  11  -0.916  -3.321  -6.308
   95   HH22  ARG  11          2HH2      ARG  11  -0.262  -3.776  -4.772
   96    H    ARG  12           H        ARG  12   3.759   2.234  -7.618
   97    HA   ARG  12           HA       ARG  12   4.785   0.687  -9.816
   98    HB2  ARG  12           2HB      ARG  12   5.453   3.328  -8.543
   99    HB3  ARG  12           1HB      ARG  12   6.783   2.527  -9.367
  100    HG2  ARG  12           2HG      ARG  12   5.608   4.147 -10.843
  101    HG3  ARG  12           1HG      ARG  12   5.543   2.495 -11.463
  102    HD2  ARG  12           2HD      ARG  12   3.253   2.250 -10.626
  103    HD3  ARG  12           1HD      ARG  12   3.314   3.873  -9.942
  104    HE   ARG  12           HE       ARG  12   3.819   4.059 -12.696
  105   HH11  ARG  12          1HH1      ARG  12   1.201   3.205 -10.518
  106   HH12  ARG  12          2HH1      ARG  12  -0.047   3.696 -11.615
  107   HH21  ARG  12          1HH2      ARG  12   2.186   4.733 -14.116
  108   HH22  ARG  12          2HH2      ARG  12   0.515   4.569 -13.667
  109    H    TYR  13           H        TYR  13   5.864   1.429  -6.526
  110    HA   TYR  13           HA       TYR  13   8.169  -0.136  -6.395
  111    HB2  TYR  13           2HB      TYR  13   7.535   1.430  -4.612
  112    HB3  TYR  13           1HB      TYR  13   6.123   0.458  -4.214
  113    HD1  TYR  13           HD1      TYR  13   9.857  -0.047  -4.591
  114    HD2  TYR  13           HD2      TYR  13   6.352  -0.902  -2.279
  115    HE1  TYR  13           HE1      TYR  13  11.214  -1.309  -2.991
  116    HE2  TYR  13           HE2      TYR  13   7.726  -2.155  -0.681
  117    HH   TYR  13           HH       TYR  13  10.053  -3.451  -0.910
  118    H    ILE  14           H        ILE  14   4.780  -1.098  -6.027
  119    HA   ILE  14           HA       ILE  14   5.256  -3.803  -5.289
  120    HB   ILE  14           HB       ILE  14   2.808  -2.467  -6.497
  121   HG12  ILE  14          2HG1      ILE  14   3.415  -1.680  -4.225
  122   HG13  ILE  14          1HG1      ILE  14   1.904  -2.578  -4.199
  123   HG21  ILE  14          1HG2      ILE  14   3.036  -5.285  -5.386
  124   HG22  ILE  14          2HG2      ILE  14   2.672  -4.834  -7.053
  125   HG23  ILE  14          3HG2      ILE  14   1.518  -4.468  -5.773
  126   HD11  ILE  14          3HD1      ILE  14   4.603  -3.589  -3.322
  127   HD12  ILE  14          1HD1      ILE  14   3.122  -4.553  -3.351
  128   HD13  ILE  14          2HD1      ILE  14   3.245  -3.149  -2.294
  129    H    MET  15           H        MET  15   4.196  -2.476  -8.468
  130    HA   MET  15           HA       MET  15   4.224  -4.895  -9.915
  131    HB2  MET  15           2HB      MET  15   4.773  -2.058 -10.954
  132    HB3  MET  15           1HB      MET  15   4.379  -3.430 -11.973
  133    HG2  MET  15           2HG      MET  15   2.368  -2.805  -9.888
  134    HG3  MET  15           1HG      MET  15   2.583  -1.574 -11.124
  135    HE1  MET  15           3HE      MET  15   0.989  -5.854 -11.932
  136    HE2  MET  15           1HE      MET  15   1.337  -5.207 -10.329
  137    HE3  MET  15           2HE      MET  15   2.664  -5.636 -11.414
  138    H    GLU  16           H        GLU  16   6.769  -2.382  -9.653
  139    HA   GLU  16           HA       GLU  16   8.537  -3.653 -11.538
  140    HB2  GLU  16           2HB      GLU  16   9.073  -1.327  -9.636
  141    HB3  GLU  16           1HB      GLU  16  10.076  -1.788 -11.009
  142    HG2  GLU  16           2HG      GLU  16   8.339  -1.189 -12.574
  143    HG3  GLU  16           1HG      GLU  16   7.187  -0.909 -11.270
  144    H    ASP  17           H        ASP  17   8.462  -3.387  -7.965
  145    HA   ASP  17           HA       ASP  17  11.008  -4.896  -7.765
  146    HB2  ASP  17           2HB      ASP  17  10.976  -2.875  -6.427
  147    HB3  ASP  17           1HB      ASP  17   9.442  -3.313  -5.697
  148    H    LEU  18           H        LEU  18   7.754  -5.030  -6.200
  149    HA   LEU  18           HA       LEU  18   8.306  -7.521  -4.925
  150    HB2  LEU  18           2HB      LEU  18   5.742  -5.963  -5.260
  151    HB3  LEU  18           1HB      LEU  18   5.760  -7.520  -4.461
  152    HG   LEU  18           HG       LEU  18   5.817  -5.910  -2.724
  153   HD11  LEU  18          1HD1      LEU  18   7.873  -6.340  -1.534
  154   HD12  LEU  18          2HD1      LEU  18   8.708  -6.793  -3.019
  155   HD13  LEU  18          3HD1      LEU  18   7.396  -7.798  -2.393
  156   HD21  LEU  18          3HD2      LEU  18   8.133  -4.471  -4.054
  157   HD22  LEU  18          1HD2      LEU  18   7.374  -4.052  -2.514
  158   HD23  LEU  18          2HD2      LEU  18   6.459  -3.916  -4.012
  159    H    ILE  19           H        ILE  19   6.602  -6.763  -7.948
  160    HA   ILE  19           HA       ILE  19   6.149  -9.611  -8.482
  161    HB   ILE  19           HB       ILE  19   5.465  -7.178 -10.191
  162   HG12  ILE  19          2HG1      ILE  19   3.094  -7.787  -9.835
  163   HG13  ILE  19          1HG1      ILE  19   3.574  -9.149  -8.872
  164   HG21  ILE  19          1HG2      ILE  19   6.056  -9.035 -11.679
  165   HG22  ILE  19          2HG2      ILE  19   4.310  -8.775 -11.735
  166   HG23  ILE  19          3HG2      ILE  19   4.970 -10.119 -10.801
  167   HD11  ILE  19          3HD1      ILE  19   2.691  -7.399  -7.511
  168   HD12  ILE  19          1HD1      ILE  19   3.898  -6.273  -8.136
  169   HD13  ILE  19          2HD1      ILE  19   4.400  -7.650  -7.150
  170    H    GLY  20           H        GLY  20   7.974  -6.873  -9.824
  171    HA2  GLY  20           2HA      GLY  20  10.290  -7.160 -10.543
  172    HA3  GLY  20           1HA      GLY  20   9.859  -8.747 -11.175
  173    HA   PRO  21           HA       PRO  21   9.678  -5.672 -14.753
  174    HB2  PRO  21           2HB      PRO  21  11.083  -7.227 -16.544
  175    HB3  PRO  21           1HB      PRO  21  11.884  -6.152 -15.383
  176    HG2  PRO  21           2HG      PRO  21  11.412  -9.109 -15.173
  177    HG3  PRO  21           1HG      PRO  21  12.892  -8.175 -14.844
  178    HD2  PRO  21           2HD      PRO  21  11.261  -8.969 -12.836
  179    HD3  PRO  21           1HD      PRO  21  12.127  -7.415 -12.777
  180    H    SER  22           H        SER  22   8.791  -8.943 -14.177
  181    HA   SER  22           HA       SER  22   7.157  -9.354 -16.547
  182    HB2  SER  22           2HB      SER  22   7.466 -10.963 -13.973
  183    HB3  SER  22           1HB      SER  22   6.702 -11.528 -15.461
  184    HG   SER  22           HG       SER  22   8.657 -12.195 -15.906
  185    H    ALA  23           H        ALA  23   6.505  -7.041 -14.766
  186    HA   ALA  23           HA       ALA  23   4.370  -7.480 -13.007
  187    HB1  ALA  23           3HB      ALA  23   5.092  -4.980 -14.567
  188    HB2  ALA  23           1HB      ALA  23   5.746  -5.460 -12.998
  189    HB3  ALA  23           2HB      ALA  23   4.039  -5.045 -13.148
  190    H    LYS  24           H        LYS  24   2.293  -7.944 -13.331
  191    HA   LYS  24           HA       LYS  24   1.017  -7.665 -15.960
  192    HB2  LYS  24           2HB      LYS  24  -0.084  -8.976 -13.444
  193    HB3  LYS  24           1HB      LYS  24  -0.866  -8.943 -15.021
  194    HG2  LYS  24           2HG      LYS  24   0.042 -11.068 -14.967
  195    HG3  LYS  24           1HG      LYS  24   1.266 -10.167 -15.868
  196    HD2  LYS  24           2HD      LYS  24   2.631  -9.970 -13.811
  197    HD3  LYS  24           1HD      LYS  24   1.388 -10.835 -12.901
  198    HE2  LYS  24           2HE      LYS  24   3.224 -12.331 -13.483
  199    HE3  LYS  24           1HE      LYS  24   1.747 -12.823 -14.308
  200    HZ1  LYS  24           3HZ      LYS  24   2.543 -11.814 -16.316
  201    HZ2  LYS  24           1HZ      LYS  24   3.692 -12.904 -15.735
  202    HZ3  LYS  24           2HZ      LYS  24   3.930 -11.246 -15.537
  203    H    GLU  25           H        GLU  25   0.781  -5.491 -16.053
  204    HA   GLU  25           HA       GLU  25  -0.106  -3.809 -13.917
  205    HB2  GLU  25           2HB      GLU  25   0.152  -3.178 -16.891
  206    HB3  GLU  25           1HB      GLU  25   0.086  -1.997 -15.581
  207    HG2  GLU  25           2HG      GLU  25   2.229  -2.755 -14.711
  208    HG3  GLU  25           1HG      GLU  25   2.289  -4.063 -15.895
  209    H    ASP  26           H        ASP  26  -1.686  -5.634 -16.311
  210    HA   ASP  26           HA       ASP  26  -4.182  -4.264 -16.537
  211    HB2  ASP  26           2HB      ASP  26  -3.314  -5.903 -18.220
  212    HB3  ASP  26           1HB      ASP  26  -3.491  -7.196 -17.037
  213    H    GLU  27           H        GLU  27  -2.845  -6.587 -14.281
  214    HA   GLU  27           HA       GLU  27  -5.399  -7.333 -13.097
  215    HB2  GLU  27           2HB      GLU  27  -2.542  -8.049 -12.330
  216    HB3  GLU  27           1HB      GLU  27  -3.978  -8.695 -11.529
  217    HG2  GLU  27           2HG      GLU  27  -4.711  -9.615 -13.773
  218    HG3  GLU  27           1HG      GLU  27  -3.135  -9.140 -14.413
  219    H    LEU  28           H        LEU  28  -2.737  -5.152 -12.401
  220    HA   LEU  28           HA       LEU  28  -3.767  -4.453  -9.790
  221    HB2  LEU  28           2HB      LEU  28  -1.312  -4.571 -10.390
  222    HB3  LEU  28           1HB      LEU  28  -1.528  -3.129 -11.354
  223    HG   LEU  28           HG       LEU  28  -2.261  -3.038  -8.413
  224   HD11  LEU  28          1HD1      LEU  28   0.010  -2.439  -7.769
  225   HD12  LEU  28          2HD1      LEU  28   0.572  -2.709  -9.420
  226   HD13  LEU  28          3HD1      LEU  28  -0.018  -4.064  -8.458
  227   HD21  LEU  28          3HD2      LEU  28  -2.792  -1.068  -9.779
  228   HD22  LEU  28          1HD2      LEU  28  -1.103  -0.937 -10.281
  229   HD23  LEU  28          2HD2      LEU  28  -1.551  -0.680  -8.592
  230    H    ASP  29           H        ASP  29  -4.890  -2.669  -9.300
  231    HA   ASP  29           HA       ASP  29  -5.113  -0.330 -10.995
  232    HB2  ASP  29           2HB      ASP  29  -7.021  -2.000 -11.650
  233    HB3  ASP  29           1HB      ASP  29  -7.672  -1.699 -10.044
  234    H    ASP  30           H        ASP  30  -6.497   1.373  -9.680
  235    HA   ASP  30           HA       ASP  30  -5.459   1.348  -6.985
  236    HB2  ASP  30           2HB      ASP  30  -6.230   3.633  -6.786
  237    HB3  ASP  30           1HB      ASP  30  -5.377   3.435  -8.309
  238    H    GLN  31           H        GLN  31  -8.510   0.700  -8.519
  239    HA   GLN  31           HA       GLN  31  -9.936   0.619  -5.925
  240    HB2  GLN  31           2HB      GLN  31 -11.019   0.502  -8.778
  241    HB3  GLN  31           1HB      GLN  31 -12.014   0.420  -7.326
  242    HG2  GLN  31           2HG      GLN  31 -11.226   2.696  -6.699
  243    HG3  GLN  31           1HG      GLN  31 -10.332   2.783  -8.220
  244   HE21  GLN  31          1HE2      GLN  31 -12.538   4.475  -7.238
  245   HE22  GLN  31          2HE2      GLN  31 -13.787   4.373  -8.429
  246    H    THR  32           H        THR  32  -8.309  -1.514  -8.014
  247    HA   THR  32           HA       THR  32  -9.999  -3.842  -7.684
  248    HB   THR  32           HB       THR  32  -7.178  -3.442  -8.751
  249    HG1  THR  32           HG1      THR  32  -9.482  -3.102  -9.822
  250   HG21  THR  32          3HG2      THR  32  -8.681  -6.090  -8.631
  251   HG22  THR  32          1HG2      THR  32  -7.193  -5.704  -7.757
  252   HG23  THR  32          2HG2      THR  32  -7.186  -5.792  -9.517
  253    HA   PRO  33           HA       PRO  33  -8.496  -4.784  -3.508
  254    HB2  PRO  33           2HB      PRO  33  -9.489  -7.376  -3.345
  255    HB3  PRO  33           1HB      PRO  33 -10.463  -5.914  -3.076
  256    HG2  PRO  33           2HG      PRO  33 -10.277  -7.617  -5.526
  257    HG3  PRO  33           1HG      PRO  33 -11.699  -6.845  -4.789
  258    HD2  PRO  33           2HD      PRO  33 -10.476  -5.797  -6.961
  259    HD3  PRO  33           1HD      PRO  33 -11.245  -4.767  -5.738
  260    H    LEU  34           H        LEU  34  -6.395  -4.871  -3.613
  261    HA   LEU  34           HA       LEU  34  -4.687  -6.393  -5.173
  262    HB2  LEU  34           2HB      LEU  34  -4.045  -5.039  -2.532
  263    HB3  LEU  34           1HB      LEU  34  -2.926  -5.375  -3.843
  264    HG   LEU  34           HG       LEU  34  -5.269  -3.441  -4.095
  265   HD11  LEU  34          1HD1      LEU  34  -3.772  -2.571  -2.403
  266   HD12  LEU  34          2HD1      LEU  34  -3.645  -1.612  -3.876
  267   HD13  LEU  34          3HD1      LEU  34  -2.383  -2.780  -3.476
  268   HD21  LEU  34          3HD2      LEU  34  -4.062  -2.595  -6.097
  269   HD22  LEU  34          1HD2      LEU  34  -4.541  -4.283  -6.273
  270   HD23  LEU  34          2HD2      LEU  34  -2.861  -3.875  -5.909
  271    H    LEU  35           H        LEU  35  -5.537  -6.803  -1.691
  272    HA   LEU  35           HA       LEU  35  -4.022  -9.123  -1.126
  273    HB2  LEU  35           2HB      LEU  35  -6.629  -8.087   0.025
  274    HB3  LEU  35           1HB      LEU  35  -5.993  -9.631   0.561
  275    HG   LEU  35           HG       LEU  35  -5.476  -7.839   2.142
  276   HD11  LEU  35          1HD1      LEU  35  -3.088  -8.235   2.471
  277   HD12  LEU  35          2HD1      LEU  35  -2.942  -8.882   0.836
  278   HD13  LEU  35          3HD1      LEU  35  -3.920  -9.726   2.039
  279   HD21  LEU  35          3HD2      LEU  35  -5.382  -5.926   0.663
  280   HD22  LEU  35          1HD2      LEU  35  -3.893  -6.524  -0.078
  281   HD23  LEU  35          2HD2      LEU  35  -3.908  -6.036   1.617
  282    H    GLU  36           H        GLU  36  -7.215  -8.721  -2.519
  283    HA   GLU  36           HA       GLU  36  -8.027 -11.438  -2.445
  284    HB2  GLU  36           2HB      GLU  36  -9.526  -9.391  -2.561
  285    HB3  GLU  36           1HB      GLU  36  -9.060  -9.228  -4.248
  286    HG2  GLU  36           2HG      GLU  36 -11.226 -10.266  -4.111
  287    HG3  GLU  36           1HG      GLU  36 -10.065 -11.445  -4.716
  288    H    TRP  37           H        TRP  37  -6.284  -9.470  -4.770
  289    HA   TRP  37           HA       TRP  37  -6.347 -11.600  -6.833
  290    HB2  TRP  37           2HB      TRP  37  -5.435  -8.703  -6.854
  291    HB3  TRP  37           1HB      TRP  37  -5.059  -9.798  -8.183
  292    HD1  TRP  37           HD1      TRP  37  -8.420  -9.078  -6.278
  293    HE1  TRP  37           HE1      TRP  37 -10.233  -8.639  -8.021
  294    HE3  TRP  37           HE3      TRP  37  -5.601  -9.559 -10.524
  295    HZ2  TRP  37           HZ2      TRP  37 -10.472  -8.507 -10.821
  296    HZ3  TRP  37           HZ3      TRP  37  -6.711  -9.258 -12.701
  297    HH2  TRP  37           HH2      TRP  37  -9.097  -8.744 -12.845
  298    H    GLY  38           H        GLY  38  -4.648 -11.256  -4.125
  299    HA2  GLY  38           2HA      GLY  38  -2.736 -12.258  -3.369
  300    HA3  GLY  38           1HA      GLY  38  -2.570 -13.026  -4.937
  301    H    ILE  39           H        ILE  39  -2.733  -9.594  -4.889
  302    HA   ILE  39           HA       ILE  39  -0.085  -9.212  -5.945
  303    HB   ILE  39           HB       ILE  39  -2.243  -7.203  -5.112
  304   HG12  ILE  39          2HG1      ILE  39  -1.552  -8.221  -7.909
  305   HG13  ILE  39          1HG1      ILE  39  -2.963  -8.710  -6.981
  306   HG21  ILE  39          1HG2      ILE  39   0.238  -6.665  -6.773
  307   HG22  ILE  39          2HG2      ILE  39  -0.031  -6.126  -5.115
  308   HG23  ILE  39          3HG2      ILE  39  -1.042  -5.501  -6.419
  309   HD11  ILE  39          3HD1      ILE  39  -3.570  -7.109  -8.680
  310   HD12  ILE  39          1HD1      ILE  39  -2.400  -5.945  -8.058
  311   HD13  ILE  39          2HD1      ILE  39  -3.803  -6.394  -7.084
  312    H    LEU  40           H        LEU  40  -1.765  -8.822  -2.889
  313    HA   LEU  40           HA       LEU  40   0.780  -8.243  -1.473
  314    HB2  LEU  40           2HB      LEU  40  -2.016  -7.413  -0.594
  315    HB3  LEU  40           1HB      LEU  40  -0.498  -6.999   0.184
  316    HG   LEU  40           HG       LEU  40  -1.450  -5.978  -2.520
  317   HD11  LEU  40          1HD1      LEU  40  -1.585  -3.781  -1.391
  318   HD12  LEU  40          2HD1      LEU  40  -1.228  -4.561   0.153
  319   HD13  LEU  40          3HD1      LEU  40  -2.709  -4.968  -0.728
  320   HD21  LEU  40          3HD2      LEU  40   0.515  -4.511  -2.488
  321   HD22  LEU  40          1HD2      LEU  40   0.978  -6.209  -2.522
  322   HD23  LEU  40          2HD2      LEU  40   1.092  -5.292  -1.014
  323    H    ASN  41           H        ASN  41   1.269  -9.649   0.153
  324    HA   ASN  41           HA       ASN  41  -0.535 -10.925   1.888
  325    HB2  ASN  41           2HB      ASN  41  -0.917 -12.388  -0.181
  326    HB3  ASN  41           1HB      ASN  41   0.767 -12.879  -0.100
  327   HD21  ASN  41          1HD2      ASN  41  -1.596 -14.544   0.027
  328   HD22  ASN  41          2HD2      ASN  41  -1.556 -15.359   1.548
  329    H    SER  42           H        SER  42   0.726 -10.618   3.628
  330    HA   SER  42           HA       SER  42   2.465 -10.504   5.056
  331    HB2  SER  42           3HB      SER  42   1.487 -12.744   5.343
  332    HB3  SER  42           2HB      SER  42   2.694 -13.413   4.228
  333    H    MET  43           H        MET  43   4.074 -12.820   2.913
  334    HA   MET  43           HA       MET  43   6.676 -12.233   3.468
  335    HB2  MET  43           2HB      MET  43   7.222 -13.452   1.405
  336    HB3  MET  43           1HB      MET  43   5.931 -14.246   2.291
  337    HG2  MET  43           2HG      MET  43   4.577 -12.541   0.498
  338    HG3  MET  43           1HG      MET  43   5.922 -13.186  -0.435
  339    HE1  MET  43           3HE      MET  43   3.726 -14.859   2.486
  340    HE2  MET  43           1HE      MET  43   2.561 -15.736   1.497
  341    HE3  MET  43           2HE      MET  43   2.582 -13.968   1.481
  342    H    ASN  44           H        ASN  44   4.631 -10.568   1.084
  343    HA   ASN  44           HA       ASN  44   6.903  -8.798   0.340
  344    HB2  ASN  44           2HB      ASN  44   5.808  -8.408  -1.775
  345    HB3  ASN  44           1HB      ASN  44   5.911 -10.142  -1.515
  346   HD21  ASN  44          1HD2      ASN  44   4.123  -8.612  -3.262
  347   HD22  ASN  44          2HD2      ASN  44   2.525  -9.064  -2.793
  348    H    ILE  45           H        ILE  45   3.996  -8.896   2.078
  349    HA   ILE  45           HA       ILE  45   3.109  -6.194   1.689
  350    HB   ILE  45           HB       ILE  45   1.823  -8.414   2.640
  351   HG12  ILE  45          2HG1      ILE  45   0.981  -5.579   3.396
  352   HG13  ILE  45          1HG1      ILE  45   0.738  -6.297   1.809
  353   HG21  ILE  45          1HG2      ILE  45   1.278  -8.248   5.021
  354   HG22  ILE  45          2HG2      ILE  45   2.323  -6.837   5.193
  355   HG23  ILE  45          3HG2      ILE  45   3.029  -8.412   4.833
  356   HD11  ILE  45          3HD1      ILE  45  -1.311  -6.360   3.094
  357   HD12  ILE  45          1HD1      ILE  45  -0.504  -7.231   4.399
  358   HD13  ILE  45          2HD1      ILE  45  -0.720  -8.004   2.826
  359    H    VAL  46           H        VAL  46   5.466  -7.719   3.723
  360    HA   VAL  46           HA       VAL  46   5.679  -5.780   5.802
  361    HB   VAL  46           HB       VAL  46   7.862  -7.681   4.829
  362   HG11  VAL  46          1HG1      VAL  46   8.723  -7.527   7.144
  363   HG12  VAL  46          2HG1      VAL  46   7.448  -6.371   7.542
  364   HG13  VAL  46          3HG1      VAL  46   8.694  -5.942   6.368
  365   HG21  VAL  46          3HG2      VAL  46   5.755  -8.195   6.960
  366   HG22  VAL  46          1HG2      VAL  46   7.075  -9.281   6.520
  367   HG23  VAL  46          2HG2      VAL  46   5.790  -8.934   5.362
  368    H    LYS  47           H        LYS  47   6.821  -5.922   2.551
  369    HA   LYS  47           HA       LYS  47   8.959  -4.057   2.671
  370    HB2  LYS  47           2HB      LYS  47   7.276  -5.082   0.371
  371    HB3  LYS  47           1HB      LYS  47   8.490  -3.832   0.122
  372    HG2  LYS  47           2HG      LYS  47   9.429  -5.976  -0.461
  373    HG3  LYS  47           1HG      LYS  47  10.235  -5.360   0.980
  374    HD2  LYS  47           2HD      LYS  47   8.821  -6.856   2.385
  375    HD3  LYS  47           1HD      LYS  47   8.059  -7.478   0.926
  376    HE2  LYS  47           2HE      LYS  47   9.783  -9.019   1.723
  377    HE3  LYS  47           1HE      LYS  47  10.248  -8.340   0.164
  378    HZ1  LYS  47           3HZ      LYS  47  12.106  -8.346   1.648
  379    HZ2  LYS  47           1HZ      LYS  47  11.249  -7.483   2.820
  380    HZ3  LYS  47           2HZ      LYS  47  11.655  -6.748   1.353
  381    H    LEU  48           H        LEU  48   5.501  -3.727   2.496
  382    HA   LEU  48           HA       LEU  48   5.461  -0.936   1.759
  383    HB2  LEU  48           2HB      LEU  48   3.278  -2.741   2.886
  384    HB3  LEU  48           1HB      LEU  48   3.017  -1.051   2.483
  385    HG   LEU  48           HG       LEU  48   2.150  -2.344   0.663
  386   HD11  LEU  48          1HD1      LEU  48   4.828  -1.197  -0.241
  387   HD12  LEU  48          2HD1      LEU  48   3.330  -0.286  -0.029
  388   HD13  LEU  48          3HD1      LEU  48   3.432  -1.527  -1.273
  389   HD21  LEU  48          3HD2      LEU  48   3.404  -3.994  -0.630
  390   HD22  LEU  48          1HD2      LEU  48   3.338  -4.474   1.063
  391   HD23  LEU  48          2HD2      LEU  48   4.819  -3.776   0.402
  392    H    MET  49           H        MET  49   5.403  -2.786   4.754
  393    HA   MET  49           HA       MET  49   4.592  -0.795   6.587
  394    HB2  MET  49           2HB      MET  49   6.525  -3.089   7.155
  395    HB3  MET  49           1HB      MET  49   5.564  -2.218   8.343
  396    HG2  MET  49           2HG      MET  49   3.511  -3.179   7.442
  397    HG3  MET  49           1HG      MET  49   4.430  -3.985   6.161
  398    HE1  MET  49           3HE      MET  49   3.969  -6.519   6.573
  399    HE2  MET  49           1HE      MET  49   2.654  -5.958   7.599
  400    HE3  MET  49           2HE      MET  49   3.747  -7.210   8.181
  401    H    VAL  50           H        VAL  50   7.825  -1.822   5.521
  402    HA   VAL  50           HA       VAL  50   9.245   0.223   6.987
  403    HB   VAL  50           HB       VAL  50  10.273  -1.997   6.509
  404   HG11  VAL  50          1HG1      VAL  50  11.179  -2.531   4.265
  405   HG12  VAL  50          2HG1      VAL  50  10.399  -1.092   3.605
  406   HG13  VAL  50          3HG1      VAL  50   9.419  -2.417   4.239
  407   HG21  VAL  50          3HG2      VAL  50  11.769  -0.118   7.037
  408   HG22  VAL  50          1HG2      VAL  50  11.848   0.319   5.327
  409   HG23  VAL  50          2HG2      VAL  50  12.537  -1.207   5.881
  410    H    TYR  51           H        TYR  51   7.897  -0.085   3.742
  411    HA   TYR  51           HA       TYR  51   9.445   1.839   2.358
  412    HB2  TYR  51           2HB      TYR  51   7.816   0.192   1.253
  413    HB3  TYR  51           1HB      TYR  51   6.511   1.238   1.766
  414    HD1  TYR  51           HD1      TYR  51   9.536   1.078  -0.422
  415    HD2  TYR  51           HD2      TYR  51   5.998   3.286   0.533
  416    HE1  TYR  51           HE1      TYR  51   9.837   2.443  -2.443
  417    HE2  TYR  51           HE2      TYR  51   6.299   4.638  -1.484
  418    HH   TYR  51           HH       TYR  51   8.075   5.328  -2.992
  419    H    ILE  52           H        ILE  52   6.216   2.098   3.753
  420    HA   ILE  52           HA       ILE  52   5.786   4.848   3.244
  421    HB   ILE  52           HB       ILE  52   4.391   3.025   5.263
  422   HG12  ILE  52          2HG1      ILE  52   3.500   3.586   2.394
  423   HG13  ILE  52          1HG1      ILE  52   4.519   2.209   2.792
  424   HG21  ILE  52          1HG2      ILE  52   3.387   5.541   3.914
  425   HG22  ILE  52          2HG2      ILE  52   3.882   5.407   5.598
  426   HG23  ILE  52          3HG2      ILE  52   2.467   4.521   5.025
  427   HD11  ILE  52          3HD1      ILE  52   2.209   1.577   2.581
  428   HD12  ILE  52          1HD1      ILE  52   1.746   2.712   3.851
  429   HD13  ILE  52          2HD1      ILE  52   2.779   1.324   4.228
  430    H    ARG  53           H        ARG  53   7.180   3.105   5.933
  431    HA   ARG  53           HA       ARG  53   7.235   5.164   7.889
  432    HB2  ARG  53           2HB      ARG  53   7.454   2.753   8.388
  433    HB3  ARG  53           1HB      ARG  53   9.013   2.722   7.574
  434    HG2  ARG  53           2HG      ARG  53   9.912   4.296   9.293
  435    HG3  ARG  53           1HG      ARG  53   8.351   4.254  10.116
  436    HD2  ARG  53           2HD      ARG  53   8.607   1.829  10.506
  437    HD3  ARG  53           1HD      ARG  53  10.161   1.847   9.661
  438    HE   ARG  53           HE       ARG  53   9.562   2.961  12.305
  439   HH11  ARG  53          1HH1      ARG  53  12.001   2.410   9.834
  440   HH12  ARG  53          2HH1      ARG  53  13.319   2.748  10.906
  441   HH21  ARG  53          1HH2      ARG  53  11.300   3.417  13.677
  442   HH22  ARG  53          2HH2      ARG  53  12.924   3.315  13.071
  443    H    ASP  54           H        ASP  54   9.345   4.409   5.191
  444    HA   ASP  54           HA       ASP  54  11.399   6.384   5.934
  445    HB2  ASP  54           2HB      ASP  54  11.962   4.150   4.847
  446    HB3  ASP  54           1HB      ASP  54  11.130   4.695   3.394
  447    H    GLU  55           H        GLU  55   8.929   5.834   3.540
  448    HA   GLU  55           HA       GLU  55   9.385   7.888   1.698
  449    HB2  GLU  55           2HB      GLU  55   8.122   5.858   1.168
  450    HB3  GLU  55           1HB      GLU  55   6.922   6.251   2.386
  451    HG2  GLU  55           2HG      GLU  55   5.970   6.657   0.240
  452    HG3  GLU  55           1HG      GLU  55   6.216   8.213   1.025
  453    H    MET  56           H        MET  56   6.905   7.614   4.222
  454    HA   MET  56           HA       MET  56   6.418  10.537   4.164
  455    HB2  MET  56           2HB      MET  56   4.454   8.220   4.299
  456    HB3  MET  56           1HB      MET  56   3.987   9.848   4.768
  457    HG2  MET  56           2HG      MET  56   4.321  10.682   2.556
  458    HG3  MET  56           1HG      MET  56   5.113   9.198   2.033
  459    HE1  MET  56           3HE      MET  56   3.919   7.105   1.165
  460    HE2  MET  56           1HE      MET  56   2.245   6.689   1.524
  461    HE3  MET  56           2HE      MET  56   3.432   6.765   2.826
  462    H    GLY  57           H        GLY  57   7.701   8.161   5.981
  463    HA2  GLY  57           2HA      GLY  57   8.418   8.156   8.161
  464    HA3  GLY  57           1HA      GLY  57   7.524   9.635   8.460
  465    H    VAL  58           H        VAL  58   5.594   7.107   7.124
  466    HA   VAL  58           HA       VAL  58   4.128   6.976   9.687
  467    HB   VAL  58           HB       VAL  58   3.188   6.120   6.915
  468   HG11  VAL  58          1HG1      VAL  58   1.599   6.590   9.444
  469   HG12  VAL  58          2HG1      VAL  58   1.907   5.036   8.659
  470   HG13  VAL  58          3HG1      VAL  58   0.909   6.248   7.853
  471   HG21  VAL  58          3HG2      VAL  58   1.937   8.233   6.790
  472   HG22  VAL  58          1HG2      VAL  58   3.681   8.505   6.860
  473   HG23  VAL  58          2HG2      VAL  58   2.687   8.764   8.297
  474    H    SER  59           H        SER  59   4.598   5.239  10.897
  475    HA   SER  59           HA       SER  59   5.610   2.746   9.756
  476    HB2  SER  59           2HB      SER  59   5.008   3.446  12.668
  477    HB3  SER  59           1HB      SER  59   6.003   2.108  12.086
  478    HG   SER  59           HG       SER  59   6.711   4.690  11.288
  479    H    ILE  60           H        ILE  60   4.099   1.263   9.037
  480    HA   ILE  60           HA       ILE  60   1.393   1.175  10.129
  481    HB   ILE  60           HB       ILE  60   2.651  -0.819   8.182
  482   HG12  ILE  60          2HG1      ILE  60   2.602   1.593   7.279
  483   HG13  ILE  60          1HG1      ILE  60   1.736   0.399   6.318
  484   HG21  ILE  60          1HG2      ILE  60   0.278  -1.355   7.646
  485   HG22  ILE  60          2HG2      ILE  60  -0.258  -0.235   8.900
  486   HG23  ILE  60          3HG2      ILE  60   0.667  -1.674   9.335
  487   HD11  ILE  60          3HD1      ILE  60   0.495   2.375   8.236
  488   HD12  ILE  60          1HD1      ILE  60  -0.397   1.168   7.298
  489   HD13  ILE  60          2HD1      ILE  60   0.479   2.465   6.476
  490    HA   PRO  61           HA       PRO  61   3.073  -1.749  13.263
  491    HB2  PRO  61           2HB      PRO  61   0.956  -1.593  15.009
  492    HB3  PRO  61           1HB      PRO  61   2.189  -0.319  14.897
  493    HG2  PRO  61           2HG      PRO  61  -0.550  -0.380  13.687
  494    HG3  PRO  61           1HG      PRO  61   0.291   0.959  14.496
  495    HD2  PRO  61           2HD      PRO  61   0.124   0.704  11.781
  496    HD3  PRO  61           1HD      PRO  61   1.465   1.531  12.594
  497    H    SER  62           H        SER  62   2.222  -3.771  14.226
  498    HA   SER  62           HA       SER  62   1.250  -5.515  12.250
  499    HB2  SER  62           2HB      SER  62   1.296  -7.200  14.110
  500    HB3  SER  62           1HB      SER  62   2.787  -6.271  13.968
  501    HG   SER  62           HG       SER  62   2.324  -6.194  16.088
  502    H    THR  63           H        THR  63  -0.384  -3.795  14.842
  503    HA   THR  63           HA       THR  63  -2.886  -5.204  14.727
  504    HB   THR  63           HB       THR  63  -2.070  -3.922  16.729
  505    HG1  THR  63           HG1      THR  63  -4.296  -4.459  16.459
  506   HG21  THR  63          3HG2      THR  63  -1.224  -1.885  15.602
  507   HG22  THR  63          1HG2      THR  63  -2.398  -1.497  16.862
  508   HG23  THR  63          2HG2      THR  63  -2.877  -1.445  15.166
  509    H    HIS  64           H        HIS  64  -1.464  -2.935  12.618
  510    HA   HIS  64           HA       HIS  64  -4.047  -2.197  11.375
  511    HB2  HIS  64           2HB      HIS  64  -1.340  -0.860  11.380
  512    HB3  HIS  64           1HB      HIS  64  -2.461  -0.559  10.049
  513    HD1  HIS  64           HD1      HIS  64  -2.142  -0.078  13.792
  514    HD2  HIS  64           HD2      HIS  64  -4.553   1.146  10.647
  515    HE1  HIS  64           HE1      HIS  64  -3.622   1.693  14.742
  516    HE2  HIS  64           HE2      HIS  64  -5.233   2.221  12.887
  517    H    ILE  65           H        ILE  65  -1.757  -4.565  11.082
  518    HA   ILE  65           HA       ILE  65  -1.769  -4.706   8.177
  519    HB   ILE  65           HB       ILE  65  -0.885  -6.872  10.116
  520   HG12  ILE  65          2HG1      ILE  65   0.476  -4.900  10.551
  521   HG13  ILE  65          1HG1      ILE  65   1.449  -6.064   9.657
  522   HG21  ILE  65          1HG2      ILE  65  -1.348  -7.719   7.844
  523   HG22  ILE  65          2HG2      ILE  65   0.381  -7.784   8.185
  524   HG23  ILE  65          3HG2      ILE  65  -0.268  -6.509   7.145
  525   HD11  ILE  65          3HD1      ILE  65   1.782  -3.785   8.900
  526   HD12  ILE  65          1HD1      ILE  65   0.075  -3.663   8.471
  527   HD13  ILE  65          2HD1      ILE  65   1.124  -4.806   7.618
  528    H    THR  66           H        THR  66  -3.841  -4.794   7.625
  529    HA   THR  66           HA       THR  66  -5.096  -7.379   7.823
  530    HB   THR  66           HB       THR  66  -6.126  -6.220   9.736
  531    HG1  THR  66           HG1      THR  66  -7.691  -7.412   8.939
  532   HG21  THR  66          3HG2      THR  66  -7.033  -4.091   7.773
  533   HG22  THR  66          1HG2      THR  66  -5.783  -3.882   9.009
  534   HG23  THR  66          2HG2      THR  66  -7.460  -4.186   9.484
  535    H    GLY  67           H        GLY  67  -6.575  -7.719   6.132
  536    HA2  GLY  67           2HA      GLY  67  -5.916  -6.648   3.648
  537    HA3  GLY  67           1HA      GLY  67  -7.344  -7.606   4.004
  538    H    LYS  68           H        LYS  68  -8.483  -5.739   5.906
  539    HA   LYS  68           HA       LYS  68 -10.102  -4.210   4.202
  540    HB2  LYS  68           2HB      LYS  68 -10.854  -4.970   6.369
  541    HB3  LYS  68           1HB      LYS  68  -9.625  -4.018   7.195
  542    HG2  LYS  68           2HG      LYS  68 -10.733  -1.969   6.732
  543    HG3  LYS  68           1HG      LYS  68 -11.777  -2.703   5.506
  544    HD2  LYS  68           2HD      LYS  68 -13.006  -2.248   7.617
  545    HD3  LYS  68           1HD      LYS  68 -12.973  -3.967   7.227
  546    HE2  LYS  68           2HE      LYS  68 -11.070  -4.220   8.867
  547    HE3  LYS  68           1HE      LYS  68 -11.309  -2.535   9.328
  548    HZ1  LYS  68           3HZ      LYS  68 -13.253  -4.753   9.600
  549    HZ2  LYS  68           1HZ      LYS  68 -13.614  -3.132   9.929
  550    HZ3  LYS  68           2HZ      LYS  68 -12.450  -3.950  10.846
  551    H    TYR  69           H        TYR  69  -7.216  -3.231   6.022
  552    HA   TYR  69           HA       TYR  69  -7.458  -0.432   5.269
  553    HB2  TYR  69           2HB      TYR  69  -5.397  -1.976   6.875
  554    HB3  TYR  69           1HB      TYR  69  -5.127  -0.295   6.407
  555    HD1  TYR  69           HD2      TYR  69  -7.967   0.740   6.675
  556    HD2  TYR  69           HD1      TYR  69  -5.649  -1.717   9.298
  557    HE1  TYR  69           HE2      TYR  69  -9.279   1.533   8.561
  558    HE2  TYR  69           HE1      TYR  69  -6.983  -0.912  11.196
  559    HH   TYR  69           HH       TYR  69  -9.917   0.801  10.789
  560    H    PHE  70           H        PHE  70  -5.845  -3.254   4.088
  561    HA   PHE  70           HA       PHE  70  -4.185  -1.689   2.218
  562    HB2  PHE  70           2HB      PHE  70  -3.984  -4.529   3.262
  563    HB3  PHE  70           1HB      PHE  70  -3.082  -4.016   1.846
  564    HD1  PHE  70           HD2      PHE  70  -3.418  -3.563   5.529
  565    HD2  PHE  70           HD1      PHE  70  -1.118  -2.609   2.045
  566    HE1  PHE  70           HE2      PHE  70  -1.591  -2.740   6.948
  567    HE2  PHE  70           HE1      PHE  70   0.701  -1.787   3.476
  568    HZ   PHE  70           HZ       PHE  70   0.471  -1.850   5.920
  569    H    LYS  71           H        LYS  71  -7.242  -2.620   2.022
  570    HA   LYS  71           HA       LYS  71  -7.620  -4.699   0.249
  571    HB2  LYS  71           2HB      LYS  71  -9.254  -2.167   0.593
  572    HB3  LYS  71           1HB      LYS  71  -9.724  -3.375  -0.601
  573    HG2  LYS  71           2HG      LYS  71  -9.889  -5.061   1.211
  574    HG3  LYS  71           1HG      LYS  71  -9.501  -3.804   2.387
  575    HD2  LYS  71           2HD      LYS  71 -11.905  -3.768   0.530
  576    HD3  LYS  71           1HD      LYS  71 -11.938  -4.269   2.218
  577    HE2  LYS  71           2HE      LYS  71 -11.365  -2.031   2.956
  578    HE3  LYS  71           1HE      LYS  71 -11.131  -1.494   1.287
  579    HZ1  LYS  71           3HZ      LYS  71 -13.702  -2.520   2.344
  580    HZ2  LYS  71           1HZ      LYS  71 -13.428  -1.775   0.854
  581    HZ3  LYS  71           2HZ      LYS  71 -13.296  -0.880   2.278
  582    H    ASP  72           H        ASP  72  -7.206  -1.313  -0.583
  583    HA   ASP  72           HA       ASP  72  -6.037  -1.889  -3.146
  584    HB2  ASP  72           2HB      ASP  72  -7.743  -0.674  -4.486
  585    HB3  ASP  72           1HB      ASP  72  -8.409  -2.127  -3.745
  586    H    LEU  73           H        LEU  73  -6.045   0.532  -4.297
  587    HA   LEU  73           HA       LEU  73  -4.185   1.907  -2.607
  588    HB2  LEU  73           2HB      LEU  73  -3.904   1.673  -5.049
  589    HB3  LEU  73           1HB      LEU  73  -5.300   2.707  -5.300
  590    HG   LEU  73           HG       LEU  73  -4.079   4.610  -4.252
  591   HD11  LEU  73          1HD1      LEU  73  -1.659   4.396  -3.767
  592   HD12  LEU  73          2HD1      LEU  73  -1.748   2.667  -4.078
  593   HD13  LEU  73          3HD1      LEU  73  -2.625   3.366  -2.715
  594   HD21  LEU  73          3HD2      LEU  73  -3.993   4.382  -6.682
  595   HD22  LEU  73          1HD2      LEU  73  -2.625   3.272  -6.564
  596   HD23  LEU  73          2HD2      LEU  73  -2.438   4.959  -6.092
  597    H    ASN  74           H        ASN  74  -7.555   2.513  -3.515
  598    HA   ASN  74           HA       ASN  74  -7.750   5.152  -2.388
  599    HB2  ASN  74           2HB      ASN  74  -9.978   3.087  -2.719
  600    HB3  ASN  74           1HB      ASN  74 -10.198   4.804  -2.403
  601   HD21  ASN  74          1HD2      ASN  74  -9.240   2.436  -4.773
  602   HD22  ASN  74          2HD2      ASN  74  -9.384   3.483  -6.149
  603    H    ALA  75           H        ALA  75  -8.221   1.865  -1.127
  604    HA   ALA  75           HA       ALA  75  -9.086   2.543   1.484
  605    HB1  ALA  75           3HB      ALA  75  -7.576   0.074   0.566
  606    HB2  ALA  75           1HB      ALA  75  -9.331   0.278   0.541
  607    HB3  ALA  75           2HB      ALA  75  -8.466   0.232   2.080
  608    H    ILE  76           H        ILE  76  -5.832   1.874   0.197
  609    HA   ILE  76           HA       ILE  76  -4.374   2.171   2.624
  610    HB   ILE  76           HB       ILE  76  -3.462   2.237  -0.285
  611   HG12  ILE  76          2HG1      ILE  76  -3.195   0.144   1.904
  612   HG13  ILE  76          1HG1      ILE  76  -4.278   0.042   0.520
  613   HG21  ILE  76          1HG2      ILE  76  -1.652   2.265   2.166
  614   HG22  ILE  76          2HG2      ILE  76  -1.837   3.588   1.018
  615   HG23  ILE  76          3HG2      ILE  76  -1.108   2.069   0.498
  616   HD11  ILE  76          3HD1      ILE  76  -1.267  -0.077   0.494
  617   HD12  ILE  76          1HD1      ILE  76  -2.290  -0.085  -0.953
  618   HD13  ILE  76          2HD1      ILE  76  -2.401  -1.401   0.218
  619    H    SER  77           H        SER  77  -5.184   4.499   0.031
  620    HA   SER  77           HA       SER  77  -3.498   6.595   0.945
  621    HB2  SER  77           2HB      SER  77  -5.000   8.092  -0.419
  622    HB3  SER  77           1HB      SER  77  -4.430   6.686  -1.308
  623    HG   SER  77           HG       SER  77  -6.370   5.896  -1.371
  624    H    ARG  78           H        ARG  78  -6.930   5.870   1.598
  625    HA   ARG  78           HA       ARG  78  -7.340   8.042   3.392
  626    HB2  ARG  78           2HB      ARG  78  -8.841   5.413   3.115
  627    HB3  ARG  78           1HB      ARG  78  -9.398   6.771   4.090
  628    HG2  ARG  78           2HG      ARG  78  -9.037   6.734   1.078
  629    HG3  ARG  78           1HG      ARG  78 -10.566   6.756   1.951
  630    HD2  ARG  78           2HD      ARG  78 -10.160   9.022   2.732
  631    HD3  ARG  78           1HD      ARG  78  -8.515   9.004   2.087
  632    HE   ARG  78           HE       ARG  78 -10.746   8.657   0.213
  633   HH11  ARG  78          1HH1      ARG  78  -8.250  10.816   1.476
  634   HH12  ARG  78          2HH1      ARG  78  -8.375  11.921   0.146
  635   HH21  ARG  78          1HH2      ARG  78 -10.821  10.056  -1.530
  636   HH22  ARG  78          2HH2      ARG  78  -9.836  11.480  -1.560
  637    H    THR  79           H        THR  79  -6.190   4.730   3.888
  638    HA   THR  79           HA       THR  79  -6.300   4.753   6.741
  639    HB   THR  79           HB       THR  79  -4.615   3.006   4.895
  640    HG1  THR  79           HG1      THR  79  -6.435   1.996   4.587
  641   HG21  THR  79          3HG2      THR  79  -5.320   2.606   7.829
  642   HG22  THR  79          1HG2      THR  79  -3.705   2.967   7.208
  643   HG23  THR  79          2HG2      THR  79  -4.488   1.435   6.808
  644    H    VAL  80           H        VAL  80  -3.802   5.607   4.380
  645    HA   VAL  80           HA       VAL  80  -1.708   5.794   6.366
  646    HB   VAL  80           HB       VAL  80  -1.356   5.086   3.923
  647   HG11  VAL  80          1HG1      VAL  80  -2.635   6.820   2.777
  648   HG12  VAL  80          2HG1      VAL  80  -0.955   6.831   2.233
  649   HG13  VAL  80          3HG1      VAL  80  -1.523   8.068   3.357
  650   HG21  VAL  80          3HG2      VAL  80   0.428   7.293   5.001
  651   HG22  VAL  80          1HG2      VAL  80   0.873   6.128   3.751
  652   HG23  VAL  80          2HG2      VAL  80   0.530   5.576   5.391
  653    H    GLU  81           H        GLU  81  -3.985   7.980   4.814
  654    HA   GLU  81           HA       GLU  81  -2.908  10.421   5.873
  655    HB2  GLU  81           2HB      GLU  81  -5.687   9.745   4.847
  656    HB3  GLU  81           1HB      GLU  81  -5.194  11.363   5.326
  657    HG2  GLU  81           2HG      GLU  81  -3.629  11.513   3.506
  658    HG3  GLU  81           1HG      GLU  81  -3.849   9.807   3.104
  659    H    GLN  82           H        GLN  82  -5.349   8.035   6.993
  660    HA   GLN  82           HA       GLN  82  -6.386   9.648   9.117
  661    HB2  GLN  82           2HB      GLN  82  -7.718   7.830   9.790
  662    HB3  GLN  82           1HB      GLN  82  -7.491   7.519   8.079
  663    HG2  GLN  82           2HG      GLN  82  -5.742   5.843   8.627
  664    HG3  GLN  82           1HG      GLN  82  -6.001   6.142  10.341
  665   HE21  GLN  82          1HE2      GLN  82  -6.502   3.948  10.664
  666   HE22  GLN  82          2HE2      GLN  82  -8.011   3.268  10.161
  667    H    LEU  83           H        LEU  83  -3.737   7.334   8.910
  668    HA   LEU  83           HA       LEU  83  -3.127   7.131  11.670
  669    HB2  LEU  83           2HB      LEU  83  -1.392   6.716   9.209
  670    HB3  LEU  83           1HB      LEU  83  -0.858   6.339  10.842
  671    HG   LEU  83           HG       LEU  83  -3.274   5.037   9.508
  672   HD11  LEU  83          1HD1      LEU  83  -1.871   3.044   9.256
  673   HD12  LEU  83          2HD1      LEU  83  -0.474   3.944   9.850
  674   HD13  LEU  83          3HD1      LEU  83  -1.240   4.403   8.328
  675   HD21  LEU  83          3HD2      LEU  83  -3.126   3.405  11.361
  676   HD22  LEU  83          1HD2      LEU  83  -3.435   5.031  11.963
  677   HD23  LEU  83          2HD2      LEU  83  -1.815   4.334  12.085
  678    H    LYS  84           H        LYS  84  -2.009   9.363   9.163
  679    HA   LYS  84           HA       LYS  84  -0.151  10.795  10.840
  680    HB2  LYS  84           2HB      LYS  84  -1.516  11.697   8.267
  681    HB3  LYS  84           1HB      LYS  84  -0.134  12.486   9.024
  682    HG2  LYS  84           2HG      LYS  84   1.228  10.466   8.635
  683    HG3  LYS  84           1HG      LYS  84  -0.151   9.689   7.857
  684    HD2  LYS  84           2HD      LYS  84   1.294  12.187   6.889
  685    HD3  LYS  84           1HD      LYS  84   1.398  10.581   6.174
  686    HE2  LYS  84           2HE      LYS  84  -0.960  10.683   5.514
  687    HE3  LYS  84           1HE      LYS  84  -1.145  12.245   6.313
  688    HZ1  LYS  84           3HZ      LYS  84  -0.878  12.574   3.983
  689    HZ2  LYS  84           1HZ      LYS  84   0.536  11.653   3.941
  690    HZ3  LYS  84           2HZ      LYS  84   0.518  13.133   4.744
  691    H    ALA  85           H        ALA  85  -3.587  11.028  10.208
  692    HA   ALA  85           HA       ALA  85  -3.989  13.676  11.278
  693    HB1  ALA  85           3HB      ALA  85  -6.382  13.146  11.014
  694    HB2  ALA  85           1HB      ALA  85  -5.978  11.460  10.679
  695    HB3  ALA  85           2HB      ALA  85  -5.475  12.728   9.559
  696    H    GLU  86           H        GLU  86  -4.260  10.371  12.504
  697    HA   GLU  86           HA       GLU  86  -5.296  11.098  15.106
  698    HB2  GLU  86           2HB      GLU  86  -4.129   8.463  14.078
  699    HB3  GLU  86           1HB      GLU  86  -4.928   8.672  15.634
  700    HG2  GLU  86           2HG      GLU  86  -7.040   9.030  14.644
  701    HG3  GLU  86           1HG      GLU  86  -6.347   9.306  13.048
  702    H    SER  87           H        SER  87  -2.150  10.330  13.689
  703    HA   SER  87           HA       SER  87  -0.658  10.573  16.158
  704    HB2  SER  87           2HB      SER  87   0.094   9.169  14.221
  705    HB3  SER  87           1HB      SER  87   0.390  10.639  13.299
  706    HG   SER  87           HG       SER  87   1.817  11.190  15.181
  707    H    ALA  88           H        ALA  88  -2.023  12.827  13.990
  708    HA   ALA  88           HA       ALA  88  -0.267  14.971  13.935
  709    HB1  ALA  88           3HB      ALA  88  -2.315  14.879  12.622
  710    HB2  ALA  88           1HB      ALA  88  -2.214  16.394  13.520
  711    HB3  ALA  88           2HB      ALA  88  -3.296  15.104  14.068
  712    H    LEU  89           H        LEU  89   0.351  16.467  15.338
  713    HA   LEU  89           HA       LEU  89  -0.357  16.021  18.154
  714    HB2  LEU  89           2HB      LEU  89   1.995  16.744  18.680
  715    HB3  LEU  89           1HB      LEU  89   1.865  15.249  17.802
  716    HG   LEU  89           HG       LEU  89   3.856  16.462  17.104
  717   HD11  LEU  89          1HD1      LEU  89   2.800  15.130  15.347
  718   HD12  LEU  89          2HD1      LEU  89   3.578  16.554  14.658
  719   HD13  LEU  89          3HD1      LEU  89   1.823  16.519  14.857
  720   HD21  LEU  89          3HD2      LEU  89   2.098  18.783  16.252
  721   HD22  LEU  89          1HD2      LEU  89   3.841  18.658  16.004
  722   HD23  LEU  89          2HD2      LEU  89   3.186  18.773  17.639
  723    H    GLU  90           H        GLU  90  -0.079  18.454  15.704
  724    HA   GLU  90           HA       GLU  90  -0.149  20.691  17.502
  725    HB2  GLU  90           2HB      GLU  90  -0.586  22.082  15.529
  726    HB3  GLU  90           1HB      GLU  90   0.803  21.043  15.318
  727    HG2  GLU  90           2HG      GLU  90  -1.913  20.430  14.115
  728    HG3  GLU  90           1HG      GLU  90  -0.672  21.371  13.302
  729   H281  4EM 101          2H28      PYA 142   3.125 -11.761   9.015
  730   H283  4EM 101          3H28      PYA 142   2.529 -13.077  10.027
  731   H303  4EM 101          3H30      PYA 142  -0.005 -13.289  10.380
  732   H301  4EM 101          1H30      PYA 142  -0.278 -13.140   8.633
  733   H302  4EM 101          2H30      PYA 142  -1.080 -12.033   9.756
  734   H312  4EM 101          2H31      PYA 142   0.654 -11.208   7.391
  735   H313  4EM 101          3H31      PYA 142  -0.132 -10.088   8.497
  736   H311  4EM 101          1H31      PYA 142   1.611  -9.967   8.218
  737    H32  4EM 101           H32      PYA 142   1.299 -11.486  11.621
  738    H33  4EM 101           H33      PYA 142   2.250  -9.308  11.440
  739    H36  4EM 101           H36      PYA 142  -1.060 -11.534  11.702
  740   H373  4EM 101          3H37      PYA 142  -2.476  -9.447  12.587
  741   H372  4EM 101          2H37      PYA 142  -2.697  -9.312  10.834
  742   H382  4EM 101          2H38      PYA 142  -3.545 -11.513  12.723
  743   H383  4EM 101          3H38      PYA 142  -3.216 -11.935  11.042
  744    H41  4EM 101           H41      PYA 142  -4.167 -10.836   9.499
  745   H423  4EM 101          3H42      PYA 142  -5.884  -9.163   8.796
  746   H422  4EM 101          2H42      PYA 142  -6.994 -10.162   9.740
  747   H433  4EM 101          3H43      PYA 142  -6.989 -10.772   7.297
  748   H432  4EM 101          2H43      PYA 142  -6.465 -12.108   8.328
  749    H44  4EM 101           H44      PYA 142  -4.596 -12.074   7.341
  750    H49  4EM 101           H49      PYA 142  -2.510  -8.428   5.827
  751    H51  4EM 101           H51      PYA 142  -0.423  -9.728   4.916
  752    H50  4EM 101           H50      PYA 142  -0.935 -12.280   5.050
  753    H48  4EM 101           H48      PYA 142  -3.296 -12.506   6.033
  Start of MODEL   14
    1    H1   MET   1           1H       MET   1   1.207  16.317   1.375
    2    H2   MET   1           2H       MET   1   2.473  16.810   2.376
    3    H3   MET   1           3H       MET   1   2.677  15.500   1.336
    4    HA   MET   1           HA       MET   1   2.262  18.317   0.534
    5    HB2  MET   1           2HB      MET   1   4.530  17.808   1.436
    6    HB3  MET   1           1HB      MET   1   4.699  16.507   0.268
    7    HG2  MET   1           2HG      MET   1   4.531  18.216  -1.567
    8    HG3  MET   1           1HG      MET   1   4.538  19.473  -0.325
    9    HE1  MET   1           3HE      MET   1   8.121  19.710  -1.977
   10    HE2  MET   1           1HE      MET   1   6.616  20.569  -1.647
   11    HE3  MET   1           2HE      MET   1   6.638  19.239  -2.807
   12    H    ASP   2           H        ASP   2   3.008  15.015  -0.521
   13    HA   ASP   2           HA       ASP   2   1.599  15.466  -3.085
   14    HB2  ASP   2           2HB      ASP   2   4.374  14.252  -2.685
   15    HB3  ASP   2           1HB      ASP   2   3.420  13.944  -4.130
   16    H    GLY   3           H        GLY   3  -0.182  14.346  -2.330
   17    HA2  GLY   3           2HA      GLY   3  -0.043  11.747  -1.082
   18    HA3  GLY   3           1HA      GLY   3  -1.483  12.592  -1.624
   19    H    GLU   4           H        GLU   4  -1.335  12.889  -4.213
   20    HA   GLU   4           HA       GLU   4  -1.919  10.277  -5.156
   21    HB2  GLU   4           2HB      GLU   4  -1.685  12.873  -6.713
   22    HB3  GLU   4           1HB      GLU   4  -2.383  11.385  -7.343
   23    HG2  GLU   4           2HG      GLU   4  -3.760  11.868  -4.912
   24    HG3  GLU   4           1HG      GLU   4  -3.603  13.445  -5.668
   25    H    GLU   5           H        GLU   5   0.933  12.274  -5.454
   26    HA   GLU   5           HA       GLU   5   2.282  10.828  -7.489
   27    HB2  GLU   5           2HB      GLU   5   3.419  12.457  -5.194
   28    HB3  GLU   5           1HB      GLU   5   4.338  11.911  -6.594
   29    HG2  GLU   5           2HG      GLU   5   2.003  13.843  -6.634
   30    HG3  GLU   5           1HG      GLU   5   3.704  14.272  -6.783
   31    H    VAL   6           H        VAL   6   2.300  10.527  -3.900
   32    HA   VAL   6           HA       VAL   6   4.175   8.291  -4.001
   33    HB   VAL   6           HB       VAL   6   3.954   8.127  -1.564
   34   HG11  VAL   6          1HG1      VAL   6   4.253  11.017  -2.464
   35   HG12  VAL   6          2HG1      VAL   6   5.524   9.792  -2.460
   36   HG13  VAL   6          3HG1      VAL   6   4.832  10.348  -0.935
   37   HG21  VAL   6          3HG2      VAL   6   1.810  10.283  -1.765
   38   HG22  VAL   6          1HG2      VAL   6   2.499   9.662  -0.261
   39   HG23  VAL   6          2HG2      VAL   6   1.549   8.602  -1.303
   40    H    LYS   7           H        LYS   7   0.709   8.688  -3.979
   41    HA   LYS   7           HA       LYS   7  -0.030   6.094  -3.102
   42    HB2  LYS   7           2HB      LYS   7  -1.498   8.120  -4.817
   43    HB3  LYS   7           1HB      LYS   7  -2.188   6.541  -4.467
   44    HG2  LYS   7           2HG      LYS   7  -1.949   7.141  -1.989
   45    HG3  LYS   7           1HG      LYS   7  -1.619   8.791  -2.527
   46    HD2  LYS   7           2HD      LYS   7  -4.141   7.164  -2.995
   47    HD3  LYS   7           1HD      LYS   7  -3.975   8.618  -2.015
   48    HE2  LYS   7           2HE      LYS   7  -3.537   9.940  -4.051
   49    HE3  LYS   7           1HE      LYS   7  -3.689   8.485  -5.035
   50    HZ1  LYS   7           3HZ      LYS   7  -5.718   9.725  -5.087
   51    HZ2  LYS   7           1HZ      LYS   7  -5.834   9.729  -3.401
   52    HZ3  LYS   7           2HZ      LYS   7  -5.986   8.281  -4.251
   53    H    GLU   8           H        GLU   8   0.420   7.434  -6.412
   54    HA   GLU   8           HA       GLU   8   0.025   4.945  -7.703
   55    HB2  GLU   8           2HB      GLU   8   0.924   5.879  -9.700
   56    HB3  GLU   8           1HB      GLU   8  -0.011   7.146  -8.921
   57    HG2  GLU   8           2HG      GLU   8   1.892   8.389  -8.356
   58    HG3  GLU   8           1HG      GLU   8   2.976   7.007  -8.524
   59    H    LYS   9           H        LYS   9   2.890   6.458  -6.214
   60    HA   LYS   9           HA       LYS   9   4.779   4.571  -7.153
   61    HB2  LYS   9           2HB      LYS   9   4.907   6.282  -4.653
   62    HB3  LYS   9           1HB      LYS   9   6.235   5.303  -5.261
   63    HG2  LYS   9           2HG      LYS   9   6.006   6.714  -7.434
   64    HG3  LYS   9           1HG      LYS   9   5.060   7.813  -6.433
   65    HD2  LYS   9           2HD      LYS   9   7.962   7.022  -6.093
   66    HD3  LYS   9           1HD      LYS   9   7.311   8.621  -6.431
   67    HE2  LYS   9           2HE      LYS   9   6.363   8.743  -4.169
   68    HE3  LYS   9           1HE      LYS   9   6.919   7.096  -3.826
   69    HZ1  LYS   9           3HZ      LYS   9   8.747   9.310  -4.576
   70    HZ2  LYS   9           1HZ      LYS   9   9.163   7.782  -3.987
   71    HZ3  LYS   9           2HZ      LYS   9   8.387   8.882  -2.976
   72    H    ILE  10           H        ILE  10   2.478   4.398  -4.484
   73    HA   ILE  10           HA       ILE  10   3.501   2.113  -3.163
   74    HB   ILE  10           HB       ILE  10   0.555   2.699  -3.691
   75   HG12  ILE  10          2HG1      ILE  10   1.484   4.669  -2.630
   76   HG13  ILE  10          1HG1      ILE  10   0.525   3.807  -1.433
   77   HG21  ILE  10          1HG2      ILE  10   1.820   1.015  -1.510
   78   HG22  ILE  10          2HG2      ILE  10   0.881   0.423  -2.881
   79   HG23  ILE  10          3HG2      ILE  10   0.101   1.398  -1.636
   80   HD11  ILE  10          3HD1      ILE  10   3.537   3.853  -1.643
   81   HD12  ILE  10          1HD1      ILE  10   2.615   2.915  -0.455
   82   HD13  ILE  10          2HD1      ILE  10   2.537   4.676  -0.448
   83    H    ARG  11           H        ARG  11   1.485   2.520  -6.043
   84    HA   ARG  11           HA       ARG  11   1.045  -0.267  -6.535
   85    HB2  ARG  11           2HB      ARG  11   0.780   1.986  -8.564
   86    HB3  ARG  11           1HB      ARG  11   0.041   0.398  -8.643
   87    HG2  ARG  11           2HG      ARG  11  -0.753   2.794  -7.021
   88    HG3  ARG  11           1HG      ARG  11  -1.736   1.756  -8.049
   89    HD2  ARG  11           2HD      ARG  11  -0.843   1.318  -5.202
   90    HD3  ARG  11           1HD      ARG  11  -2.461   1.256  -5.888
   91    HE   ARG  11           HE       ARG  11  -1.498  -0.835  -7.074
   92   HH11  ARG  11          1HH1      ARG  11  -1.030   0.118  -3.733
   93   HH12  ARG  11          2HH1      ARG  11  -0.770  -1.501  -3.181
   94   HH21  ARG  11          1HH2      ARG  11  -0.895  -2.927  -6.372
   95   HH22  ARG  11          2HH2      ARG  11  -0.694  -3.226  -4.677
   96    H    ARG  12           H        ARG  12   3.188   2.158  -7.980
   97    HA   ARG  12           HA       ARG  12   4.412   0.595  -9.977
   98    HB2  ARG  12           2HB      ARG  12   5.090   3.205  -8.602
   99    HB3  ARG  12           1HB      ARG  12   6.333   2.438  -9.572
  100    HG2  ARG  12           2HG      ARG  12   5.131   4.169 -10.840
  101    HG3  ARG  12           1HG      ARG  12   4.955   2.575 -11.568
  102    HD2  ARG  12           2HD      ARG  12   2.689   2.382 -10.739
  103    HD3  ARG  12           1HD      ARG  12   2.872   3.847  -9.785
  104    HE   ARG  12           HE       ARG  12   2.906   5.130 -11.815
  105   HH11  ARG  12          1HH1      ARG  12   1.800   1.851 -12.183
  106   HH12  ARG  12          2HH1      ARG  12   0.934   2.177 -13.640
  107   HH21  ARG  12          1HH2      ARG  12   1.724   5.573 -13.676
  108   HH22  ARG  12          2HH2      ARG  12   0.882   4.298 -14.492
  109    H    TYR  13           H        TYR  13   5.254   1.223  -6.611
  110    HA   TYR  13           HA       TYR  13   7.775  -0.066  -6.522
  111    HB2  TYR  13           2HB      TYR  13   7.151   1.474  -4.762
  112    HB3  TYR  13           1HB      TYR  13   5.718   0.528  -4.353
  113    HD1  TYR  13           HD1      TYR  13   9.468   0.009  -4.626
  114    HD2  TYR  13           HD2      TYR  13   5.896  -0.769  -2.400
  115    HE1  TYR  13           HE1      TYR  13  10.775  -1.206  -2.941
  116    HE2  TYR  13           HE2      TYR  13   7.215  -1.965  -0.721
  117    HH   TYR  13           HH       TYR  13   9.556  -3.269  -0.821
  118    H    ILE  14           H        ILE  14   4.512  -1.250  -5.681
  119    HA   ILE  14           HA       ILE  14   5.230  -3.874  -4.943
  120    HB   ILE  14           HB       ILE  14   2.587  -2.737  -5.957
  121   HG12  ILE  14          2HG1      ILE  14   3.584  -3.445  -3.155
  122   HG13  ILE  14          1HG1      ILE  14   3.457  -1.816  -3.798
  123   HG21  ILE  14          1HG2      ILE  14   3.059  -5.487  -4.725
  124   HG22  ILE  14          2HG2      ILE  14   2.566  -5.163  -6.387
  125   HG23  ILE  14          3HG2      ILE  14   1.476  -4.775  -5.059
  126   HD11  ILE  14          3HD1      ILE  14   1.669  -2.291  -2.280
  127   HD12  ILE  14          1HD1      ILE  14   1.191  -3.700  -3.220
  128   HD13  ILE  14          2HD1      ILE  14   1.027  -2.084  -3.907
  129    H    MET  15           H        MET  15   4.258  -2.556  -8.076
  130    HA   MET  15           HA       MET  15   4.298  -4.930  -9.605
  131    HB2  MET  15           2HB      MET  15   4.716  -1.983 -10.305
  132    HB3  MET  15           1HB      MET  15   4.709  -3.229 -11.539
  133    HG2  MET  15           2HG      MET  15   2.366  -3.021  -9.688
  134    HG3  MET  15           1HG      MET  15   2.551  -1.856 -10.987
  135    HE1  MET  15           3HE      MET  15   1.384  -6.269 -11.489
  136    HE2  MET  15           1HE      MET  15   1.427  -5.362  -9.977
  137    HE3  MET  15           2HE      MET  15   2.932  -5.932 -10.707
  138    H    GLU  16           H        GLU  16   6.907  -2.420  -9.294
  139    HA   GLU  16           HA       GLU  16   8.628  -3.834 -11.101
  140    HB2  GLU  16           2HB      GLU  16   9.283  -1.479  -9.293
  141    HB3  GLU  16           1HB      GLU  16  10.261  -2.051 -10.637
  142    HG2  GLU  16           2HG      GLU  16   7.603  -0.623 -10.720
  143    HG3  GLU  16           1HG      GLU  16   9.134  -0.152 -11.448
  144    H    ASP  17           H        ASP  17   8.449  -3.535  -7.622
  145    HA   ASP  17           HA       ASP  17  11.025  -4.883  -7.213
  146    HB2  ASP  17           2HB      ASP  17  10.452  -2.780  -5.970
  147    HB3  ASP  17           1HB      ASP  17   9.100  -3.611  -5.213
  148    H    LEU  18           H        LEU  18   7.639  -5.200  -6.044
  149    HA   LEU  18           HA       LEU  18   8.177  -7.648  -4.629
  150    HB2  LEU  18           2HB      LEU  18   5.602  -6.137  -5.149
  151    HB3  LEU  18           1HB      LEU  18   5.649  -7.626  -4.238
  152    HG   LEU  18           HG       LEU  18   7.024  -6.553  -2.487
  153   HD11  LEU  18          1HD1      LEU  18   7.448  -4.138  -2.449
  154   HD12  LEU  18          2HD1      LEU  18   6.765  -3.978  -4.068
  155   HD13  LEU  18          3HD1      LEU  18   8.253  -4.889  -3.825
  156   HD21  LEU  18          3HD2      LEU  18   4.554  -4.933  -3.158
  157   HD22  LEU  18          1HD2      LEU  18   5.327  -5.039  -1.576
  158   HD23  LEU  18          2HD2      LEU  18   4.576  -6.464  -2.287
  159    H    ILE  19           H        ILE  19   6.315  -6.904  -7.611
  160    HA   ILE  19           HA       ILE  19   5.754  -9.685  -8.214
  161    HB   ILE  19           HB       ILE  19   5.324  -7.114  -9.785
  162   HG12  ILE  19          2HG1      ILE  19   2.917  -7.780  -9.736
  163   HG13  ILE  19          1HG1      ILE  19   3.339  -9.206  -8.841
  164   HG21  ILE  19          1HG2      ILE  19   4.297  -8.397 -11.649
  165   HG22  ILE  19          2HG2      ILE  19   4.818  -9.904 -10.889
  166   HG23  ILE  19          3HG2      ILE  19   6.018  -8.751 -11.477
  167   HD11  ILE  19          3HD1      ILE  19   2.341  -7.558  -7.427
  168   HD12  ILE  19          1HD1      ILE  19   3.577  -6.381  -7.878
  169   HD13  ILE  19          2HD1      ILE  19   4.019  -7.824  -6.954
  170    H    GLY  20           H        GLY  20   7.739  -7.165  -9.749
  171    HA2  GLY  20           2HA      GLY  20  10.170  -8.079 -10.091
  172    HA3  GLY  20           1HA      GLY  20   9.344  -9.179 -11.190
  173    HA   PRO  21           HA       PRO  21  10.682  -5.148 -13.356
  174    HB2  PRO  21           2HB      PRO  21  12.188  -6.348 -15.341
  175    HB3  PRO  21           1HB      PRO  21  12.862  -5.917 -13.758
  176    HG2  PRO  21           2HG      PRO  21  11.846  -8.584 -14.700
  177    HG3  PRO  21           1HG      PRO  21  13.357  -8.193 -13.838
  178    HD2  PRO  21           2HD      PRO  21  11.232  -9.148 -12.494
  179    HD3  PRO  21           1HD      PRO  21  12.279  -7.897 -11.782
  180    H    SER  22           H        SER  22   9.584  -8.273 -14.595
  181    HA   SER  22           HA       SER  22   8.122  -7.089 -16.848
  182    HB2  SER  22           2HB      SER  22   8.339 -10.015 -15.992
  183    HB3  SER  22           1HB      SER  22   7.788  -9.397 -17.554
  184    HG   SER  22           HG       SER  22  10.191  -8.384 -17.109
  185    H    ALA  23           H        ALA  23   7.025  -5.903 -14.941
  186    HA   ALA  23           HA       ALA  23   5.345  -7.240 -13.103
  187    HB1  ALA  23           3HB      ALA  23   4.523  -4.979 -12.576
  188    HB2  ALA  23           1HB      ALA  23   5.320  -4.350 -14.021
  189    HB3  ALA  23           2HB      ALA  23   6.282  -5.020 -12.699
  190    H    LYS  24           H        LYS  24   3.176  -7.637 -13.097
  191    HA   LYS  24           HA       LYS  24   1.708  -7.608 -15.619
  192    HB2  LYS  24           2HB      LYS  24   1.053  -8.758 -12.878
  193    HB3  LYS  24           1HB      LYS  24  -0.065  -8.823 -14.234
  194    HG2  LYS  24           2HG      LYS  24   2.700 -10.077 -14.205
  195    HG3  LYS  24           1HG      LYS  24   1.191 -10.937 -13.889
  196    HD2  LYS  24           2HD      LYS  24   0.406 -10.332 -16.203
  197    HD3  LYS  24           1HD      LYS  24   1.973  -9.577 -16.509
  198    HE2  LYS  24           2HE      LYS  24   3.095 -11.750 -16.226
  199    HE3  LYS  24           1HE      LYS  24   1.553 -12.518 -15.841
  200    HZ1  LYS  24           3HZ      LYS  24   2.366 -11.324 -18.430
  201    HZ2  LYS  24           1HZ      LYS  24   0.798 -11.847 -18.088
  202    HZ3  LYS  24           2HZ      LYS  24   2.070 -12.953 -18.102
  203    H    GLU  25           H        GLU  25   1.935  -5.203 -15.453
  204    HA   GLU  25           HA       GLU  25   0.324  -3.500 -13.946
  205    HB2  GLU  25           2HB      GLU  25   0.243  -2.158 -16.308
  206    HB3  GLU  25           1HB      GLU  25   1.667  -2.230 -15.310
  207    HG2  GLU  25           2HG      GLU  25   2.185  -2.549 -17.696
  208    HG3  GLU  25           1HG      GLU  25   2.671  -3.915 -16.699
  209    H    ASP  26           H        ASP  26  -0.546  -5.717 -16.438
  210    HA   ASP  26           HA       ASP  26  -3.026  -4.895 -17.298
  211    HB2  ASP  26           2HB      ASP  26  -1.832  -6.788 -18.304
  212    HB3  ASP  26           1HB      ASP  26  -1.944  -7.700 -16.801
  213    H    GLU  27           H        GLU  27  -2.154  -6.530 -14.319
  214    HA   GLU  27           HA       GLU  27  -4.968  -6.933 -13.509
  215    HB2  GLU  27           2HB      GLU  27  -2.420  -7.915 -12.162
  216    HB3  GLU  27           1HB      GLU  27  -4.062  -8.487 -11.876
  217    HG2  GLU  27           2HG      GLU  27  -4.147  -9.342 -14.199
  218    HG3  GLU  27           1HG      GLU  27  -2.485  -8.809 -14.443
  219    H    LEU  28           H        LEU  28  -2.307  -4.873 -12.968
  220    HA   LEU  28           HA       LEU  28  -2.928  -3.982 -10.298
  221    HB2  LEU  28           2HB      LEU  28  -0.641  -4.123 -11.199
  222    HB3  LEU  28           1HB      LEU  28  -1.010  -2.924 -12.411
  223    HG   LEU  28           HG       LEU  28   0.409  -2.168 -10.428
  224   HD11  LEU  28          1HD1      LEU  28  -2.085  -0.529 -10.911
  225   HD12  LEU  28          2HD1      LEU  28  -0.617  -0.496 -11.887
  226   HD13  LEU  28          3HD1      LEU  28  -0.575   0.057 -10.216
  227   HD21  LEU  28          3HD2      LEU  28  -2.203  -2.293  -8.900
  228   HD22  LEU  28          1HD2      LEU  28  -0.688  -1.595  -8.324
  229   HD23  LEU  28          2HD2      LEU  28  -0.795  -3.326  -8.634
  230    H    ASP  29           H        ASP  29  -4.229  -2.384  -9.740
  231    HA   ASP  29           HA       ASP  29  -4.516   0.073 -11.224
  232    HB2  ASP  29           2HB      ASP  29  -6.327  -1.496 -12.188
  233    HB3  ASP  29           1HB      ASP  29  -7.018  -1.540 -10.576
  234    H    ASP  30           H        ASP  30  -5.948   1.581  -9.838
  235    HA   ASP  30           HA       ASP  30  -4.990   1.362  -7.118
  236    HB2  ASP  30           2HB      ASP  30  -5.819   3.681  -6.852
  237    HB3  ASP  30           1HB      ASP  30  -4.739   3.513  -8.228
  238    H    GLN  31           H        GLN  31  -8.078   1.362  -8.775
  239    HA   GLN  31           HA       GLN  31  -9.658   1.067  -6.337
  240    HB2  GLN  31           2HB      GLN  31 -10.413   1.195  -9.296
  241    HB3  GLN  31           1HB      GLN  31 -11.582   1.120  -7.978
  242    HG2  GLN  31           2HG      GLN  31 -11.129   3.288  -7.260
  243    HG3  GLN  31           1HG      GLN  31  -9.526   3.313  -7.987
  244   HE21  GLN  31          1HE2      GLN  31  -9.814   5.230  -9.054
  245   HE22  GLN  31          2HE2      GLN  31 -10.893   5.435 -10.391
  246    H    THR  32           H        THR  32  -8.214  -1.019  -8.757
  247    HA   THR  32           HA       THR  32  -9.836  -3.346  -8.345
  248    HB   THR  32           HB       THR  32  -6.937  -3.076  -9.243
  249    HG1  THR  32           HG1      THR  32  -8.209  -3.948 -11.214
  250   HG21  THR  32          3HG2      THR  32  -7.042  -5.425 -10.026
  251   HG22  THR  32          1HG2      THR  32  -8.618  -5.622  -9.257
  252   HG23  THR  32          2HG2      THR  32  -7.180  -5.345  -8.269
  253    HA   PRO  33           HA       PRO  33  -8.308  -4.220  -4.143
  254    HB2  PRO  33           2HB      PRO  33  -9.605  -6.625  -3.779
  255    HB3  PRO  33           1HB      PRO  33 -10.432  -5.056  -3.651
  256    HG2  PRO  33           2HG      PRO  33 -10.398  -6.986  -5.936
  257    HG3  PRO  33           1HG      PRO  33 -11.754  -6.049  -5.276
  258    HD2  PRO  33           2HD      PRO  33 -10.406  -5.298  -7.525
  259    HD3  PRO  33           1HD      PRO  33 -11.170  -4.123  -6.434
  260    H    LEU  34           H        LEU  34  -6.176  -4.689  -4.218
  261    HA   LEU  34           HA       LEU  34  -5.037  -6.599  -6.070
  262    HB2  LEU  34           2HB      LEU  34  -3.687  -5.020  -3.832
  263    HB3  LEU  34           1HB      LEU  34  -2.866  -5.948  -5.070
  264    HG   LEU  34           HG       LEU  34  -2.615  -3.775  -5.831
  265   HD11  LEU  34          1HD1      LEU  34  -5.115  -4.647  -7.304
  266   HD12  LEU  34          2HD1      LEU  34  -3.454  -5.108  -7.687
  267   HD13  LEU  34          3HD1      LEU  34  -3.956  -3.430  -7.849
  268   HD21  LEU  34          3HD2      LEU  34  -4.274  -2.003  -5.868
  269   HD22  LEU  34          1HD2      LEU  34  -3.989  -2.611  -4.239
  270   HD23  LEU  34          2HD2      LEU  34  -5.451  -3.081  -5.111
  271    H    LEU  35           H        LEU  35  -5.820  -6.406  -2.716
  272    HA   LEU  35           HA       LEU  35  -4.317  -8.486  -1.628
  273    HB2  LEU  35           2HB      LEU  35  -5.508  -6.543  -0.505
  274    HB3  LEU  35           1HB      LEU  35  -7.012  -7.422  -0.733
  275    HG   LEU  35           HG       LEU  35  -5.969  -9.300   0.631
  276   HD11  LEU  35          1HD1      LEU  35  -3.613  -8.693   0.447
  277   HD12  LEU  35          2HD1      LEU  35  -4.098  -8.678   2.143
  278   HD13  LEU  35          3HD1      LEU  35  -3.919  -7.155   1.264
  279   HD21  LEU  35          3HD2      LEU  35  -6.468  -8.197   2.774
  280   HD22  LEU  35          1HD2      LEU  35  -7.669  -7.811   1.542
  281   HD23  LEU  35          2HD2      LEU  35  -6.431  -6.625   1.968
  282    H    GLU  36           H        GLU  36  -7.636  -8.364  -2.868
  283    HA   GLU  36           HA       GLU  36  -8.337 -11.068  -2.283
  284    HB2  GLU  36           2HB      GLU  36  -9.616  -9.311  -4.408
  285    HB3  GLU  36           1HB      GLU  36 -10.348 -10.652  -3.539
  286    HG2  GLU  36           2HG      GLU  36  -9.712  -7.886  -2.505
  287    HG3  GLU  36           1HG      GLU  36 -11.286  -8.653  -2.669
  288    H    TRP  37           H        TRP  37  -6.889  -9.391  -4.972
  289    HA   TRP  37           HA       TRP  37  -7.124 -11.541  -6.899
  290    HB2  TRP  37           2HB      TRP  37  -5.800  -8.810  -6.888
  291    HB3  TRP  37           1HB      TRP  37  -5.471  -9.949  -8.192
  292    HD1  TRP  37           HD1      TRP  37  -8.924  -9.129  -6.539
  293    HE1  TRP  37           HE1      TRP  37 -10.541  -8.441  -8.407
  294    HE3  TRP  37           HE3      TRP  37  -5.672  -9.243 -10.494
  295    HZ2  TRP  37           HZ2      TRP  37 -10.455  -8.010 -11.200
  296    HZ3  TRP  37           HZ3      TRP  37  -6.522  -8.679 -12.737
  297    HH2  TRP  37           HH2      TRP  37  -8.868  -8.075 -13.078
  298    H    GLY  38           H        GLY  38  -5.072 -11.094  -4.263
  299    HA2  GLY  38           2HA      GLY  38  -3.320 -12.411  -3.530
  300    HA3  GLY  38           1HA      GLY  38  -3.375 -13.314  -5.035
  301    H    ILE  39           H        ILE  39  -3.159  -9.913  -5.270
  302    HA   ILE  39           HA       ILE  39  -0.404  -9.883  -6.208
  303    HB   ILE  39           HB       ILE  39  -2.449  -7.619  -5.865
  304   HG12  ILE  39          2HG1      ILE  39  -1.692  -9.170  -8.384
  305   HG13  ILE  39          1HG1      ILE  39  -3.198  -9.353  -7.507
  306   HG21  ILE  39          1HG2      ILE  39  -0.146  -6.735  -5.882
  307   HG22  ILE  39          2HG2      ILE  39  -1.017  -6.257  -7.338
  308   HG23  ILE  39          3HG2      ILE  39   0.171  -7.562  -7.411
  309   HD11  ILE  39          3HD1      ILE  39  -3.792  -7.043  -8.107
  310   HD12  ILE  39          1HD1      ILE  39  -3.511  -8.068  -9.516
  311   HD13  ILE  39          2HD1      ILE  39  -2.282  -6.911  -9.013
  312    H    LEU  40           H        LEU  40  -2.294  -9.245  -3.371
  313    HA   LEU  40           HA       LEU  40   0.132  -8.690  -1.765
  314    HB2  LEU  40           2HB      LEU  40  -2.699  -7.703  -1.221
  315    HB3  LEU  40           1HB      LEU  40  -1.283  -7.387  -0.227
  316    HG   LEU  40           HG       LEU  40  -1.658  -6.371  -3.072
  317   HD11  LEU  40          1HD1      LEU  40  -2.018  -4.156  -2.068
  318   HD12  LEU  40          2HD1      LEU  40  -1.993  -4.872  -0.453
  319   HD13  LEU  40          3HD1      LEU  40  -3.273  -5.303  -1.599
  320   HD21  LEU  40          3HD2      LEU  40   0.482  -5.733  -1.015
  321   HD22  LEU  40          1HD2      LEU  40   0.306  -4.971  -2.599
  322   HD23  LEU  40          2HD2      LEU  40   0.693  -6.686  -2.490
  323    H    ASN  41           H        ASN  41   0.404 -10.079  -0.011
  324    HA   ASN  41           HA       ASN  41  -1.925 -11.512   1.071
  325    HB2  ASN  41           2HB      ASN  41  -0.781 -13.106  -0.531
  326    HB3  ASN  41           1HB      ASN  41   0.669 -12.999   0.463
  327   HD21  ASN  41          1HD2      ASN  41   0.468 -15.327   0.742
  328   HD22  ASN  41          2HD2      ASN  41  -0.628 -15.970   1.908
  329    H    SER  42           H        SER  42   1.665 -11.297   1.601
  330    HA   SER  42           HA       SER  42   1.305 -10.074   4.163
  331    HB2  SER  42           3HB      SER  42   0.684 -12.391   4.832
  332    HB3  SER  42           2HB      SER  42   2.228 -12.979   4.193
  333    H    MET  43           H        MET  43   3.644 -12.277   2.619
  334    HA   MET  43           HA       MET  43   6.010 -11.304   3.697
  335    HB2  MET  43           2HB      MET  43   6.143 -12.219   0.808
  336    HB3  MET  43           1HB      MET  43   7.178 -12.644   2.165
  337    HG2  MET  43           2HG      MET  43   6.017 -14.609   1.573
  338    HG3  MET  43           1HG      MET  43   5.227 -14.016   3.045
  339    HE1  MET  43           3HE      MET  43   2.892 -14.950   2.945
  340    HE2  MET  43           1HE      MET  43   3.471 -16.042   1.681
  341    HE3  MET  43           2HE      MET  43   1.960 -15.159   1.462
  342    H    ASN  44           H        ASN  44   4.419 -10.448   0.734
  343    HA   ASN  44           HA       ASN  44   6.256  -8.377  -0.026
  344    HB2  ASN  44           2HB      ASN  44   4.742  -8.074  -1.920
  345    HB3  ASN  44           1HB      ASN  44   5.102  -9.773  -1.679
  346   HD21  ASN  44          1HD2      ASN  44   2.868  -8.460  -3.057
  347   HD22  ASN  44          2HD2      ASN  44   1.445  -9.109  -2.345
  348    H    ILE  45           H        ILE  45   3.198  -8.482   1.704
  349    HA   ILE  45           HA       ILE  45   2.475  -5.747   1.654
  350    HB   ILE  45           HB       ILE  45   1.777  -8.152   3.267
  351   HG12  ILE  45          2HG1      ILE  45   0.052  -5.928   2.111
  352   HG13  ILE  45          1HG1      ILE  45   0.448  -7.438   1.300
  353   HG21  ILE  45          1HG2      ILE  45   2.315  -6.668   5.134
  354   HG22  ILE  45          2HG2      ILE  45   0.577  -7.021   5.065
  355   HG23  ILE  45          3HG2      ILE  45   1.177  -5.459   4.505
  356   HD11  ILE  45          3HD1      ILE  45  -1.163  -7.163   3.838
  357   HD12  ILE  45          1HD1      ILE  45  -0.782  -8.678   3.000
  358   HD13  ILE  45          2HD1      ILE  45  -1.792  -7.462   2.213
  359    H    VAL  46           H        VAL  46   4.820  -7.508   3.558
  360    HA   VAL  46           HA       VAL  46   5.309  -5.692   5.668
  361    HB   VAL  46           HB       VAL  46   7.261  -7.652   4.404
  362   HG11  VAL  46          1HG1      VAL  46   7.226  -6.426   7.178
  363   HG12  VAL  46          2HG1      VAL  46   8.386  -6.051   5.900
  364   HG13  VAL  46          3HG1      VAL  46   8.365  -7.659   6.631
  365   HG21  VAL  46          3HG2      VAL  46   5.305  -8.108   6.681
  366   HG22  VAL  46          1HG2      VAL  46   6.537  -9.257   6.153
  367   HG23  VAL  46          2HG2      VAL  46   5.214  -8.821   5.072
  368    H    LYS  47           H        LYS  47   6.337  -5.729   2.359
  369    HA   LYS  47           HA       LYS  47   8.523  -3.922   2.424
  370    HB2  LYS  47           2HB      LYS  47   6.587  -4.715   0.213
  371    HB3  LYS  47           1HB      LYS  47   7.868  -3.545  -0.054
  372    HG2  LYS  47           2HG      LYS  47   8.497  -5.749  -0.877
  373    HG3  LYS  47           1HG      LYS  47   9.564  -5.210   0.418
  374    HD2  LYS  47           2HD      LYS  47   8.421  -6.679   2.011
  375    HD3  LYS  47           1HD      LYS  47   7.265  -7.152   0.770
  376    HE2  LYS  47           2HE      LYS  47   8.989  -8.878   1.133
  377    HE3  LYS  47           1HE      LYS  47   9.034  -8.244  -0.511
  378    HZ1  LYS  47           3HZ      LYS  47  10.899  -6.885   0.087
  379    HZ2  LYS  47           1HZ      LYS  47  11.226  -8.498   0.464
  380    HZ3  LYS  47           2HZ      LYS  47  10.826  -7.406   1.689
  381    H    LEU  48           H        LEU  48   5.024  -3.509   2.171
  382    HA   LEU  48           HA       LEU  48   5.048  -0.686   1.655
  383    HB2  LEU  48           2HB      LEU  48   2.793  -2.520   2.568
  384    HB3  LEU  48           1HB      LEU  48   2.576  -0.805   2.256
  385    HG   LEU  48           HG       LEU  48   1.793  -1.935   0.313
  386   HD11  LEU  48          1HD1      LEU  48   3.235  -1.077  -1.490
  387   HD12  LEU  48          2HD1      LEU  48   4.571  -0.872  -0.359
  388   HD13  LEU  48          3HD1      LEU  48   3.106   0.099  -0.183
  389   HD21  LEU  48          3HD2      LEU  48   4.404  -3.483   0.161
  390   HD22  LEU  48          1HD2      LEU  48   3.076  -3.567  -1.000
  391   HD23  LEU  48          2HD2      LEU  48   2.841  -4.140   0.649
  392    H    MET  49           H        MET  49   5.004  -2.646   4.569
  393    HA   MET  49           HA       MET  49   4.114  -0.767   6.466
  394    HB2  MET  49           2HB      MET  49   6.202  -2.951   6.901
  395    HB3  MET  49           1HB      MET  49   5.306  -2.129   8.169
  396    HG2  MET  49           2HG      MET  49   3.227  -3.166   7.407
  397    HG3  MET  49           1HG      MET  49   4.088  -3.940   6.069
  398    HE1  MET  49           3HE      MET  49   3.650  -6.504   6.596
  399    HE2  MET  49           1HE      MET  49   2.455  -5.947   7.759
  400    HE3  MET  49           2HE      MET  49   3.637  -7.163   8.233
  401    H    VAL  50           H        VAL  50   7.394  -1.490   5.289
  402    HA   VAL  50           HA       VAL  50   8.607   0.721   6.750
  403    HB   VAL  50           HB       VAL  50   9.843  -1.400   6.503
  404   HG11  VAL  50          1HG1      VAL  50  10.858  -2.089   4.352
  405   HG12  VAL  50          2HG1      VAL  50   9.970  -0.808   3.519
  406   HG13  VAL  50          3HG1      VAL  50   9.093  -2.137   4.287
  407   HG21  VAL  50          3HG2      VAL  50  11.144   0.658   6.864
  408   HG22  VAL  50          1HG2      VAL  50  11.254   0.917   5.120
  409   HG23  VAL  50          2HG2      VAL  50  12.049  -0.474   5.859
  410    H    TYR  51           H        TYR  51   7.374   0.167   3.521
  411    HA   TYR  51           HA       TYR  51   8.819   2.127   2.061
  412    HB2  TYR  51           2HB      TYR  51   7.329   0.312   1.047
  413    HB3  TYR  51           1HB      TYR  51   5.942   1.276   1.498
  414    HD1  TYR  51           HD1      TYR  51   9.203   1.695  -0.341
  415    HD2  TYR  51           HD2      TYR  51   5.059   2.717  -0.163
  416    HE1  TYR  51           HE1      TYR  51   9.418   2.958  -2.443
  417    HE2  TYR  51           HE2      TYR  51   5.275   3.964  -2.262
  418    HH   TYR  51           HH       TYR  51   7.898   3.731  -4.318
  419    H    ILE  52           H        ILE  52   5.626   2.211   3.513
  420    HA   ILE  52           HA       ILE  52   5.000   4.940   3.008
  421    HB   ILE  52           HB       ILE  52   3.803   2.942   4.989
  422   HG12  ILE  52          2HG1      ILE  52   2.728   3.694   2.229
  423   HG13  ILE  52          1HG1      ILE  52   3.841   2.352   2.454
  424   HG21  ILE  52          1HG2      ILE  52   2.591   5.527   3.969
  425   HG22  ILE  52          2HG2      ILE  52   3.179   5.239   5.606
  426   HG23  ILE  52          3HG2      ILE  52   1.784   4.343   5.004
  427   HD11  ILE  52          3HD1      ILE  52   1.108   2.583   3.692
  428   HD12  ILE  52          1HD1      ILE  52   2.230   1.225   3.860
  429   HD13  ILE  52          2HD1      ILE  52   1.551   1.619   2.281
  430    H    ARG  53           H        ARG  53   6.503   3.199   5.638
  431    HA   ARG  53           HA       ARG  53   6.576   5.129   7.666
  432    HB2  ARG  53           2HB      ARG  53   7.083   2.729   7.959
  433    HB3  ARG  53           1HB      ARG  53   8.588   2.937   7.069
  434    HG2  ARG  53           2HG      ARG  53   9.424   4.445   8.851
  435    HG3  ARG  53           1HG      ARG  53   7.904   4.243   9.726
  436    HD2  ARG  53           2HD      ARG  53   8.413   1.734   9.758
  437    HD3  ARG  53           1HD      ARG  53  10.033   2.155   9.189
  438    HE   ARG  53           HE       ARG  53   9.509   3.709  11.452
  439   HH11  ARG  53          1HH1      ARG  53   9.943   0.302  10.714
  440   HH12  ARG  53          2HH1      ARG  53  10.535  -0.090  12.293
  441   HH21  ARG  53          1HH2      ARG  53  10.241   3.186  13.519
  442   HH22  ARG  53          2HH2      ARG  53  10.706   1.556  13.894
  443    H    ASP  54           H        ASP  54   8.652   4.703   4.850
  444    HA   ASP  54           HA       ASP  54  10.480   6.835   5.717
  445    HB2  ASP  54           2HB      ASP  54  11.371   4.725   4.677
  446    HB3  ASP  54           1HB      ASP  54  10.535   5.132   3.184
  447    H    GLU  55           H        GLU  55   8.490   6.123   2.835
  448    HA   GLU  55           HA       GLU  55   8.823   8.522   1.486
  449    HB2  GLU  55           2HB      GLU  55   6.526   6.534   1.377
  450    HB3  GLU  55           1HB      GLU  55   6.697   7.874   0.250
  451    HG2  GLU  55           2HG      GLU  55   8.550   5.505   0.581
  452    HG3  GLU  55           1HG      GLU  55   7.532   5.892  -0.805
  453    H    MET  56           H        MET  56   5.840   7.621   3.290
  454    HA   MET  56           HA       MET  56   5.024  10.446   3.423
  455    HB2  MET  56           2HB      MET  56   3.590   7.842   4.077
  456    HB3  MET  56           1HB      MET  56   2.918   9.410   4.517
  457    HG2  MET  56           2HG      MET  56   1.961   8.596   2.426
  458    HG3  MET  56           1HG      MET  56   2.876  10.081   2.173
  459    HE1  MET  56           3HE      MET  56   4.009   5.905   0.610
  460    HE2  MET  56           1HE      MET  56   2.419   6.385   1.203
  461    HE3  MET  56           2HE      MET  56   3.756   6.169   2.334
  462    H    GLY  57           H        GLY  57   6.999   8.514   5.188
  463    HA2  GLY  57           2HA      GLY  57   8.060   8.815   7.179
  464    HA3  GLY  57           1HA      GLY  57   7.219  10.348   7.346
  465    H    VAL  58           H        VAL  58   5.378   7.386   6.987
  466    HA   VAL  58           HA       VAL  58   4.713   7.402   9.862
  467    HB   VAL  58           HB       VAL  58   3.095   8.906   8.772
  468   HG11  VAL  58          1HG1      VAL  58   2.327   6.586   6.974
  469   HG12  VAL  58          2HG1      VAL  58   3.096   8.095   6.476
  470   HG13  VAL  58          3HG1      VAL  58   1.443   8.116   7.097
  471   HG21  VAL  58          3HG2      VAL  58   2.329   7.568  10.684
  472   HG22  VAL  58          1HG2      VAL  58   1.796   6.295   9.579
  473   HG23  VAL  58          2HG2      VAL  58   1.011   7.877   9.550
  474    H    SER  59           H        SER  59   4.847   5.391  10.619
  475    HA   SER  59           HA       SER  59   5.289   3.140   8.896
  476    HB2  SER  59           2HB      SER  59   5.546   1.900  11.098
  477    HB3  SER  59           1HB      SER  59   6.581   3.319  10.955
  478    HG   SER  59           HG       SER  59   5.202   4.442  12.300
  479    H    ILE  60           H        ILE  60   3.875   1.499   8.374
  480    HA   ILE  60           HA       ILE  60   1.268   1.255   9.683
  481    HB   ILE  60           HB       ILE  60   2.620  -0.698   7.749
  482   HG12  ILE  60          2HG1      ILE  60   1.889   1.660   6.804
  483   HG13  ILE  60          1HG1      ILE  60   1.425   0.210   5.924
  484   HG21  ILE  60          1HG2      ILE  60   1.031  -1.837   9.183
  485   HG22  ILE  60          2HG2      ILE  60   0.337  -1.706   7.572
  486   HG23  ILE  60          3HG2      ILE  60  -0.214  -0.630   8.858
  487   HD11  ILE  60          3HD1      ILE  60  -0.823   0.347   6.722
  488   HD12  ILE  60          1HD1      ILE  60  -0.364   1.937   6.120
  489   HD13  ILE  60          2HD1      ILE  60  -0.413   1.630   7.857
  490    HA   PRO  61           HA       PRO  61   3.506  -1.337  12.744
  491    HB2  PRO  61           2HB      PRO  61   1.807  -0.962  14.821
  492    HB3  PRO  61           1HB      PRO  61   2.942   0.308  14.315
  493    HG2  PRO  61           2HG      PRO  61   0.020   0.059  13.699
  494    HG3  PRO  61           1HG      PRO  61   0.946   1.494  14.190
  495    HD2  PRO  61           2HD      PRO  61   0.268   0.900  11.581
  496    HD3  PRO  61           1HD      PRO  61   1.656   1.906  12.033
  497    H    SER  62           H        SER  62   2.821  -3.250  14.017
  498    HA   SER  62           HA       SER  62   1.491  -5.104  12.367
  499    HB2  SER  62           2HB      SER  62   2.296  -5.470  15.276
  500    HB3  SER  62           1HB      SER  62   2.014  -6.746  14.080
  501    HG   SER  62           HG       SER  62   3.866  -6.319  13.154
  502    H    THR  63           H        THR  63   0.353  -3.210  15.049
  503    HA   THR  63           HA       THR  63  -2.107  -4.582  15.532
  504    HB   THR  63           HB       THR  63  -1.142  -3.185  17.268
  505    HG1  THR  63           HG1      THR  63  -3.677  -3.031  16.547
  506   HG21  THR  63          3HG2      THR  63  -1.019  -0.735  17.116
  507   HG22  THR  63          1HG2      THR  63  -1.595  -0.794  15.450
  508   HG23  THR  63          2HG2      THR  63  -0.026  -1.489  15.865
  509    H    HIS  64           H        HIS  64  -1.105  -2.393  13.060
  510    HA   HIS  64           HA       HIS  64  -3.870  -1.941  12.107
  511    HB2  HIS  64           2HB      HIS  64  -1.277  -0.444  11.627
  512    HB3  HIS  64           1HB      HIS  64  -2.617  -0.296  10.495
  513    HD1  HIS  64           HD1      HIS  64  -1.806   0.399  14.141
  514    HD2  HIS  64           HD2      HIS  64  -4.588   1.484  11.250
  515    HE1  HIS  64           HE1      HIS  64  -3.120   2.282  15.150
  516    HE2  HIS  64           HE2      HIS  64  -4.587   3.098  13.278
  517    H    ILE  65           H        ILE  65  -1.997  -4.426  11.869
  518    HA   ILE  65           HA       ILE  65  -2.008  -4.733   8.946
  519    HB   ILE  65           HB       ILE  65  -1.049  -6.668  11.096
  520   HG12  ILE  65          2HG1      ILE  65   0.424  -4.746  10.948
  521   HG13  ILE  65          1HG1      ILE  65   1.233  -6.110  10.188
  522   HG21  ILE  65          1HG2      ILE  65  -0.818  -6.929   8.063
  523   HG22  ILE  65          2HG2      ILE  65  -1.827  -7.917   9.124
  524   HG23  ILE  65          3HG2      ILE  65  -0.072  -8.004   9.255
  525   HD11  ILE  65          3HD1      ILE  65   0.651  -5.220   7.991
  526   HD12  ILE  65          1HD1      ILE  65   1.569  -4.061   8.955
  527   HD13  ILE  65          2HD1      ILE  65  -0.174  -3.860   8.762
  528    H    THR  66           H        THR  66  -4.126  -4.707   8.507
  529    HA   THR  66           HA       THR  66  -5.449  -7.298   8.752
  530    HB   THR  66           HB       THR  66  -6.654  -6.022  10.446
  531    HG1  THR  66           HG1      THR  66  -8.311  -7.001   9.555
  532   HG21  THR  66          3HG2      THR  66  -6.023  -3.741   9.725
  533   HG22  THR  66          1HG2      THR  66  -7.766  -3.885   9.993
  534   HG23  THR  66          2HG2      THR  66  -7.127  -3.879   8.348
  535    H    GLY  67           H        GLY  67  -7.106  -7.504   7.059
  536    HA2  GLY  67           2HA      GLY  67  -6.124  -6.860   4.501
  537    HA3  GLY  67           1HA      GLY  67  -7.703  -7.529   4.877
  538    H    LYS  68           H        LYS  68  -8.565  -5.329   6.540
  539    HA   LYS  68           HA       LYS  68  -9.994  -3.750   4.782
  540    HB2  LYS  68           2HB      LYS  68 -10.514  -4.068   7.195
  541    HB3  LYS  68           1HB      LYS  68  -9.152  -3.040   7.627
  542    HG2  LYS  68           2HG      LYS  68 -10.220  -1.086   6.810
  543    HG3  LYS  68           1HG      LYS  68 -11.427  -2.013   5.917
  544    HD2  LYS  68           2HD      LYS  68 -12.566  -1.147   7.817
  545    HD3  LYS  68           1HD      LYS  68 -12.294  -2.849   8.176
  546    HE2  LYS  68           2HE      LYS  68 -11.788  -1.701  10.183
  547    HE3  LYS  68           1HE      LYS  68 -10.207  -2.048   9.479
  548    HZ1  LYS  68           3HZ      LYS  68 -11.671   0.531   9.454
  549    HZ2  LYS  68           1HZ      LYS  68 -10.286   0.237   8.529
  550    HZ3  LYS  68           2HZ      LYS  68 -10.204   0.177  10.214
  551    H    TYR  69           H        TYR  69  -6.787  -3.170   6.080
  552    HA   TYR  69           HA       TYR  69  -6.684  -0.411   5.101
  553    HB2  TYR  69           2HB      TYR  69  -4.732  -2.038   6.778
  554    HB3  TYR  69           1HB      TYR  69  -4.481  -0.355   6.309
  555    HD1  TYR  69           HD2      TYR  69  -7.434   0.559   6.628
  556    HD2  TYR  69           HD1      TYR  69  -4.844  -1.671   9.198
  557    HE1  TYR  69           HE2      TYR  69  -8.738   1.281   8.557
  558    HE2  TYR  69           HE1      TYR  69  -6.163  -0.939  11.129
  559    HH   TYR  69           HH       TYR  69  -7.725   0.813  11.768
  560    H    PHE  70           H        PHE  70  -5.768  -3.521   4.011
  561    HA   PHE  70           HA       PHE  70  -3.947  -2.356   1.946
  562    HB2  PHE  70           2HB      PHE  70  -3.823  -5.090   3.323
  563    HB3  PHE  70           1HB      PHE  70  -2.881  -4.677   1.901
  564    HD1  PHE  70           HD1      PHE  70  -1.053  -2.986   2.037
  565    HD2  PHE  70           HD2      PHE  70  -3.161  -4.262   5.538
  566    HE1  PHE  70           HE1      PHE  70   0.729  -2.059   3.455
  567    HE2  PHE  70           HE2      PHE  70  -1.370  -3.334   6.945
  568    HZ   PHE  70           HZ       PHE  70   0.576  -2.232   5.903
  569    H    LYS  71           H        LYS  71  -6.988  -2.917   1.973
  570    HA   LYS  71           HA       LYS  71  -7.702  -5.053   0.297
  571    HB2  LYS  71           2HB      LYS  71  -8.924  -2.258   0.342
  572    HB3  LYS  71           1HB      LYS  71  -9.665  -3.652  -0.425
  573    HG2  LYS  71           2HG      LYS  71  -9.103  -3.391   2.538
  574    HG3  LYS  71           1HG      LYS  71 -10.660  -3.083   1.770
  575    HD2  LYS  71           2HD      LYS  71  -9.190  -5.747   1.798
  576    HD3  LYS  71           1HD      LYS  71 -10.568  -5.326   2.813
  577    HE2  LYS  71           2HE      LYS  71 -11.993  -5.126   0.846
  578    HE3  LYS  71           1HE      LYS  71 -10.620  -5.456  -0.215
  579    HZ1  LYS  71           3HZ      LYS  71 -10.436  -7.646   0.782
  580    HZ2  LYS  71           1HZ      LYS  71 -11.975  -7.417   0.132
  581    HZ3  LYS  71           2HZ      LYS  71 -11.742  -7.330   1.797
  582    H    ASP  72           H        ASP  72  -6.798  -1.756  -0.532
  583    HA   ASP  72           HA       ASP  72  -5.722  -2.298  -3.124
  584    HB2  ASP  72           2HB      ASP  72  -7.417  -1.115  -4.472
  585    HB3  ASP  72           1HB      ASP  72  -8.205  -2.435  -3.615
  586    H    LEU  73           H        LEU  73  -5.850   0.278  -4.203
  587    HA   LEU  73           HA       LEU  73  -3.971   1.620  -2.509
  588    HB2  LEU  73           2HB      LEU  73  -3.782   1.758  -4.968
  589    HB3  LEU  73           1HB      LEU  73  -5.282   2.669  -5.036
  590    HG   LEU  73           HG       LEU  73  -4.227   4.544  -3.784
  591   HD11  LEU  73          1HD1      LEU  73  -2.638   3.290  -2.400
  592   HD12  LEU  73          2HD1      LEU  73  -1.788   4.532  -3.314
  593   HD13  LEU  73          3HD1      LEU  73  -1.700   2.848  -3.831
  594   HD21  LEU  73          3HD2      LEU  73  -2.669   3.660  -6.242
  595   HD22  LEU  73          1HD2      LEU  73  -2.604   5.280  -5.537
  596   HD23  LEU  73          2HD2      LEU  73  -4.114   4.672  -6.206
  597    H    ASN  74           H        ASN  74  -7.386   2.174  -3.280
  598    HA   ASN  74           HA       ASN  74  -7.577   4.733  -2.004
  599    HB2  ASN  74           2HB      ASN  74  -9.783   2.727  -2.666
  600    HB3  ASN  74           1HB      ASN  74 -10.040   4.405  -2.191
  601   HD21  ASN  74          1HD2      ASN  74  -8.933   2.287  -4.744
  602   HD22  ASN  74          2HD2      ASN  74  -8.927   3.491  -5.992
  603    H    ALA  75           H        ALA  75  -7.935   1.398  -0.882
  604    HA   ALA  75           HA       ALA  75  -8.855   1.924   1.747
  605    HB1  ALA  75           3HB      ALA  75  -8.853  -0.333   0.763
  606    HB2  ALA  75           1HB      ALA  75  -7.992  -0.312   2.307
  607    HB3  ALA  75           2HB      ALA  75  -7.091  -0.350   0.788
  608    H    ILE  76           H        ILE  76  -5.540   1.447   0.526
  609    HA   ILE  76           HA       ILE  76  -4.113   2.114   2.896
  610    HB   ILE  76           HB       ILE  76  -3.241   2.166  -0.033
  611   HG12  ILE  76          2HG1      ILE  76  -2.697   0.138   2.165
  612   HG13  ILE  76          1HG1      ILE  76  -3.888  -0.077   0.885
  613   HG21  ILE  76          1HG2      ILE  76  -1.762   3.675   1.302
  614   HG22  ILE  76          2HG2      ILE  76  -0.893   2.239   0.749
  615   HG23  ILE  76          3HG2      ILE  76  -1.441   2.345   2.422
  616   HD11  ILE  76          3HD1      ILE  76  -2.066  -0.096  -0.766
  617   HD12  ILE  76          1HD1      ILE  76  -1.897  -1.358   0.459
  618   HD13  ILE  76          2HD1      ILE  76  -0.899   0.096   0.550
  619    H    SER  77           H        SER  77  -5.509   4.079   0.351
  620    HA   SER  77           HA       SER  77  -4.041   6.477   0.777
  621    HB2  SER  77           2HB      SER  77  -5.278   6.100  -1.322
  622    HB3  SER  77           1HB      SER  77  -6.806   6.046  -0.449
  623    HG   SER  77           HG       SER  77  -5.621   8.337   0.172
  624    H    ARG  78           H        ARG  78  -6.957   5.145   2.219
  625    HA   ARG  78           HA       ARG  78  -7.451   7.556   3.779
  626    HB2  ARG  78           2HB      ARG  78  -8.795   4.819   3.870
  627    HB3  ARG  78           1HB      ARG  78  -9.322   6.230   4.792
  628    HG2  ARG  78           2HG      ARG  78  -9.300   5.937   1.772
  629    HG3  ARG  78           1HG      ARG  78 -10.723   5.986   2.813
  630    HD2  ARG  78           2HD      ARG  78 -10.342   8.324   3.340
  631    HD3  ARG  78           1HD      ARG  78  -8.759   8.303   2.560
  632    HE   ARG  78           HE       ARG  78 -11.163   7.795   0.941
  633   HH11  ARG  78          1HH1      ARG  78  -8.495   9.947   1.736
  634   HH12  ARG  78          2HH1      ARG  78  -8.727  10.935   0.329
  635   HH21  ARG  78          1HH2      ARG  78 -11.438   9.085  -0.886
  636   HH22  ARG  78          2HH2      ARG  78 -10.397  10.443  -1.159
  637    H    THR  79           H        THR  79  -6.226   4.263   4.330
  638    HA   THR  79           HA       THR  79  -5.899   4.232   7.091
  639    HB   THR  79           HB       THR  79  -4.036   2.980   5.024
  640    HG1  THR  79           HG1      THR  79  -5.666   1.711   4.634
  641   HG21  THR  79          3HG2      THR  79  -4.543   2.185   7.930
  642   HG22  THR  79          1HG2      THR  79  -3.051   2.897   7.303
  643   HG23  THR  79          2HG2      THR  79  -3.555   1.291   6.777
  644    H    VAL  80           H        VAL  80  -3.661   5.375   4.629
  645    HA   VAL  80           HA       VAL  80  -1.430   5.842   6.293
  646    HB   VAL  80           HB       VAL  80  -1.351   5.443   3.793
  647   HG11  VAL  80          1HG1      VAL  80  -1.720   7.286   2.217
  648   HG12  VAL  80          2HG1      VAL  80  -2.266   8.340   3.528
  649   HG13  VAL  80          3HG1      VAL  80  -3.206   6.908   3.094
  650   HG21  VAL  80          3HG2      VAL  80   0.609   6.372   4.982
  651   HG22  VAL  80          1HG2      VAL  80   0.042   8.013   4.665
  652   HG23  VAL  80          2HG2      VAL  80   0.515   6.963   3.324
  653    H    GLU  81           H        GLU  81  -4.209   7.794   5.372
  654    HA   GLU  81           HA       GLU  81  -3.247  10.266   6.585
  655    HB2  GLU  81           2HB      GLU  81  -6.045   9.532   5.618
  656    HB3  GLU  81           1HB      GLU  81  -5.465  11.158   5.980
  657    HG2  GLU  81           2HG      GLU  81  -3.859  11.013   4.143
  658    HG3  GLU  81           1HG      GLU  81  -4.371   9.361   3.807
  659    H    GLN  82           H        GLN  82  -5.329   7.549   7.569
  660    HA   GLN  82           HA       GLN  82  -6.430   8.672   9.949
  661    HB2  GLN  82           2HB      GLN  82  -5.756   5.734   9.460
  662    HB3  GLN  82           1HB      GLN  82  -6.830   6.349  10.712
  663    HG2  GLN  82           2HG      GLN  82  -7.313   6.425   7.728
  664    HG3  GLN  82           1HG      GLN  82  -8.079   5.350   8.879
  665   HE21  GLN  82          1HE2      GLN  82  -8.525   7.478  10.868
  666   HE22  GLN  82          2HE2      GLN  82  -9.819   8.428  10.244
  667    H    LEU  83           H        LEU  83  -3.505   6.891   9.235
  668    HA   LEU  83           HA       LEU  83  -2.446   6.656  11.869
  669    HB2  LEU  83           2HB      LEU  83  -1.149   6.506   9.129
  670    HB3  LEU  83           1HB      LEU  83  -0.276   6.183  10.619
  671    HG   LEU  83           HG       LEU  83  -2.646   4.559   9.610
  672   HD11  LEU  83          1HD1      LEU  83   0.320   3.908   9.605
  673   HD12  LEU  83          2HD1      LEU  83  -0.664   4.285   8.187
  674   HD13  LEU  83          3HD1      LEU  83  -0.990   2.824   9.117
  675   HD21  LEU  83          3HD2      LEU  83  -0.798   4.122  11.989
  676   HD22  LEU  83          1HD2      LEU  83  -1.989   2.962  11.391
  677   HD23  LEU  83          2HD2      LEU  83  -2.520   4.503  12.049
  678    H    LYS  84           H        LYS  84  -1.948   9.026   9.247
  679    HA   LYS  84           HA       LYS  84   0.045  10.534  10.591
  680    HB2  LYS  84           2HB      LYS  84  -1.885  11.345   8.380
  681    HB3  LYS  84           1HB      LYS  84  -0.681  12.453   9.038
  682    HG2  LYS  84           2HG      LYS  84   1.095  10.780   8.376
  683    HG3  LYS  84           1HG      LYS  84  -0.161   9.869   7.532
  684    HD2  LYS  84           2HD      LYS  84   0.712  12.731   6.961
  685    HD3  LYS  84           1HD      LYS  84   1.048  11.317   5.963
  686    HE2  LYS  84           2HE      LYS  84  -1.295  11.091   5.389
  687    HE3  LYS  84           1HE      LYS  84  -1.750  12.354   6.534
  688    HZ1  LYS  84           3HZ      LYS  84  -0.431  13.927   5.199
  689    HZ2  LYS  84           1HZ      LYS  84  -1.726  13.257   4.350
  690    HZ3  LYS  84           2HZ      LYS  84  -0.158  12.715   4.051
  691    H    ALA  85           H        ALA  85  -3.492  10.640  10.707
  692    HA   ALA  85           HA       ALA  85  -3.756  12.992  12.287
  693    HB1  ALA  85           3HB      ALA  85  -5.588  10.573  12.106
  694    HB2  ALA  85           1HB      ALA  85  -5.653  12.000  11.064
  695    HB3  ALA  85           2HB      ALA  85  -6.024  12.145  12.782
  696    H    GLU  86           H        GLU  86  -3.646   9.529  13.152
  697    HA   GLU  86           HA       GLU  86  -3.775   9.643  15.948
  698    HB2  GLU  86           2HB      GLU  86  -2.304   7.655  14.154
  699    HB3  GLU  86           1HB      GLU  86  -2.602   7.393  15.870
  700    HG2  GLU  86           2HG      GLU  86  -4.990   7.284  15.502
  701    HG3  GLU  86           1HG      GLU  86  -4.797   7.752  13.814
  702    H    SER  87           H        SER  87  -1.022   9.885  13.765
  703    HA   SER  87           HA       SER  87   0.974   9.979  15.874
  704    HB2  SER  87           2HB      SER  87   1.214  10.317  12.853
  705    HB3  SER  87           1HB      SER  87   2.584  10.239  13.967
  706    HG   SER  87           HG       SER  87   0.618   8.214  13.634
  707    H    ALA  88           H        ALA  88  -0.876  12.378  14.087
  708    HA   ALA  88           HA       ALA  88   1.048  14.509  14.174
  709    HB1  ALA  88           3HB      ALA  88  -0.759  14.493  12.514
  710    HB2  ALA  88           1HB      ALA  88  -0.810  15.977  13.470
  711    HB3  ALA  88           2HB      ALA  88  -1.964  14.675  13.786
  712    H    LEU  89           H        LEU  89   1.349  16.131  15.626
  713    HA   LEU  89           HA       LEU  89   0.517  16.063  18.288
  714    HB2  LEU  89           2HB      LEU  89   1.548  18.187  18.573
  715    HB3  LEU  89           1HB      LEU  89   2.496  17.360  17.355
  716    HG   LEU  89           HG       LEU  89   0.458  19.561  16.781
  717   HD11  LEU  89          1HD1      LEU  89   2.416  20.976  16.287
  718   HD12  LEU  89          2HD1      LEU  89   3.486  19.672  16.812
  719   HD13  LEU  89          3HD1      LEU  89   2.395  20.442  17.967
  720   HD21  LEU  89          3HD2      LEU  89   2.425  18.230  14.876
  721   HD22  LEU  89          1HD2      LEU  89   1.383  19.603  14.490
  722   HD23  LEU  89          2HD2      LEU  89   0.670  18.033  14.856
  723    H    GLU  90           H        GLU  90  -1.005  17.321  15.458
  724    HA   GLU  90           HA       GLU  90  -3.017  18.884  16.908
  725    HB2  GLU  90           2HB      GLU  90  -3.599  19.760  14.616
  726    HB3  GLU  90           1HB      GLU  90  -1.960  20.112  15.145
  727    HG2  GLU  90           2HG      GLU  90  -1.164  18.161  13.765
  728    HG3  GLU  90           1HG      GLU  90  -2.798  18.025  13.114
  729   H281  4EM 101          2H28      PYA 142   0.951 -10.720   8.342
  730   H283  4EM 101          3H28      PYA 142   1.630 -11.839   9.528
  731   H303  4EM 101          3H30      PYA 142  -1.496 -12.409   7.567
  732   H301  4EM 101          1H30      PYA 142  -1.546 -10.677   7.925
  733   H302  4EM 101          2H30      PYA 142  -2.602 -11.798   8.789
  734   H312  4EM 101          2H31      PYA 142  -1.675 -10.911  10.979
  735   H313  4EM 101          3H31      PYA 142   0.061 -10.921  11.268
  736   H311  4EM 101          1H31      PYA 142  -0.622  -9.812  10.071
  737    H32  4EM 101           H32      PYA 142  -0.373 -14.021   9.254
  738    H33  4EM 101           H33      PYA 142   0.245 -14.258  11.519
  739    H36  4EM 101           H36      PYA 142  -2.533 -14.383   8.837
  740   H373  4EM 101          3H37      PYA 142  -4.275 -15.702  10.061
  741   H372  4EM 101          2H37      PYA 142  -4.535 -14.247  11.021
  742   H382  4EM 101          2H38      PYA 142  -5.222 -13.014   9.014
  743   H383  4EM 101          3H38      PYA 142  -6.239 -14.431   9.271
  744    H41  4EM 101           H41      PYA 142  -5.368 -12.750   6.835
  745   H423  4EM 101          3H42      PYA 142  -5.631 -14.579   4.780
  746   H422  4EM 101          2H42      PYA 142  -3.892 -14.393   5.028
  747   H433  4EM 101          3H43      PYA 142  -5.837 -12.142   4.420
  748   H432  4EM 101          2H43      PYA 142  -4.709 -12.873   3.271
  749    H44  4EM 101           H44      PYA 142  -2.971 -12.213   4.684
  750    H49  4EM 101           H49      PYA 142  -3.676  -7.919   5.859
  751    H51  4EM 101           H51      PYA 142  -1.121  -7.429   6.197
  752    H50  4EM 101           H50      PYA 142   0.166  -9.678   6.038
  753    H48  4EM 101           H48      PYA 142  -1.565 -11.472   5.441
  Start of MODEL   15
    1    H1   MET   1           1H       MET   1   4.791  10.802  -0.895
    2    H2   MET   1           2H       MET   1   5.217  12.007   0.199
    3    H3   MET   1           3H       MET   1   6.384  11.366  -0.842
    4    HA   MET   1           HA       MET   1   5.694  13.523  -1.596
    5    HB2  MET   1           2HB      MET   1   6.237  11.527  -3.179
    6    HB3  MET   1           1HB      MET   1   4.508  11.417  -3.461
    7    HG2  MET   1           2HG      MET   1   4.505  13.679  -4.398
    8    HG3  MET   1           1HG      MET   1   6.231  13.832  -4.053
    9    HE1  MET   1           3HE      MET   1   5.016  14.382  -6.950
   10    HE2  MET   1           1HE      MET   1   6.164  13.528  -7.980
   11    HE3  MET   1           2HE      MET   1   6.747  14.478  -6.616
   12    H    ASP   2           H        ASP   2   3.673  14.467  -3.035
   13    HA   ASP   2           HA       ASP   2   1.559  14.948  -1.235
   14    HB2  ASP   2           2HB      ASP   2   2.478  16.406  -3.224
   15    HB3  ASP   2           1HB      ASP   2   1.348  15.504  -4.220
   16    H    GLY   3           H        GLY   3  -0.781  14.589  -1.748
   17    HA2  GLY   3           2HA      GLY   3  -1.406  12.045  -1.116
   18    HA3  GLY   3           1HA      GLY   3  -2.541  13.167  -1.832
   19    H    GLU   4           H        GLU   4  -1.943  13.299  -4.472
   20    HA   GLU   4           HA       GLU   4  -2.950  10.700  -5.277
   21    HB2  GLU   4           2HB      GLU   4  -2.655  13.314  -6.802
   22    HB3  GLU   4           1HB      GLU   4  -3.335  11.845  -7.508
   23    HG2  GLU   4           2HG      GLU   4  -5.141  11.840  -5.861
   24    HG3  GLU   4           1HG      GLU   4  -4.446  13.246  -5.062
   25    H    GLU   5           H        GLU   5   0.049  12.442  -5.651
   26    HA   GLU   5           HA       GLU   5   0.947  10.908  -7.935
   27    HB2  GLU   5           2HB      GLU   5   3.279  12.078  -7.023
   28    HB3  GLU   5           1HB      GLU   5   2.185  12.795  -8.179
   29    HG2  GLU   5           2HG      GLU   5   1.897  13.324  -5.222
   30    HG3  GLU   5           1HG      GLU   5   3.024  14.230  -6.217
   31    H    VAL   6           H        VAL   6   1.309  10.722  -4.447
   32    HA   VAL   6           HA       VAL   6   3.449   8.808  -4.526
   33    HB   VAL   6           HB       VAL   6   3.091  10.333  -2.585
   34   HG11  VAL   6          1HG1      VAL   6   0.707   8.573  -1.899
   35   HG12  VAL   6          2HG1      VAL   6   0.641  10.272  -2.376
   36   HG13  VAL   6          3HG1      VAL   6   1.406   9.814  -0.853
   37   HG21  VAL   6          3HG2      VAL   6   3.640   8.705  -0.838
   38   HG22  VAL   6          1HG2      VAL   6   4.483   8.333  -2.341
   39   HG23  VAL   6          2HG2      VAL   6   3.068   7.391  -1.865
   40    H    LYS   7           H        LYS   7  -0.040   8.625  -4.621
   41    HA   LYS   7           HA       LYS   7  -0.557   6.081  -3.604
   42    HB2  LYS   7           2HB      LYS   7  -2.011   7.687  -5.745
   43    HB3  LYS   7           1HB      LYS   7  -2.615   6.145  -5.154
   44    HG2  LYS   7           2HG      LYS   7  -2.592   7.199  -2.814
   45    HG3  LYS   7           1HG      LYS   7  -2.313   8.732  -3.631
   46    HD2  LYS   7           2HD      LYS   7  -4.718   6.933  -4.124
   47    HD3  LYS   7           1HD      LYS   7  -4.713   8.333  -3.062
   48    HE2  LYS   7           2HE      LYS   7  -5.738   8.989  -5.108
   49    HE3  LYS   7           1HE      LYS   7  -4.171   9.763  -5.043
   50    HZ1  LYS   7           3HZ      LYS   7  -4.746   7.288  -6.581
   51    HZ2  LYS   7           1HZ      LYS   7  -3.342   8.224  -6.644
   52    HZ3  LYS   7           2HZ      LYS   7  -4.789   8.850  -7.237
   53    H    GLU   8           H        GLU   8  -0.188   6.869  -7.090
   54    HA   GLU   8           HA       GLU   8  -0.174   4.206  -8.038
   55    HB2  GLU   8           2HB      GLU   8   0.808   5.174 -10.124
   56    HB3  GLU   8           1HB      GLU   8  -0.608   6.048  -9.557
   57    HG2  GLU   8           2HG      GLU   8   0.808   7.813  -8.619
   58    HG3  GLU   8           1HG      GLU   8   2.261   6.933  -9.094
   59    H    LYS   9           H        LYS   9   2.364   6.241  -6.771
   60    HA   LYS   9           HA       LYS   9   4.630   4.840  -7.684
   61    HB2  LYS   9           2HB      LYS   9   4.294   7.310  -6.879
   62    HB3  LYS   9           1HB      LYS   9   4.529   6.655  -5.259
   63    HG2  LYS   9           2HG      LYS   9   6.749   5.826  -5.938
   64    HG3  LYS   9           1HG      LYS   9   6.478   6.483  -7.555
   65    HD2  LYS   9           2HD      LYS   9   7.885   8.015  -6.222
   66    HD3  LYS   9           1HD      LYS   9   6.338   8.762  -6.628
   67    HE2  LYS   9           2HE      LYS   9   6.946   9.224  -4.300
   68    HE3  LYS   9           1HE      LYS   9   5.492   8.226  -4.371
   69    HZ1  LYS   9           3HZ      LYS   9   8.249   7.284  -3.810
   70    HZ2  LYS   9           1HZ      LYS   9   6.898   6.281  -3.959
   71    HZ3  LYS   9           2HZ      LYS   9   6.978   7.409  -2.707
   72    H    ILE  10           H        ILE  10   2.584   4.536  -4.835
   73    HA   ILE  10           HA       ILE  10   4.192   2.688  -3.353
   74    HB   ILE  10           HB       ILE  10   1.146   2.926  -3.371
   75   HG12  ILE  10          2HG1      ILE  10   2.077   5.099  -2.777
   76   HG13  ILE  10          1HG1      ILE  10   1.383   4.365  -1.347
   77   HG21  ILE  10          1HG2      ILE  10   1.859   0.841  -2.326
   78   HG22  ILE  10          2HG2      ILE  10   1.220   1.943  -1.107
   79   HG23  ILE  10          3HG2      ILE  10   2.964   1.719  -1.264
   80   HD11  ILE  10          3HD1      ILE  10   4.318   4.537  -2.019
   81   HD12  ILE  10          1HD1      ILE  10   3.645   3.745  -0.589
   82   HD13  ILE  10          2HD1      ILE  10   3.446   5.481  -0.813
   83    H    ARG  11           H        ARG  11   1.631   2.384  -5.783
   84    HA   ARG  11           HA       ARG  11   1.622  -0.478  -5.927
   85    HB2  ARG  11           2HB      ARG  11   0.416   1.658  -7.676
   86    HB3  ARG  11           1HB      ARG  11   0.254  -0.059  -8.046
   87    HG2  ARG  11           2HG      ARG  11  -0.664   1.273  -5.490
   88    HG3  ARG  11           1HG      ARG  11  -1.709   0.830  -6.842
   89    HD2  ARG  11           2HD      ARG  11  -1.391  -1.501  -6.453
   90    HD3  ARG  11           1HD      ARG  11  -0.009  -1.218  -5.400
   91    HE   ARG  11           HE       ARG  11  -2.803  -1.119  -4.707
   92   HH11  ARG  11          1HH1      ARG  11   0.384  -0.019  -3.713
   93   HH12  ARG  11          2HH1      ARG  11  -0.059   0.129  -2.044
   94   HH21  ARG  11          1HH2      ARG  11  -3.283  -1.137  -2.496
   95   HH22  ARG  11          2HH2      ARG  11  -2.143  -0.508  -1.361
   96    H    ARG  12           H        ARG  12   3.502   1.977  -7.464
   97    HA   ARG  12           HA       ARG  12   4.466   0.405  -9.650
   98    HB2  ARG  12           2HB      ARG  12   5.410   2.965  -8.327
   99    HB3  ARG  12           1HB      ARG  12   6.415   2.184  -9.537
  100    HG2  ARG  12           2HG      ARG  12   3.664   3.405  -9.896
  101    HG3  ARG  12           1HG      ARG  12   5.170   3.867 -10.689
  102    HD2  ARG  12           2HD      ARG  12   5.182   1.609 -11.804
  103    HD3  ARG  12           1HD      ARG  12   3.578   1.327 -11.126
  104    HE   ARG  12           HE       ARG  12   3.073   3.538 -12.445
  105   HH11  ARG  12          1HH1      ARG  12   5.077   0.866 -13.469
  106   HH12  ARG  12          2HH1      ARG  12   4.749   1.096 -15.161
  107   HH21  ARG  12          1HH2      ARG  12   2.607   3.817 -14.671
  108   HH22  ARG  12          2HH2      ARG  12   3.346   2.765 -15.841
  109    H    TYR  13           H        TYR  13   5.662   1.183  -6.449
  110    HA   TYR  13           HA       TYR  13   7.958  -0.399  -6.382
  111    HB2  TYR  13           2HB      TYR  13   7.412   1.238  -4.664
  112    HB3  TYR  13           1HB      TYR  13   5.977   0.337  -4.202
  113    HD1  TYR  13           HD1      TYR  13   9.688  -0.243  -4.548
  114    HD2  TYR  13           HD2      TYR  13   6.170  -0.951  -2.227
  115    HE1  TYR  13           HE1      TYR  13  11.040  -1.370  -2.843
  116    HE2  TYR  13           HE2      TYR  13   7.525  -2.079  -0.530
  117    HH   TYR  13           HH       TYR  13  10.876  -1.874  -0.396
  118    H    ILE  14           H        ILE  14   4.570  -1.296  -5.615
  119    HA   ILE  14           HA       ILE  14   4.989  -3.956  -4.820
  120    HB   ILE  14           HB       ILE  14   2.553  -2.640  -6.115
  121   HG12  ILE  14          2HG1      ILE  14   3.340  -3.291  -3.235
  122   HG13  ILE  14          1HG1      ILE  14   3.059  -1.699  -3.928
  123   HG21  ILE  14          1HG2      ILE  14   1.235  -4.607  -5.332
  124   HG22  ILE  14          2HG2      ILE  14   2.727  -5.412  -4.836
  125   HG23  ILE  14          3HG2      ILE  14   2.433  -5.064  -6.541
  126   HD11  ILE  14          3HD1      ILE  14   0.682  -2.271  -4.167
  127   HD12  ILE  14          1HD1      ILE  14   1.253  -2.325  -2.502
  128   HD13  ILE  14          2HD1      ILE  14   1.002  -3.825  -3.390
  129    H    MET  15           H        MET  15   3.917  -2.800  -8.030
  130    HA   MET  15           HA       MET  15   3.892  -5.423  -9.130
  131    HB2  MET  15           2HB      MET  15   3.779  -2.704 -10.504
  132    HB3  MET  15           1HB      MET  15   3.448  -4.243 -11.295
  133    HG2  MET  15           2HG      MET  15   1.874  -3.075  -8.982
  134    HG3  MET  15           1HG      MET  15   1.369  -3.091 -10.672
  135    HE1  MET  15           3HE      MET  15   0.531  -5.171 -11.953
  136    HE2  MET  15           1HE      MET  15   0.606  -6.830 -11.342
  137    HE3  MET  15           2HE      MET  15   2.094  -5.965 -11.727
  138    H    GLU  16           H        GLU  16   6.253  -2.734  -9.409
  139    HA   GLU  16           HA       GLU  16   7.868  -4.156 -11.334
  140    HB2  GLU  16           2HB      GLU  16   8.470  -1.607  -9.781
  141    HB3  GLU  16           1HB      GLU  16   9.425  -2.230 -11.120
  142    HG2  GLU  16           2HG      GLU  16   7.457  -1.974 -12.620
  143    HG3  GLU  16           1HG      GLU  16   6.543  -1.283 -11.280
  144    H    ASP  17           H        ASP  17   7.931  -3.931  -7.788
  145    HA   ASP  17           HA       ASP  17  10.511  -5.426  -7.764
  146    HB2  ASP  17           2HB      ASP  17   9.164  -3.970  -5.447
  147    HB3  ASP  17           1HB      ASP  17  10.703  -4.822  -5.375
  148    H    LEU  18           H        LEU  18   7.415  -5.385  -5.929
  149    HA   LEU  18           HA       LEU  18   7.941  -7.882  -4.651
  150    HB2  LEU  18           2HB      LEU  18   5.417  -6.212  -4.817
  151    HB3  LEU  18           1HB      LEU  18   5.493  -7.702  -3.910
  152    HG   LEU  18           HG       LEU  18   5.753  -5.913  -2.337
  153   HD11  LEU  18          1HD1      LEU  18   7.215  -7.853  -1.910
  154   HD12  LEU  18          2HD1      LEU  18   7.888  -6.361  -1.277
  155   HD13  LEU  18          3HD1      LEU  18   8.537  -7.051  -2.764
  156   HD21  LEU  18          3HD2      LEU  18   8.036  -4.781  -3.984
  157   HD22  LEU  18          1HD2      LEU  18   7.473  -4.169  -2.425
  158   HD23  LEU  18          2HD2      LEU  18   6.424  -4.086  -3.835
  159    H    ILE  19           H        ILE  19   6.030  -7.092  -7.532
  160    HA   ILE  19           HA       ILE  19   5.462  -9.912  -8.072
  161    HB   ILE  19           HB       ILE  19   4.888  -7.374  -9.660
  162   HG12  ILE  19          2HG1      ILE  19   2.495  -8.085  -9.451
  163   HG13  ILE  19          1HG1      ILE  19   3.012  -9.456  -8.491
  164   HG21  ILE  19          1HG2      ILE  19   3.786  -8.715 -11.425
  165   HG22  ILE  19          2HG2      ILE  19   4.358 -10.193 -10.642
  166   HG23  ILE  19          3HG2      ILE  19   5.519  -9.057 -11.330
  167   HD11  ILE  19          3HD1      ILE  19   2.089  -7.682  -7.144
  168   HD12  ILE  19          1HD1      ILE  19   3.319  -6.566  -7.737
  169   HD13  ILE  19          2HD1      ILE  19   3.785  -7.959  -6.750
  170    H    GLY  20           H        GLY  20   7.383  -7.271  -9.542
  171    HA2  GLY  20           2HA      GLY  20   9.804  -7.796  -9.927
  172    HA3  GLY  20           1HA      GLY  20   9.257  -9.263 -10.731
  173    HA   PRO  21           HA       PRO  21   9.848  -5.915 -13.977
  174    HB2  PRO  21           2HB      PRO  21  11.445  -7.322 -15.686
  175    HB3  PRO  21           1HB      PRO  21  12.098  -6.544 -14.229
  176    HG2  PRO  21           2HG      PRO  21  11.327  -9.419 -14.629
  177    HG3  PRO  21           1HG      PRO  21  12.804  -8.740 -13.902
  178    HD2  PRO  21           2HD      PRO  21  10.714  -9.623 -12.383
  179    HD3  PRO  21           1HD      PRO  21  11.760  -8.276 -11.875
  180    H    SER  22           H        SER  22   8.637  -9.167 -14.024
  181    HA   SER  22           HA       SER  22   7.262  -8.868 -16.604
  182    HB2  SER  22           2HB      SER  22   8.371 -11.040 -15.977
  183    HB3  SER  22           1HB      SER  22   7.255 -11.195 -14.620
  184    HG   SER  22           HG       SER  22   5.548 -11.197 -16.175
  185    H    ALA  23           H        ALA  23   6.680  -7.072 -14.381
  186    HA   ALA  23           HA       ALA  23   4.153  -7.601 -13.194
  187    HB1  ALA  23           3HB      ALA  23   5.502  -4.945 -13.816
  188    HB2  ALA  23           1HB      ALA  23   5.730  -5.903 -12.353
  189    HB3  ALA  23           2HB      ALA  23   4.156  -5.192 -12.696
  190    H    LYS  24           H        LYS  24   2.133  -7.299 -13.975
  191    HA   LYS  24           HA       LYS  24   1.717  -6.258 -16.684
  192    HB2  LYS  24           2HB      LYS  24  -0.249  -7.520 -14.755
  193    HB3  LYS  24           1HB      LYS  24  -0.590  -7.078 -16.423
  194    HG2  LYS  24           2HG      LYS  24   1.095  -8.761 -17.178
  195    HG3  LYS  24           1HG      LYS  24   1.336  -9.234 -15.491
  196    HD2  LYS  24           2HD      LYS  24  -1.063  -9.874 -15.331
  197    HD3  LYS  24           1HD      LYS  24  -1.300  -9.401 -17.014
  198    HE2  LYS  24           2HE      LYS  24   0.339 -11.167 -17.696
  199    HE3  LYS  24           1HE      LYS  24   0.448 -11.679 -16.012
  200    HZ1  LYS  24           3HZ      LYS  24  -1.090 -13.061 -17.243
  201    HZ2  LYS  24           1HZ      LYS  24  -2.002 -11.712 -17.689
  202    HZ3  LYS  24           2HZ      LYS  24  -1.924 -12.179 -16.068
  203    H    GLU  25           H        GLU  25   1.740  -4.066 -16.665
  204    HA   GLU  25           HA       GLU  25   0.848  -2.376 -14.561
  205    HB2  GLU  25           2HB      GLU  25   1.266  -1.734 -17.514
  206    HB3  GLU  25           1HB      GLU  25   1.053  -0.533 -16.242
  207    HG2  GLU  25           2HG      GLU  25   3.121  -1.233 -15.172
  208    HG3  GLU  25           1HG      GLU  25   3.342  -2.516 -16.366
  209    H    ASP  26           H        ASP  26  -0.810  -3.974 -17.111
  210    HA   ASP  26           HA       ASP  26  -3.197  -2.496 -17.378
  211    HB2  ASP  26           2HB      ASP  26  -3.005  -5.544 -17.489
  212    HB3  ASP  26           1HB      ASP  26  -4.138  -4.510 -18.352
  213    H    GLU  27           H        GLU  27  -2.209  -5.045 -15.140
  214    HA   GLU  27           HA       GLU  27  -4.686  -5.341 -13.757
  215    HB2  GLU  27           2HB      GLU  27  -1.884  -6.096 -12.847
  216    HB3  GLU  27           1HB      GLU  27  -3.383  -6.692 -12.156
  217    HG2  GLU  27           2HG      GLU  27  -2.229  -7.292 -14.878
  218    HG3  GLU  27           1HG      GLU  27  -2.465  -8.409 -13.543
  219    H    LEU  28           H        LEU  28  -2.016  -3.127 -13.401
  220    HA   LEU  28           HA       LEU  28  -2.388  -2.442 -10.666
  221    HB2  LEU  28           2HB      LEU  28  -0.317  -2.118 -12.164
  222    HB3  LEU  28           1HB      LEU  28  -1.107  -0.691 -12.796
  223    HG   LEU  28           HG       LEU  28  -0.483  -1.037  -9.835
  224   HD11  LEU  28          1HD1      LEU  28   1.531   0.275 -10.134
  225   HD12  LEU  28          2HD1      LEU  28   1.258   0.354 -11.882
  226   HD13  LEU  28          3HD1      LEU  28   1.610  -1.195 -11.105
  227   HD21  LEU  28          3HD2      LEU  28  -0.627   1.443  -9.762
  228   HD22  LEU  28          1HD2      LEU  28  -2.142   0.704 -10.289
  229   HD23  LEU  28          2HD2      LEU  28  -1.068   1.454 -11.474
  230    H    ASP  29           H        ASP  29  -3.712  -0.979  -9.744
  231    HA   ASP  29           HA       ASP  29  -4.816   1.347 -10.917
  232    HB2  ASP  29           2HB      ASP  29  -6.349  -0.473 -11.942
  233    HB3  ASP  29           1HB      ASP  29  -6.925  -0.775 -10.308
  234    H    ASP  30           H        ASP  30  -6.470   2.367  -9.305
  235    HA   ASP  30           HA       ASP  30  -5.466   2.170  -6.642
  236    HB2  ASP  30           2HB      ASP  30  -7.890   3.710  -7.657
  237    HB3  ASP  30           1HB      ASP  30  -7.180   3.874  -6.054
  238    H    GLN  31           H        GLN  31  -8.472   1.241  -8.223
  239    HA   GLN  31           HA       GLN  31  -9.564   0.050  -5.764
  240    HB2  GLN  31           2HB      GLN  31 -10.819   0.488  -8.510
  241    HB3  GLN  31           1HB      GLN  31 -11.669  -0.161  -7.109
  242    HG2  GLN  31           2HG      GLN  31 -11.271   1.967  -5.896
  243    HG3  GLN  31           1HG      GLN  31 -10.453   2.613  -7.315
  244   HE21  GLN  31          1HE2      GLN  31 -11.697   3.130  -9.166
  245   HE22  GLN  31          2HE2      GLN  31 -13.410   3.331  -9.078
  246    H    THR  32           H        THR  32  -7.408  -1.071  -7.898
  247    HA   THR  32           HA       THR  32  -8.390  -3.743  -8.283
  248    HB   THR  32           HB       THR  32  -5.569  -2.630  -8.425
  249    HG1  THR  32           HG1      THR  32  -5.910  -2.960 -10.630
  250   HG21  THR  32          3HG2      THR  32  -4.915  -4.865  -9.377
  251   HG22  THR  32          1HG2      THR  32  -6.495  -5.504  -8.916
  252   HG23  THR  32          2HG2      THR  32  -5.358  -4.972  -7.672
  253    HA   PRO  33           HA       PRO  33  -7.633  -4.810  -3.921
  254    HB2  PRO  33           2HB      PRO  33  -8.875  -7.227  -3.928
  255    HB3  PRO  33           1HB      PRO  33  -9.789  -5.703  -3.995
  256    HG2  PRO  33           2HG      PRO  33  -9.064  -7.550  -6.243
  257    HG3  PRO  33           1HG      PRO  33 -10.618  -6.761  -5.900
  258    HD2  PRO  33           2HD      PRO  33  -8.826  -5.797  -7.730
  259    HD3  PRO  33           1HD      PRO  33  -9.960  -4.758  -6.839
  260    H    LEU  34           H        LEU  34  -5.522  -5.214  -3.560
  261    HA   LEU  34           HA       LEU  34  -3.870  -6.936  -5.134
  262    HB2  LEU  34           2HB      LEU  34  -3.287  -5.601  -2.462
  263    HB3  LEU  34           1HB      LEU  34  -2.100  -6.455  -3.425
  264    HG   LEU  34           HG       LEU  34  -1.749  -4.102  -3.698
  265   HD11  LEU  34          1HD1      LEU  34  -1.371  -5.418  -5.732
  266   HD12  LEU  34          2HD1      LEU  34  -1.874  -3.775  -6.105
  267   HD13  LEU  34          3HD1      LEU  34  -3.029  -5.100  -6.256
  268   HD21  LEU  34          3HD2      LEU  34  -3.874  -3.209  -3.046
  269   HD22  LEU  34          1HD2      LEU  34  -4.626  -3.814  -4.522
  270   HD23  LEU  34          2HD2      LEU  34  -3.404  -2.544  -4.608
  271    H    LEU  35           H        LEU  35  -5.178  -7.173  -1.814
  272    HA   LEU  35           HA       LEU  35  -4.133  -9.654  -1.022
  273    HB2  LEU  35           2HB      LEU  35  -6.748  -8.280  -0.349
  274    HB3  LEU  35           1HB      LEU  35  -6.287  -9.795   0.402
  275    HG   LEU  35           HG       LEU  35  -4.642  -7.243   0.667
  276   HD11  LEU  35          1HD1      LEU  35  -5.641  -7.020   2.889
  277   HD12  LEU  35          2HD1      LEU  35  -6.673  -8.420   2.591
  278   HD13  LEU  35          3HD1      LEU  35  -6.887  -6.945   1.644
  279   HD21  LEU  35          3HD2      LEU  35  -3.560  -8.412   2.530
  280   HD22  LEU  35          1HD2      LEU  35  -3.382  -9.363   1.056
  281   HD23  LEU  35          2HD2      LEU  35  -4.574  -9.833   2.270
  282    H    GLU  36           H        GLU  36  -7.171  -8.910  -2.706
  283    HA   GLU  36           HA       GLU  36  -8.254 -11.509  -2.814
  284    HB2  GLU  36           2HB      GLU  36  -9.542  -9.395  -3.145
  285    HB3  GLU  36           1HB      GLU  36  -8.726  -9.160  -4.684
  286    HG2  GLU  36           2HG      GLU  36 -10.943  -9.987  -5.088
  287    HG3  GLU  36           1HG      GLU  36  -9.791 -11.240  -5.536
  288    H    TRP  37           H        TRP  37  -5.975  -9.795  -4.898
  289    HA   TRP  37           HA       TRP  37  -6.106 -11.885  -6.996
  290    HB2  TRP  37           2HB      TRP  37  -4.645  -9.208  -6.876
  291    HB3  TRP  37           1HB      TRP  37  -4.502 -10.336  -8.222
  292    HD1  TRP  37           HD1      TRP  37  -8.015  -9.956  -6.790
  293    HE1  TRP  37           HE1      TRP  37  -9.464  -8.616  -8.405
  294    HE3  TRP  37           HE3      TRP  37  -4.395  -8.380 -10.053
  295    HZ2  TRP  37           HZ2      TRP  37  -9.168  -7.093 -10.741
  296    HZ3  TRP  37           HZ3      TRP  37  -5.090  -6.980 -11.957
  297    HH2  TRP  37           HH2      TRP  37  -7.416  -6.345 -12.300
  298    H    GLY  38           H        GLY  38  -4.667 -11.710  -4.101
  299    HA2  GLY  38           2HA      GLY  38  -3.134 -13.108  -3.127
  300    HA3  GLY  38           1HA      GLY  38  -2.845 -13.854  -4.691
  301    H    ILE  39           H        ILE  39  -2.484 -10.477  -4.554
  302    HA   ILE  39           HA       ILE  39   0.313 -10.554  -5.169
  303    HB   ILE  39           HB       ILE  39  -1.687  -8.286  -4.751
  304   HG12  ILE  39          2HG1      ILE  39  -0.422  -9.409  -7.297
  305   HG13  ILE  39          1HG1      ILE  39  -2.072  -9.705  -6.774
  306   HG21  ILE  39          1HG2      ILE  39   1.186  -8.028  -5.679
  307   HG22  ILE  39          2HG2      ILE  39   0.526  -7.437  -4.155
  308   HG23  ILE  39          3HG2      ILE  39  -0.011  -6.733  -5.679
  309   HD11  ILE  39          3HD1      ILE  39  -2.026  -8.097  -8.556
  310   HD12  ILE  39          1HD1      ILE  39  -0.904  -7.072  -7.661
  311   HD13  ILE  39          2HD1      ILE  39  -2.554  -7.300  -7.074
  312    H    LEU  40           H        LEU  40  -1.710  -9.543  -2.438
  313    HA   LEU  40           HA       LEU  40   0.649  -9.533  -0.631
  314    HB2  LEU  40           2HB      LEU  40  -2.149  -8.514   0.004
  315    HB3  LEU  40           1HB      LEU  40  -0.672  -8.217   0.905
  316    HG   LEU  40           HG       LEU  40  -1.348  -7.078  -1.827
  317   HD11  LEU  40          1HD1      LEU  40  -1.269  -5.741   0.893
  318   HD12  LEU  40          2HD1      LEU  40  -2.704  -6.073  -0.092
  319   HD13  LEU  40          3HD1      LEU  40  -1.499  -4.918  -0.655
  320   HD21  LEU  40          3HD2      LEU  40   0.688  -5.704  -1.560
  321   HD22  LEU  40          1HD2      LEU  40   1.044  -7.428  -1.664
  322   HD23  LEU  40          2HD2      LEU  40   1.099  -6.607  -0.098
  323    H    ASN  41           H        ASN  41   0.435 -10.738   1.347
  324    HA   ASN  41           HA       ASN  41  -1.784 -12.426   1.996
  325    HB2  ASN  41           2HB      ASN  41  -0.693 -13.681   0.028
  326    HB3  ASN  41           1HB      ASN  41   0.733 -13.895   1.030
  327   HD21  ASN  41          1HD2      ASN  41  -1.047 -15.885  -0.193
  328   HD22  ASN  41          2HD2      ASN  41  -1.611 -16.884   1.097
  329    H    SER  42           H        SER  42   1.746 -12.150   2.245
  330    HA   SER  42           HA       SER  42   1.769 -10.967   4.785
  331    HB2  SER  42           3HB      SER  42   1.265 -13.213   5.707
  332    HB3  SER  42           2HB      SER  42   2.652 -13.896   4.846
  333    H    MET  43           H        MET  43   4.609 -12.365   5.134
  334    HA   MET  43           HA       MET  43   6.555 -11.182   5.021
  335    HB2  MET  43           2HB      MET  43   7.906 -12.327   3.196
  336    HB3  MET  43           1HB      MET  43   7.050 -13.371   4.307
  337    HG2  MET  43           2HG      MET  43   6.013 -12.636   1.571
  338    HG3  MET  43           1HG      MET  43   6.968 -14.070   1.917
  339    HE1  MET  43           3HE      MET  43   2.829 -14.606   1.491
  340    HE2  MET  43           1HE      MET  43   4.284 -14.531   0.492
  341    HE3  MET  43           2HE      MET  43   3.592 -13.049   1.164
  342    H    ASN  44           H        ASN  44   5.416 -10.964   1.615
  343    HA   ASN  44           HA       ASN  44   7.208  -8.809   1.000
  344    HB2  ASN  44           2HB      ASN  44   6.356  -8.926  -1.205
  345    HB3  ASN  44           1HB      ASN  44   6.391 -10.578  -0.619
  346   HD21  ASN  44          1HD2      ASN  44   4.776  -9.206  -2.741
  347   HD22  ASN  44          2HD2      ASN  44   3.149  -9.589  -2.375
  348    H    ILE  45           H        ILE  45   4.168  -8.915   2.491
  349    HA   ILE  45           HA       ILE  45   3.026  -6.447   1.578
  350    HB   ILE  45           HB       ILE  45   1.801  -8.500   2.565
  351   HG12  ILE  45          2HG1      ILE  45   1.050  -5.788   3.755
  352   HG13  ILE  45          1HG1      ILE  45   0.666  -6.293   2.115
  353   HG21  ILE  45          1HG2      ILE  45   2.603  -7.255   5.226
  354   HG22  ILE  45          2HG2      ILE  45   3.180  -8.797   4.596
  355   HG23  ILE  45          3HG2      ILE  45   1.476  -8.597   5.007
  356   HD11  ILE  45          3HD1      ILE  45  -1.257  -6.507   3.567
  357   HD12  ILE  45          1HD1      ILE  45  -0.360  -7.563   4.655
  358   HD13  ILE  45          2HD1      ILE  45  -0.740  -8.102   3.017
  359    H    VAL  46           H        VAL  46   5.340  -7.354   4.019
  360    HA   VAL  46           HA       VAL  46   5.089  -5.129   5.800
  361    HB   VAL  46           HB       VAL  46   7.454  -7.015   5.405
  362   HG11  VAL  46          1HG1      VAL  46   6.726  -5.295   7.807
  363   HG12  VAL  46          2HG1      VAL  46   8.094  -5.033   6.723
  364   HG13  VAL  46          3HG1      VAL  46   8.044  -6.468   7.746
  365   HG21  VAL  46          3HG2      VAL  46   6.484  -8.343   7.260
  366   HG22  VAL  46          1HG2      VAL  46   5.389  -8.272   5.876
  367   HG23  VAL  46          2HG2      VAL  46   5.084  -7.270   7.296
  368    H    LYS  47           H        LYS  47   6.565  -5.552   2.747
  369    HA   LYS  47           HA       LYS  47   8.567  -3.535   2.795
  370    HB2  LYS  47           2HB      LYS  47   7.116  -4.935   0.527
  371    HB3  LYS  47           1HB      LYS  47   8.298  -3.669   0.226
  372    HG2  LYS  47           2HG      LYS  47   9.339  -5.842  -0.029
  373    HG3  LYS  47           1HG      LYS  47  10.034  -5.005   1.361
  374    HD2  LYS  47           2HD      LYS  47   8.631  -6.359   2.882
  375    HD3  LYS  47           1HD      LYS  47   7.909  -7.169   1.496
  376    HE2  LYS  47           2HE      LYS  47   9.641  -8.556   2.563
  377    HE3  LYS  47           1HE      LYS  47  10.087  -8.137   0.909
  378    HZ1  LYS  47           3HZ      LYS  47  11.949  -7.898   2.383
  379    HZ2  LYS  47           1HZ      LYS  47  11.094  -6.834   3.374
  380    HZ3  LYS  47           2HZ      LYS  47  11.500  -6.382   1.798
  381    H    LEU  48           H        LEU  48   5.118  -3.495   2.400
  382    HA   LEU  48           HA       LEU  48   4.861  -0.865   1.291
  383    HB2  LEU  48           2HB      LEU  48   2.878  -2.712   2.669
  384    HB3  LEU  48           1HB      LEU  48   2.428  -1.090   2.167
  385    HG   LEU  48           HG       LEU  48   1.667  -2.580   0.453
  386   HD11  LEU  48          1HD1      LEU  48   2.618  -0.460  -0.356
  387   HD12  LEU  48          2HD1      LEU  48   2.817  -1.745  -1.534
  388   HD13  LEU  48          3HD1      LEU  48   4.195  -1.230  -0.568
  389   HD21  LEU  48          3HD2      LEU  48   3.084  -4.151  -0.794
  390   HD22  LEU  48          1HD2      LEU  48   3.064  -4.555   0.922
  391   HD23  LEU  48          2HD2      LEU  48   4.468  -3.746   0.225
  392    H    MET  49           H        MET  49   4.740  -2.181   4.589
  393    HA   MET  49           HA       MET  49   4.064   0.154   5.998
  394    HB2  MET  49           2HB      MET  49   5.838  -2.149   6.909
  395    HB3  MET  49           1HB      MET  49   5.161  -0.918   7.970
  396    HG2  MET  49           2HG      MET  49   3.888  -2.938   8.186
  397    HG3  MET  49           1HG      MET  49   2.890  -1.718   7.401
  398    HE1  MET  49           3HE      MET  49   2.806  -5.062   7.650
  399    HE2  MET  49           1HE      MET  49   2.281  -5.588   6.045
  400    HE3  MET  49           2HE      MET  49   1.400  -4.316   6.883
  401    H    VAL  50           H        VAL  50   7.251  -1.209   5.195
  402    HA   VAL  50           HA       VAL  50   8.758   0.837   6.501
  403    HB   VAL  50           HB       VAL  50   9.573  -1.508   6.143
  404   HG11  VAL  50          1HG1      VAL  50   8.896  -1.898   3.832
  405   HG12  VAL  50          2HG1      VAL  50  10.640  -2.121   3.984
  406   HG13  VAL  50          3HG1      VAL  50   9.998  -0.643   3.257
  407   HG21  VAL  50          3HG2      VAL  50  11.932  -0.915   5.725
  408   HG22  VAL  50          1HG2      VAL  50  11.153   0.245   6.804
  409   HG23  VAL  50          2HG2      VAL  50  11.428   0.658   5.111
  410    H    TYR  51           H        TYR  51   7.531   0.497   3.224
  411    HA   TYR  51           HA       TYR  51   9.249   2.288   1.841
  412    HB2  TYR  51           2HB      TYR  51   7.514   0.716   0.782
  413    HB3  TYR  51           1HB      TYR  51   6.280   1.865   1.261
  414    HD1  TYR  51           HD2      TYR  51   6.169   4.138   0.132
  415    HD2  TYR  51           HD1      TYR  51   8.978   1.172  -1.098
  416    HE1  TYR  51           HE2      TYR  51   6.533   5.368  -1.950
  417    HE2  TYR  51           HE1      TYR  51   9.340   2.393  -3.204
  418    HH   TYR  51           HH       TYR  51   8.135   4.050  -4.640
  419    H    ILE  52           H        ILE  52   6.104   2.706   3.280
  420    HA   ILE  52           HA       ILE  52   5.830   5.513   2.815
  421    HB   ILE  52           HB       ILE  52   4.235   3.652   4.631
  422   HG12  ILE  52          2HG1      ILE  52   3.623   4.366   1.722
  423   HG13  ILE  52          1HG1      ILE  52   4.439   2.880   2.194
  424   HG21  ILE  52          1HG2      ILE  52   3.821   6.050   5.053
  425   HG22  ILE  52          2HG2      ILE  52   2.408   5.254   4.364
  426   HG23  ILE  52          3HG2      ILE  52   3.419   6.276   3.351
  427   HD11  ILE  52          3HD1      ILE  52   2.096   2.512   1.749
  428   HD12  ILE  52          1HD1      ILE  52   1.645   3.683   2.990
  429   HD13  ILE  52          2HD1      ILE  52   2.472   2.186   3.439
  430    H    ARG  53           H        ARG  53   6.897   3.485   5.465
  431    HA   ARG  53           HA       ARG  53   7.164   5.404   7.531
  432    HB2  ARG  53           2HB      ARG  53   7.236   2.951   7.922
  433    HB3  ARG  53           1HB      ARG  53   8.732   2.841   7.009
  434    HG2  ARG  53           2HG      ARG  53   9.116   2.700   9.439
  435    HG3  ARG  53           1HG      ARG  53   9.925   4.097   8.728
  436    HD2  ARG  53           2HD      ARG  53   8.078   5.552   9.539
  437    HD3  ARG  53           1HD      ARG  53   7.310   4.140  10.279
  438    HE   ARG  53           HE       ARG  53   9.773   4.091  11.382
  439   HH11  ARG  53          1HH1      ARG  53   7.411   6.703  11.147
  440   HH12  ARG  53          2HH1      ARG  53   7.940   7.460  12.611
  441   HH21  ARG  53          1HH2      ARG  53  10.406   5.071  13.294
  442   HH22  ARG  53          2HH2      ARG  53   9.638   6.531  13.829
  443    H    ASP  54           H        ASP  54   9.212   4.519   4.815
  444    HA   ASP  54           HA       ASP  54  11.534   6.036   5.704
  445    HB2  ASP  54           2HB      ASP  54  11.756   3.937   4.344
  446    HB3  ASP  54           1HB      ASP  54  10.952   4.735   2.998
  447    H    GLU  55           H        GLU  55   8.735   6.537   3.662
  448    HA   GLU  55           HA       GLU  55   9.870   8.946   2.419
  449    HB2  GLU  55           2HB      GLU  55   8.813   7.218   0.991
  450    HB3  GLU  55           1HB      GLU  55   7.281   7.467   1.818
  451    HG2  GLU  55           2HG      GLU  55   7.285   9.827   1.006
  452    HG3  GLU  55           1HG      GLU  55   8.768   9.483   0.124
  453    H    MET  56           H        MET  56   6.515   8.237   3.613
  454    HA   MET  56           HA       MET  56   6.189  11.025   4.426
  455    HB2  MET  56           2HB      MET  56   4.309   8.653   4.277
  456    HB3  MET  56           1HB      MET  56   3.838  10.078   5.192
  457    HG2  MET  56           2HG      MET  56   2.865  10.242   3.015
  458    HG3  MET  56           1HG      MET  56   4.145  11.444   3.122
  459    HE1  MET  56           3HE      MET  56   4.516   7.492   0.765
  460    HE2  MET  56           1HE      MET  56   3.069   7.969   1.655
  461    HE3  MET  56           2HE      MET  56   4.546   7.554   2.528
  462    H    GLY  57           H        GLY  57   7.518   8.351   5.951
  463    HA2  GLY  57           2HA      GLY  57   8.343   8.156   8.091
  464    HA3  GLY  57           1HA      GLY  57   7.640   9.715   8.492
  465    H    VAL  58           H        VAL  58   5.518   7.287   7.204
  466    HA   VAL  58           HA       VAL  58   4.557   6.566   9.927
  467    HB   VAL  58           HB       VAL  58   2.950   8.199   9.151
  468   HG11  VAL  58          1HG1      VAL  58   1.746   8.038   6.992
  469   HG12  VAL  58          2HG1      VAL  58   2.736   6.651   6.552
  470   HG13  VAL  58          3HG1      VAL  58   3.484   8.236   6.751
  471   HG21  VAL  58          3HG2      VAL  58   0.850   6.918   9.044
  472   HG22  VAL  58          1HG2      VAL  58   1.946   6.234  10.247
  473   HG23  VAL  58          2HG2      VAL  58   1.756   5.448   8.680
  474    H    SER  59           H        SER  59   4.778   4.445  10.177
  475    HA   SER  59           HA       SER  59   4.463   2.562   7.933
  476    HB2  SER  59           2HB      SER  59   6.436   2.264   9.395
  477    HB3  SER  59           1HB      SER  59   5.399   2.156  10.813
  478    HG   SER  59           HG       SER  59   4.748   0.194  10.206
  479    H    ILE  60           H        ILE  60   2.784   1.015   7.977
  480    HA   ILE  60           HA       ILE  60   0.526   1.355   9.742
  481    HB   ILE  60           HB       ILE  60   1.149  -1.035   7.943
  482   HG12  ILE  60          2HG1      ILE  60   0.947   1.174   6.677
  483   HG13  ILE  60          1HG1      ILE  60  -0.211  -0.063   6.208
  484   HG21  ILE  60          1HG2      ILE  60  -0.488  -1.597   9.662
  485   HG22  ILE  60          2HG2      ILE  60  -1.298  -1.482   8.104
  486   HG23  ILE  60          3HG2      ILE  60  -1.454  -0.170   9.271
  487   HD11  ILE  60          3HD1      ILE  60  -0.764   2.323   7.967
  488   HD12  ILE  60          1HD1      ILE  60  -1.936   1.056   7.579
  489   HD13  ILE  60          2HD1      ILE  60  -1.284   2.087   6.299
  490    HA   PRO  61           HA       PRO  61   2.668  -1.105  12.985
  491    HB2  PRO  61           2HB      PRO  61   0.725  -0.830  14.925
  492    HB3  PRO  61           1HB      PRO  61   1.895   0.448  14.539
  493    HG2  PRO  61           2HG      PRO  61  -0.943   0.177  13.625
  494    HG3  PRO  61           1HG      PRO  61  -0.080   1.618  14.210
  495    HD2  PRO  61           2HD      PRO  61  -0.484   1.142  11.570
  496    HD3  PRO  61           1HD      PRO  61   0.960   1.988  12.166
  497    H    SER  62           H        SER  62   2.135  -3.088  14.216
  498    HA   SER  62           HA       SER  62   1.055  -5.020  12.443
  499    HB2  SER  62           2HB      SER  62   1.599  -6.618  14.379
  500    HB3  SER  62           1HB      SER  62   2.933  -5.656  13.746
  501    HG   SER  62           HG       SER  62   1.718  -5.585  16.227
  502    H    THR  63           H        THR  63  -0.362  -3.286  15.108
  503    HA   THR  63           HA       THR  63  -2.648  -4.959  15.543
  504    HB   THR  63           HB       THR  63  -1.930  -3.374  17.262
  505    HG1  THR  63           HG1      THR  63  -4.030  -2.165  17.451
  506   HG21  THR  63          3HG2      THR  63  -1.038  -1.590  15.796
  507   HG22  THR  63          1HG2      THR  63  -2.153  -0.950  17.006
  508   HG23  THR  63          2HG2      THR  63  -2.684  -1.150  15.336
  509    H    HIS  64           H        HIS  64  -1.916  -2.281  13.339
  510    HA   HIS  64           HA       HIS  64  -4.627  -2.158  12.246
  511    HB2  HIS  64           2HB      HIS  64  -2.123  -0.512  11.878
  512    HB3  HIS  64           1HB      HIS  64  -3.383  -0.443  10.654
  513    HD1  HIS  64           HD1      HIS  64  -2.616   0.665  14.140
  514    HD2  HIS  64           HD2      HIS  64  -5.771   0.821  11.451
  515    HE1  HIS  64           HE1      HIS  64  -4.203   2.358  15.072
  516    HE2  HIS  64           HE2      HIS  64  -6.170   2.349  13.492
  517    H    ILE  65           H        ILE  65  -2.441  -4.465  11.889
  518    HA   ILE  65           HA       ILE  65  -2.644  -4.741   8.996
  519    HB   ILE  65           HB       ILE  65  -1.650  -6.812  11.003
  520   HG12  ILE  65          2HG1      ILE  65  -0.189  -4.889  11.170
  521   HG13  ILE  65          1HG1      ILE  65   0.652  -6.108  10.223
  522   HG21  ILE  65          1HG2      ILE  65  -1.390  -6.635   7.977
  523   HG22  ILE  65          2HG2      ILE  65  -2.311  -7.830   8.895
  524   HG23  ILE  65          3HG2      ILE  65  -0.553  -7.809   8.991
  525   HD11  ILE  65          3HD1      ILE  65   0.073  -4.912   8.183
  526   HD12  ILE  65          1HD1      ILE  65   0.972  -3.903   9.314
  527   HD13  ILE  65          2HD1      ILE  65  -0.769  -3.689   9.140
  528    H    THR  66           H        THR  66  -4.743  -4.843   8.550
  529    HA   THR  66           HA       THR  66  -5.966  -7.431   8.913
  530    HB   THR  66           HB       THR  66  -7.124  -6.422  10.732
  531    HG1  THR  66           HG1      THR  66  -8.688  -7.387   9.585
  532   HG21  THR  66          3HG2      THR  66  -8.235  -4.229  10.674
  533   HG22  THR  66          1HG2      THR  66  -7.640  -3.967   9.033
  534   HG23  THR  66          2HG2      THR  66  -6.501  -4.066  10.377
  535    H    GLY  67           H        GLY  67  -7.654  -7.784   7.320
  536    HA2  GLY  67           2HA      GLY  67  -6.683  -7.258   4.773
  537    HA3  GLY  67           1HA      GLY  67  -8.245  -7.954   5.135
  538    H    LYS  68           H        LYS  68  -9.273  -5.665   6.528
  539    HA   LYS  68           HA       LYS  68 -10.532  -4.327   4.408
  540    HB2  LYS  68           2HB      LYS  68 -11.519  -2.911   6.167
  541    HB3  LYS  68           1HB      LYS  68 -11.604  -4.628   6.540
  542    HG2  LYS  68           2HG      LYS  68  -9.781  -4.449   8.128
  543    HG3  LYS  68           1HG      LYS  68  -9.492  -2.763   7.691
  544    HD2  LYS  68           2HD      LYS  68 -12.018  -3.851   8.992
  545    HD3  LYS  68           1HD      LYS  68 -10.736  -2.973   9.826
  546    HE2  LYS  68           2HE      LYS  68 -11.203  -0.984   8.403
  547    HE3  LYS  68           1HE      LYS  68 -12.521  -1.864   7.626
  548    HZ1  LYS  68           3HZ      LYS  68 -12.363  -1.175  10.510
  549    HZ2  LYS  68           1HZ      LYS  68 -13.635  -2.004   9.764
  550    HZ3  LYS  68           2HZ      LYS  68 -13.317  -0.398   9.352
  551    H    TYR  69           H        TYR  69  -7.561  -3.559   6.039
  552    HA   TYR  69           HA       TYR  69  -7.506  -0.792   5.060
  553    HB2  TYR  69           2HB      TYR  69  -5.575  -2.333   6.845
  554    HB3  TYR  69           1HB      TYR  69  -5.349  -0.655   6.351
  555    HD1  TYR  69           HD2      TYR  69  -8.432   0.058   6.576
  556    HD2  TYR  69           HD1      TYR  69  -5.661  -1.791   9.261
  557    HE1  TYR  69           HE2      TYR  69  -9.766   0.817   8.476
  558    HE2  TYR  69           HE1      TYR  69  -7.007  -1.021  11.160
  559    HH   TYR  69           HH       TYR  69 -10.166   0.290  10.765
  560    H    PHE  70           H        PHE  70  -6.124  -3.922   4.350
  561    HA   PHE  70           HA       PHE  70  -4.256  -2.743   2.369
  562    HB2  PHE  70           2HB      PHE  70  -4.254  -5.392   3.863
  563    HB3  PHE  70           1HB      PHE  70  -3.264  -5.155   2.425
  564    HD1  PHE  70           HD2      PHE  70  -3.737  -4.105   5.952
  565    HD2  PHE  70           HD1      PHE  70  -1.293  -3.728   2.459
  566    HE1  PHE  70           HE2      PHE  70  -1.973  -3.043   7.287
  567    HE2  PHE  70           HE1      PHE  70   0.465  -2.663   3.802
  568    HZ   PHE  70           HZ       PHE  70   0.129  -2.321   6.220
  569    H    LYS  71           H        LYS  71  -7.310  -3.531   2.186
  570    HA   LYS  71           HA       LYS  71  -7.844  -5.562   0.408
  571    HB2  LYS  71           2HB      LYS  71  -9.000  -2.765   0.506
  572    HB3  LYS  71           1HB      LYS  71  -9.641  -3.984  -0.590
  573    HG2  LYS  71           2HG      LYS  71 -10.558  -5.254   1.142
  574    HG3  LYS  71           1HG      LYS  71  -9.520  -4.516   2.373
  575    HD2  LYS  71           2HD      LYS  71 -11.893  -3.726   2.466
  576    HD3  LYS  71           1HD      LYS  71 -10.724  -2.431   2.244
  577    HE2  LYS  71           2HE      LYS  71 -11.274  -2.467  -0.225
  578    HE3  LYS  71           1HE      LYS  71 -12.559  -3.623   0.128
  579    HZ1  LYS  71           3HZ      LYS  71 -13.577  -1.953   1.580
  580    HZ2  LYS  71           1HZ      LYS  71 -13.403  -1.380  -0.006
  581    HZ3  LYS  71           2HZ      LYS  71 -12.337  -0.863   1.201
  582    H    ASP  72           H        ASP  72  -6.970  -2.248  -0.374
  583    HA   ASP  72           HA       ASP  72  -5.832  -2.820  -2.948
  584    HB2  ASP  72           2HB      ASP  72  -7.472  -1.380  -4.220
  585    HB3  ASP  72           1HB      ASP  72  -8.179  -2.869  -3.628
  586    H    LEU  73           H        LEU  73  -5.768  -0.330  -4.022
  587    HA   LEU  73           HA       LEU  73  -3.832   0.972  -2.395
  588    HB2  LEU  73           2HB      LEU  73  -3.929   0.937  -4.939
  589    HB3  LEU  73           1HB      LEU  73  -5.225   2.104  -4.840
  590    HG   LEU  73           HG       LEU  73  -2.367   2.618  -3.916
  591   HD11  LEU  73          1HD1      LEU  73  -3.776   3.543  -6.449
  592   HD12  LEU  73          2HD1      LEU  73  -2.485   2.341  -6.353
  593   HD13  LEU  73          3HD1      LEU  73  -2.154   4.013  -5.928
  594   HD21  LEU  73          3HD2      LEU  73  -4.654   4.584  -4.250
  595   HD22  LEU  73          1HD2      LEU  73  -2.999   4.966  -3.777
  596   HD23  LEU  73          2HD2      LEU  73  -4.011   4.015  -2.709
  597    H    ASN  74           H        ASN  74  -7.199   1.814  -3.301
  598    HA   ASN  74           HA       ASN  74  -7.285   4.349  -2.053
  599    HB2  ASN  74           2HB      ASN  74  -8.888   3.377  -3.804
  600    HB3  ASN  74           1HB      ASN  74  -9.669   2.495  -2.500
  601   HD21  ASN  74          1HD2      ASN  74 -10.714   4.496  -4.317
  602   HD22  ASN  74          2HD2      ASN  74 -11.362   5.769  -3.347
  603    H    ALA  75           H        ALA  75  -8.035   1.100  -0.858
  604    HA   ALA  75           HA       ALA  75  -8.996   1.665   1.712
  605    HB1  ALA  75           3HB      ALA  75  -7.281  -0.682   0.840
  606    HB2  ALA  75           1HB      ALA  75  -9.039  -0.581   0.703
  607    HB3  ALA  75           2HB      ALA  75  -8.277  -0.614   2.295
  608    H    ILE  76           H        ILE  76  -5.618   1.141   0.674
  609    HA   ILE  76           HA       ILE  76  -4.402   1.620   3.215
  610    HB   ILE  76           HB       ILE  76  -3.232   1.577   0.404
  611   HG12  ILE  76          2HG1      ILE  76  -3.126  -0.439   2.685
  612   HG13  ILE  76          1HG1      ILE  76  -4.102  -0.601   1.230
  613   HG21  ILE  76          1HG2      ILE  76  -1.774   3.001   1.803
  614   HG22  ILE  76          2HG2      ILE  76  -0.969   1.479   1.428
  615   HG23  ILE  76          3HG2      ILE  76  -1.681   1.730   3.023
  616   HD11  ILE  76          3HD1      ILE  76  -2.016  -0.761  -0.086
  617   HD12  ILE  76          1HD1      ILE  76  -2.199  -2.033   1.121
  618   HD13  ILE  76          2HD1      ILE  76  -1.098  -0.686   1.421
  619    H    SER  77           H        SER  77  -5.245   3.762   0.500
  620    HA   SER  77           HA       SER  77  -3.613   5.946   1.392
  621    HB2  SER  77           2HB      SER  77  -4.832   7.296  -0.283
  622    HB3  SER  77           1HB      SER  77  -4.266   5.779  -0.961
  623    HG   SER  77           HG       SER  77  -6.855   5.839   0.067
  624    H    ARG  78           H        ARG  78  -6.853   4.846   2.191
  625    HA   ARG  78           HA       ARG  78  -7.623   7.272   3.593
  626    HB2  ARG  78           2HB      ARG  78  -8.861   4.489   3.755
  627    HB3  ARG  78           1HB      ARG  78  -9.573   5.965   4.399
  628    HG2  ARG  78           2HG      ARG  78  -9.109   5.299   1.490
  629    HG3  ARG  78           1HG      ARG  78 -10.656   5.367   2.318
  630    HD2  ARG  78           2HD      ARG  78 -10.611   7.737   2.444
  631    HD3  ARG  78           1HD      ARG  78  -8.876   7.808   2.106
  632    HE   ARG  78           HE       ARG  78 -10.655   6.742   0.025
  633   HH11  ARG  78          1HH1      ARG  78  -8.638   9.400   1.121
  634   HH12  ARG  78          2HH1      ARG  78  -8.571  10.151  -0.443
  635   HH21  ARG  78          1HH2      ARG  78 -10.505   7.688  -2.019
  636   HH22  ARG  78          2HH2      ARG  78  -9.632   9.176  -2.217
  637    H    THR  79           H        THR  79  -6.266   4.122   4.434
  638    HA   THR  79           HA       THR  79  -6.417   4.457   7.268
  639    HB   THR  79           HB       THR  79  -4.620   2.557   5.702
  640    HG1  THR  79           HG1      THR  79  -6.499   1.782   5.130
  641   HG21  THR  79          3HG2      THR  79  -4.702   1.149   7.747
  642   HG22  THR  79          1HG2      THR  79  -5.662   2.380   8.570
  643   HG23  THR  79          2HG2      THR  79  -3.993   2.722   8.114
  644    H    VAL  80           H        VAL  80  -3.995   5.215   4.840
  645    HA   VAL  80           HA       VAL  80  -1.859   5.502   6.775
  646    HB   VAL  80           HB       VAL  80  -1.552   4.681   4.367
  647   HG11  VAL  80          1HG1      VAL  80  -1.217   6.339   2.579
  648   HG12  VAL  80          2HG1      VAL  80  -1.740   7.631   3.660
  649   HG13  VAL  80          3HG1      VAL  80  -2.879   6.372   3.177
  650   HG21  VAL  80          3HG2      VAL  80   0.662   5.735   4.106
  651   HG22  VAL  80          1HG2      VAL  80   0.353   5.270   5.779
  652   HG23  VAL  80          2HG2      VAL  80   0.222   6.963   5.297
  653    H    GLU  81           H        GLU  81  -4.157   7.629   5.121
  654    HA   GLU  81           HA       GLU  81  -2.739  10.078   5.651
  655    HB2  GLU  81           2HB      GLU  81  -4.737  11.247   4.870
  656    HB3  GLU  81           1HB      GLU  81  -4.329   9.927   3.775
  657    HG2  GLU  81           2HG      GLU  81  -6.120   8.545   4.755
  658    HG3  GLU  81           1HG      GLU  81  -6.538   9.862   5.852
  659    H    GLN  82           H        GLN  82  -5.364   8.316   7.241
  660    HA   GLN  82           HA       GLN  82  -5.875  10.266   9.236
  661    HB2  GLN  82           2HB      GLN  82  -7.144   8.577  10.412
  662    HB3  GLN  82           1HB      GLN  82  -7.499   8.464   8.692
  663    HG2  GLN  82           2HG      GLN  82  -6.161   6.484   8.455
  664    HG3  GLN  82           1HG      GLN  82  -5.501   6.662  10.081
  665   HE21  GLN  82          1HE2      GLN  82  -6.828   6.182  11.864
  666   HE22  GLN  82          2HE2      GLN  82  -8.210   5.166  11.693
  667    H    LEU  83           H        LEU  83  -3.635   7.513   9.030
  668    HA   LEU  83           HA       LEU  83  -2.802   7.559  11.751
  669    HB2  LEU  83           2HB      LEU  83  -1.445   6.431   9.294
  670    HB3  LEU  83           1HB      LEU  83  -0.815   6.231  10.922
  671    HG   LEU  83           HG       LEU  83  -3.430   5.096   9.857
  672   HD11  LEU  83          1HD1      LEU  83  -0.835   3.765  10.690
  673   HD12  LEU  83          2HD1      LEU  83  -1.429   3.956   9.039
  674   HD13  LEU  83          3HD1      LEU  83  -2.306   2.929  10.176
  675   HD21  LEU  83          3HD2      LEU  83  -2.259   4.886  12.655
  676   HD22  LEU  83          1HD2      LEU  83  -3.627   3.943  12.055
  677   HD23  LEU  83          2HD2      LEU  83  -3.761   5.693  12.205
  678    H    LYS  84           H        LYS  84  -1.595   9.193   8.835
  679    HA   LYS  84           HA       LYS  84   0.654  10.466  10.019
  680    HB2  LYS  84           2HB      LYS  84  -1.126  11.519   7.767
  681    HB3  LYS  84           1HB      LYS  84   0.426  12.214   8.223
  682    HG2  LYS  84           2HG      LYS  84   1.491  10.008   7.673
  683    HG3  LYS  84           1HG      LYS  84  -0.067   9.469   7.060
  684    HD2  LYS  84           2HD      LYS  84   1.572  11.788   5.952
  685    HD3  LYS  84           1HD      LYS  84   1.435  10.184   5.242
  686    HE2  LYS  84           2HE      LYS  84  -0.022  11.530   3.961
  687    HE3  LYS  84           1HE      LYS  84  -1.089  10.651   5.053
  688    HZ1  LYS  84           3HZ      LYS  84  -1.630  13.016   4.824
  689    HZ2  LYS  84           1HZ      LYS  84  -0.146  13.435   5.501
  690    HZ3  LYS  84           2HZ      LYS  84  -1.295  12.594   6.416
  691    H    ALA  85           H        ALA  85  -2.772  11.265  10.023
  692    HA   ALA  85           HA       ALA  85  -2.554  13.747  11.458
  693    HB1  ALA  85           3HB      ALA  85  -4.983  13.633  11.579
  694    HB2  ALA  85           1HB      ALA  85  -4.964  11.928  11.114
  695    HB3  ALA  85           2HB      ALA  85  -4.461  13.168   9.954
  696    H    GLU  86           H        GLU  86  -2.902  10.360  12.376
  697    HA   GLU  86           HA       GLU  86  -3.659  10.815  15.126
  698    HB2  GLU  86           2HB      GLU  86  -2.743   8.291  13.678
  699    HB3  GLU  86           1HB      GLU  86  -3.273   8.317  15.354
  700    HG2  GLU  86           2HG      GLU  86  -4.970   8.991  12.940
  701    HG3  GLU  86           1HG      GLU  86  -5.035   7.505  13.862
  702    H    SER  87           H        SER  87  -0.684  10.321  13.358
  703    HA   SER  87           HA       SER  87   0.958  10.035  15.769
  704    HB2  SER  87           2HB      SER  87   2.853   9.947  14.090
  705    HB3  SER  87           1HB      SER  87   1.628   8.706  13.846
  706    HG   SER  87           HG       SER  87   1.325   9.468  11.943
  707    H    ALA  88           H        ALA  88   0.124  12.498  13.345
  708    HA   ALA  88           HA       ALA  88   1.832  14.551  14.389
  709    HB1  ALA  88           3HB      ALA  88   0.464  16.095  13.046
  710    HB2  ALA  88           1HB      ALA  88  -0.722  14.815  12.762
  711    HB3  ALA  88           2HB      ALA  88   0.912  14.666  12.115
  712    H    LEU  89           H        LEU  89   1.173  16.396  15.584
  713    HA   LEU  89           HA       LEU  89  -0.550  15.940  17.814
  714    HB2  LEU  89           2HB      LEU  89   0.125  18.075  18.611
  715    HB3  LEU  89           1HB      LEU  89   1.531  17.352  17.866
  716    HG   LEU  89           HG       LEU  89  -0.146  19.630  16.716
  717   HD11  LEU  89          1HD1      LEU  89   1.273  20.296  18.594
  718   HD12  LEU  89          2HD1      LEU  89   1.901  20.963  17.090
  719   HD13  LEU  89          3HD1      LEU  89   2.680  19.558  17.822
  720   HD21  LEU  89          3HD2      LEU  89   1.562  19.803  14.930
  721   HD22  LEU  89          1HD2      LEU  89   0.707  18.262  14.860
  722   HD23  LEU  89          2HD2      LEU  89   2.337  18.334  15.529
  723    H    GLU  90           H        GLU  90  -1.028  17.192  14.649
  724    HA   GLU  90           HA       GLU  90  -3.453  18.700  15.274
  725    HB2  GLU  90           2HB      GLU  90  -3.394  19.236  12.789
  726    HB3  GLU  90           1HB      GLU  90  -2.024  19.808  13.729
  727    HG2  GLU  90           2HG      GLU  90  -0.740  17.760  12.928
  728    HG3  GLU  90           1HG      GLU  90  -2.077  17.454  11.819
  729   H281  4EM 101          2H28      PYA 142   2.685 -10.443   8.003
  730   H283  4EM 101          3H28      PYA 142   3.662 -11.069   9.331
  731   H303  4EM 101          3H30      PYA 142  -0.281  -9.632  10.117
  732   H301  4EM 101          1H30      PYA 142  -0.040 -11.183   9.294
  733   H302  4EM 101          2H30      PYA 142   0.322  -9.664   8.465
  734   H312  4EM 101          2H31      PYA 142   1.693  -8.248  10.816
  735   H313  4EM 101          3H31      PYA 142   3.327  -8.794  10.457
  736   H311  4EM 101          1H31      PYA 142   2.267  -8.274   9.140
  737    H32  4EM 101           H32      PYA 142   1.332 -11.925  11.194
  738    H33  4EM 101           H33      PYA 142   3.120 -11.565  12.637
  739    H36  4EM 101           H36      PYA 142  -0.734 -11.004  11.930
  740   H373  4EM 101          3H37      PYA 142  -1.410 -10.387  14.300
  741   H372  4EM 101          2H37      PYA 142  -0.626  -8.846  13.964
  742   H382  4EM 101          2H38      PYA 142  -2.227  -8.430  12.135
  743   H383  4EM 101          3H38      PYA 142  -3.022  -8.601  13.699
  744    H41  4EM 101           H41      PYA 142  -4.374  -8.776  11.306
  745   H423  4EM 101          3H42      PYA 142  -6.335 -10.404  11.348
  746   H422  4EM 101          2H42      PYA 142  -5.128 -11.605  10.896
  747   H433  4EM 101          3H43      PYA 142  -5.873  -9.154   9.271
  748   H432  4EM 101          2H43      PYA 142  -6.395 -10.810   8.945
  749    H44  4EM 101           H44      PYA 142  -4.054 -11.326   8.847
  750    H49  4EM 101           H49      PYA 142  -2.233  -8.279   6.057
  751    H51  4EM 101           H51      PYA 142  -0.208  -9.806   5.382
  752    H50  4EM 101           H50      PYA 142  -0.465 -12.084   6.628
  753    H48  4EM 101           H48      PYA 142  -2.653 -11.947   7.963
  Start of MODEL   16
    1    H1   MET   1           1H       MET   1   4.151  17.711   0.265
    2    H2   MET   1           2H       MET   1   2.776  17.822   1.236
    3    H3   MET   1           3H       MET   1   4.043  18.919   1.438
    4    HA   MET   1           HA       MET   1   2.198  19.917   0.279
    5    HB2  MET   1           2HB      MET   1   4.608  19.444  -1.529
    6    HB3  MET   1           1HB      MET   1   3.437  20.751  -1.696
    7    HG2  MET   1           2HG      MET   1   5.465  21.583  -0.680
    8    HG3  MET   1           1HG      MET   1   4.147  21.654   0.491
    9    HE1  MET   1           3HE      MET   1   6.072  22.016   2.427
   10    HE2  MET   1           1HE      MET   1   7.349  21.852   1.222
   11    HE3  MET   1           2HE      MET   1   7.386  20.866   2.682
   12    H    ASP   2           H        ASP   2   3.758  17.869  -2.210
   13    HA   ASP   2           HA       ASP   2   1.324  17.156  -3.508
   14    HB2  ASP   2           2HB      ASP   2   2.799  15.550  -4.791
   15    HB3  ASP   2           1HB      ASP   2   3.336  17.224  -4.818
   16    H    GLY   3           H        GLY   3   0.160  15.228  -3.435
   17    HA2  GLY   3           2HA      GLY   3   0.632  13.434  -1.124
   18    HA3  GLY   3           1HA      GLY   3  -0.924  14.187  -1.436
   19    H    GLU   4           H        GLU   4  -1.416  13.859  -4.031
   20    HA   GLU   4           HA       GLU   4  -2.075  11.056  -4.136
   21    HB2  GLU   4           2HB      GLU   4  -2.612  13.252  -6.178
   22    HB3  GLU   4           1HB      GLU   4  -3.285  11.624  -6.239
   23    HG2  GLU   4           2HG      GLU   4  -4.232  12.139  -3.870
   24    HG3  GLU   4           1HG      GLU   4  -3.885  13.825  -4.250
   25    H    GLU   5           H        GLU   5   0.579  12.805  -5.234
   26    HA   GLU   5           HA       GLU   5   1.437  11.248  -7.461
   27    HB2  GLU   5           2HB      GLU   5   2.914  13.079  -5.536
   28    HB3  GLU   5           1HB      GLU   5   3.713  12.272  -6.882
   29    HG2  GLU   5           2HG      GLU   5   3.166  14.577  -7.434
   30    HG3  GLU   5           1HG      GLU   5   2.330  13.440  -8.481
   31    H    VAL   6           H        VAL   6   1.805  10.922  -3.946
   32    HA   VAL   6           HA       VAL   6   3.804   8.884  -4.072
   33    HB   VAL   6           HB       VAL   6   3.220  10.270  -1.972
   34   HG11  VAL   6          1HG1      VAL   6   1.659   9.330  -0.341
   35   HG12  VAL   6          2HG1      VAL   6   1.186   8.070  -1.477
   36   HG13  VAL   6          3HG1      VAL   6   0.791   9.750  -1.816
   37   HG21  VAL   6          3HG2      VAL   6   4.020   8.512  -0.457
   38   HG22  VAL   6          1HG2      VAL   6   4.908   8.514  -1.982
   39   HG23  VAL   6          2HG2      VAL   6   3.664   7.296  -1.686
   40    H    LYS   7           H        LYS   7   0.296   8.897  -4.120
   41    HA   LYS   7           HA       LYS   7  -0.237   6.165  -3.681
   42    HB2  LYS   7           2HB      LYS   7  -1.750   8.165  -5.413
   43    HB3  LYS   7           1HB      LYS   7  -2.365   6.572  -4.972
   44    HG2  LYS   7           2HG      LYS   7  -2.138   7.294  -2.527
   45    HG3  LYS   7           1HG      LYS   7  -1.861   8.930  -3.129
   46    HD2  LYS   7           2HD      LYS   7  -4.345   7.228  -3.549
   47    HD3  LYS   7           1HD      LYS   7  -4.207   8.642  -2.510
   48    HE2  LYS   7           2HE      LYS   7  -3.788  10.035  -4.536
   49    HE3  LYS   7           1HE      LYS   7  -4.044   8.611  -5.540
   50    HZ1  LYS   7           3HZ      LYS   7  -6.295   8.474  -4.788
   51    HZ2  LYS   7           1HZ      LYS   7  -6.013  10.041  -5.347
   52    HZ3  LYS   7           2HZ      LYS   7  -6.074   9.740  -3.688
   53    H    GLU   8           H        GLU   8   0.516   7.903  -6.660
   54    HA   GLU   8           HA       GLU   8   0.246   5.791  -8.449
   55    HB2  GLU   8           2HB      GLU   8   0.323   8.256  -8.987
   56    HB3  GLU   8           1HB      GLU   8   2.061   8.222  -8.680
   57    HG2  GLU   8           2HG      GLU   8   2.254   6.467 -10.433
   58    HG3  GLU   8           1HG      GLU   8   0.549   6.708 -10.787
   59    H    LYS   9           H        LYS   9   2.996   6.916  -6.511
   60    HA   LYS   9           HA       LYS   9   4.905   5.061  -7.564
   61    HB2  LYS   9           2HB      LYS   9   4.954   6.613  -4.952
   62    HB3  LYS   9           1HB      LYS   9   6.308   5.701  -5.609
   63    HG2  LYS   9           2HG      LYS   9   6.342   7.214  -7.582
   64    HG3  LYS   9           1HG      LYS   9   5.046   8.166  -6.850
   65    HD2  LYS   9           2HD      LYS   9   7.833   7.724  -5.719
   66    HD3  LYS   9           1HD      LYS   9   7.218   9.215  -6.427
   67    HE2  LYS   9           2HE      LYS   9   5.615   9.459  -4.590
   68    HE3  LYS   9           1HE      LYS   9   6.130   7.918  -3.903
   69    HZ1  LYS   9           3HZ      LYS   9   7.137   9.750  -2.744
   70    HZ2  LYS   9           1HZ      LYS   9   7.820  10.349  -4.173
   71    HZ3  LYS   9           2HZ      LYS   9   8.328   8.862  -3.543
   72    H    ILE  10           H        ILE  10   2.483   4.870  -5.003
   73    HA   ILE  10           HA       ILE  10   3.427   2.465  -3.764
   74    HB   ILE  10           HB       ILE  10   0.501   3.310  -4.002
   75   HG12  ILE  10          2HG1      ILE  10   1.688   5.180  -3.000
   76   HG13  ILE  10          1HG1      ILE  10   0.727   4.384  -1.770
   77   HG21  ILE  10          1HG2      ILE  10   0.162   1.988  -1.934
   78   HG22  ILE  10          2HG2      ILE  10   1.858   1.499  -1.977
   79   HG23  ILE  10          3HG2      ILE  10   0.761   0.997  -3.264
   80   HD11  ILE  10          3HD1      ILE  10   2.758   3.336  -0.871
   81   HD12  ILE  10          1HD1      ILE  10   2.882   5.097  -0.913
   82   HD13  ILE  10          2HD1      ILE  10   3.711   4.130  -2.129
   83    H    ARG  11           H        ARG  11   1.010   3.157  -6.255
   84    HA   ARG  11           HA       ARG  11   0.188   0.686  -7.163
   85    HB2  ARG  11           2HB      ARG  11   0.773   3.208  -8.766
   86    HB3  ARG  11           1HB      ARG  11  -0.076   1.822  -9.438
   87    HG2  ARG  11           2HG      ARG  11  -1.914   2.138  -7.877
   88    HG3  ARG  11           1HG      ARG  11  -1.039   3.448  -7.076
   89    HD2  ARG  11           2HD      ARG  11  -2.762   4.324  -8.615
   90    HD3  ARG  11           1HD      ARG  11  -1.140   4.800  -9.119
   91    HE   ARG  11           HE       ARG  11  -1.280   2.898 -10.752
   92   HH11  ARG  11          1HH1      ARG  11  -4.216   4.556  -9.734
   93   HH12  ARG  11          2HH1      ARG  11  -5.077   4.143 -11.182
   94   HH21  ARG  11          1HH2      ARG  11  -2.466   2.296 -12.590
   95   HH22  ARG  11          2HH2      ARG  11  -4.091   2.873 -12.786
   96    H    ARG  12           H        ARG  12   3.063   2.493  -8.176
   97    HA   ARG  12           HA       ARG  12   3.890   0.597 -10.162
   98    HB2  ARG  12           2HB      ARG  12   5.248   3.000  -8.917
   99    HB3  ARG  12           1HB      ARG  12   6.033   2.021 -10.141
  100    HG2  ARG  12           2HG      ARG  12   3.619   3.817 -10.407
  101    HG3  ARG  12           1HG      ARG  12   5.127   3.858 -11.322
  102    HD2  ARG  12           2HD      ARG  12   2.842   1.887 -11.554
  103    HD3  ARG  12           1HD      ARG  12   3.441   2.986 -12.798
  104    HE   ARG  12           HE       ARG  12   4.267   0.340 -12.315
  105   HH11  ARG  12          1HH1      ARG  12   5.719   3.422 -13.252
  106   HH12  ARG  12          2HH1      ARG  12   7.055   2.663 -14.059
  107   HH21  ARG  12          1HH2      ARG  12   6.025  -0.595 -13.329
  108   HH22  ARG  12          2HH2      ARG  12   7.223   0.397 -14.097
  109    H    TYR  13           H        TYR  13   5.022   1.409  -6.933
  110    HA   TYR  13           HA       TYR  13   7.209  -0.341  -6.705
  111    HB2  TYR  13           2HB      TYR  13   6.865   1.376  -5.044
  112    HB3  TYR  13           1HB      TYR  13   5.289   0.745  -4.627
  113    HD1  TYR  13           HD1      TYR  13   8.902  -0.321  -4.634
  114    HD2  TYR  13           HD2      TYR  13   5.122  -0.592  -2.669
  115    HE1  TYR  13           HE1      TYR  13   9.938  -1.618  -2.822
  116    HE2  TYR  13           HE2      TYR  13   6.156  -1.887  -0.859
  117    HH   TYR  13           HH       TYR  13   9.473  -2.119  -0.407
  118    H    ILE  14           H        ILE  14   3.803  -0.878  -6.101
  119    HA   ILE  14           HA       ILE  14   3.750  -3.502  -5.162
  120    HB   ILE  14           HB       ILE  14   1.825  -1.863  -6.842
  121   HG12  ILE  14          2HG1      ILE  14   2.081  -1.164  -4.501
  122   HG13  ILE  14          1HG1      ILE  14   0.461  -1.799  -4.772
  123   HG21  ILE  14          1HG2      ILE  14   1.310  -4.066  -7.573
  124   HG22  ILE  14          2HG2      ILE  14   0.066  -3.609  -6.406
  125   HG23  ILE  14          3HG2      ILE  14   1.373  -4.702  -5.928
  126   HD11  ILE  14          3HD1      ILE  14   1.117  -3.902  -3.695
  127   HD12  ILE  14          1HD1      ILE  14   1.350  -2.517  -2.635
  128   HD13  ILE  14          2HD1      ILE  14   2.738  -3.256  -3.429
  129    H    MET  15           H        MET  15   3.565  -2.352  -8.523
  130    HA   MET  15           HA       MET  15   3.496  -4.982  -9.648
  131    HB2  MET  15           2HB      MET  15   4.107  -2.311 -10.977
  132    HB3  MET  15           1HB      MET  15   3.679  -3.807 -11.805
  133    HG2  MET  15           2HG      MET  15   1.941  -2.110 -10.026
  134    HG3  MET  15           1HG      MET  15   1.725  -2.466 -11.739
  135    HE1  MET  15           3HE      MET  15   0.798  -4.736 -12.669
  136    HE2  MET  15           1HE      MET  15   0.495  -6.166 -11.686
  137    HE3  MET  15           2HE      MET  15   2.149  -5.614 -11.948
  138    H    GLU  16           H        GLU  16   6.119  -2.715  -8.969
  139    HA   GLU  16           HA       GLU  16   8.039  -3.982 -10.701
  140    HB2  GLU  16           2HB      GLU  16   8.289  -1.833  -8.577
  141    HB3  GLU  16           1HB      GLU  16   9.662  -2.390  -9.527
  142    HG2  GLU  16           2HG      GLU  16   7.154  -1.066 -10.615
  143    HG3  GLU  16           1HG      GLU  16   8.728  -0.303 -10.424
  144    H    ASP  17           H        ASP  17   7.429  -3.926  -7.212
  145    HA   ASP  17           HA       ASP  17   9.671  -5.796  -6.726
  146    HB2  ASP  17           2HB      ASP  17   8.094  -3.957  -4.881
  147    HB3  ASP  17           1HB      ASP  17   9.251  -5.146  -4.287
  148    H    LEU  18           H        LEU  18   6.261  -5.310  -5.753
  149    HA   LEU  18           HA       LEU  18   6.112  -7.774  -4.311
  150    HB2  LEU  18           2HB      LEU  18   3.958  -5.836  -5.167
  151    HB3  LEU  18           1HB      LEU  18   3.607  -7.276  -4.243
  152    HG   LEU  18           HG       LEU  18   3.678  -5.421  -2.715
  153   HD11  LEU  18          1HD1      LEU  18   4.608  -7.509  -1.836
  154   HD12  LEU  18          2HD1      LEU  18   5.380  -6.110  -1.100
  155   HD13  LEU  18          3HD1      LEU  18   6.231  -7.024  -2.345
  156   HD21  LEU  18          3HD2      LEU  18   6.477  -4.742  -3.677
  157   HD22  LEU  18          1HD2      LEU  18   5.612  -3.959  -2.351
  158   HD23  LEU  18          2HD2      LEU  18   5.017  -3.810  -4.001
  159    H    ILE  19           H        ILE  19   5.029  -6.840  -7.565
  160    HA   ILE  19           HA       ILE  19   4.294  -9.587  -8.238
  161    HB   ILE  19           HB       ILE  19   4.314  -7.004  -9.853
  162   HG12  ILE  19          2HG1      ILE  19   1.859  -7.515 -10.159
  163   HG13  ILE  19          1HG1      ILE  19   2.054  -8.893  -9.098
  164   HG21  ILE  19          1HG2      ILE  19   3.742  -9.766 -10.972
  165   HG22  ILE  19          2HG2      ILE  19   5.098  -8.721 -11.400
  166   HG23  ILE  19          3HG2      ILE  19   3.454  -8.241 -11.822
  167   HD11  ILE  19          3HD1      ILE  19   1.026  -7.029  -7.971
  168   HD12  ILE  19          1HD1      ILE  19   2.421  -6.009  -8.333
  169   HD13  ILE  19          2HD1      ILE  19   2.594  -7.400  -7.256
  170    H    GLY  20           H        GLY  20   6.605  -7.262  -9.722
  171    HA2  GLY  20           2HA      GLY  20   9.029  -8.323  -9.591
  172    HA3  GLY  20           1HA      GLY  20   8.278  -9.490 -10.676
  173    HA   PRO  21           HA       PRO  21  10.221  -5.800 -13.028
  174    HB2  PRO  21           2HB      PRO  21  11.604  -7.403 -14.856
  175    HB3  PRO  21           1HB      PRO  21  12.296  -6.791 -13.343
  176    HG2  PRO  21           2HG      PRO  21  11.094  -9.478 -13.907
  177    HG3  PRO  21           1HG      PRO  21  12.573  -9.065 -13.006
  178    HD2  PRO  21           2HD      PRO  21  10.313  -9.676 -11.703
  179    HD3  PRO  21           1HD      PRO  21  11.393  -8.398 -11.098
  180    H    SER  22           H        SER  22   8.986  -8.894 -14.359
  181    HA   SER  22           HA       SER  22   7.572  -7.583 -16.551
  182    HB2  SER  22           2HB      SER  22   7.495 -10.506 -15.671
  183    HB3  SER  22           1HB      SER  22   6.968  -9.849 -17.222
  184    HG   SER  22           HG       SER  22   9.187 -10.871 -16.974
  185    H    ALA  23           H        ALA  23   5.957  -6.356 -15.660
  186    HA   ALA  23           HA       ALA  23   3.997  -7.613 -13.823
  187    HB1  ALA  23           3HB      ALA  23   3.843  -5.485 -12.632
  188    HB2  ALA  23           1HB      ALA  23   5.058  -4.777 -13.697
  189    HB3  ALA  23           2HB      ALA  23   5.499  -6.089 -12.605
  190    H    LYS  24           H        LYS  24   1.929  -7.359 -14.351
  191    HA   LYS  24           HA       LYS  24   1.137  -6.171 -16.850
  192    HB2  LYS  24           2HB      LYS  24  -0.498  -7.522 -14.688
  193    HB3  LYS  24           1HB      LYS  24  -1.127  -7.009 -16.253
  194    HG2  LYS  24           2HG      LYS  24   0.402  -8.564 -17.396
  195    HG3  LYS  24           1HG      LYS  24   1.056  -9.067 -15.830
  196    HD2  LYS  24           2HD      LYS  24  -1.118  -9.980 -15.166
  197    HD3  LYS  24           1HD      LYS  24  -1.857  -9.384 -16.656
  198    HE2  LYS  24           2HE      LYS  24   0.359 -11.438 -16.525
  199    HE3  LYS  24           1HE      LYS  24  -1.351 -11.810 -16.736
  200    HZ1  LYS  24           3HZ      LYS  24  -1.335 -10.623 -18.811
  201    HZ2  LYS  24           1HZ      LYS  24  -0.129 -11.804 -18.823
  202    HZ3  LYS  24           2HZ      LYS  24   0.282 -10.182 -18.601
  203    H    GLU  25           H        GLU  25   1.689  -3.923 -16.350
  204    HA   GLU  25           HA       GLU  25   0.384  -2.332 -14.407
  205    HB2  GLU  25           2HB      GLU  25   1.380  -1.479 -17.159
  206    HB3  GLU  25           1HB      GLU  25   0.988  -0.383 -15.839
  207    HG2  GLU  25           2HG      GLU  25   3.174  -2.466 -15.772
  208    HG3  GLU  25           1HG      GLU  25   3.423  -0.765 -16.154
  209    H    ASP  26           H        ASP  26  -0.603  -3.505 -17.499
  210    HA   ASP  26           HA       ASP  26  -2.905  -1.985 -18.056
  211    HB2  ASP  26           2HB      ASP  26  -1.639  -3.579 -19.617
  212    HB3  ASP  26           1HB      ASP  26  -2.430  -4.913 -18.786
  213    H    GLU  27           H        GLU  27  -2.354  -4.746 -15.977
  214    HA   GLU  27           HA       GLU  27  -5.182  -5.141 -15.315
  215    HB2  GLU  27           2HB      GLU  27  -2.623  -6.520 -14.447
  216    HB3  GLU  27           1HB      GLU  27  -4.179  -6.901 -13.732
  217    HG2  GLU  27           2HG      GLU  27  -3.490  -7.199 -16.666
  218    HG3  GLU  27           1HG      GLU  27  -3.518  -8.502 -15.480
  219    H    LEU  28           H        LEU  28  -2.429  -3.453 -14.014
  220    HA   LEU  28           HA       LEU  28  -3.213  -3.260 -11.291
  221    HB2  LEU  28           2HB      LEU  28  -0.900  -2.907 -12.196
  222    HB3  LEU  28           1HB      LEU  28  -1.417  -1.399 -12.910
  223    HG   LEU  28           HG       LEU  28  -0.056  -1.177 -10.797
  224   HD11  LEU  28          1HD1      LEU  28  -1.461   0.695 -11.497
  225   HD12  LEU  28          2HD1      LEU  28  -1.355   0.591  -9.745
  226   HD13  LEU  28          3HD1      LEU  28  -2.812   0.042 -10.567
  227   HD21  LEU  28          3HD2      LEU  28  -1.022  -1.602  -8.616
  228   HD22  LEU  28          1HD2      LEU  28  -0.954  -3.099  -9.541
  229   HD23  LEU  28          2HD2      LEU  28  -2.494  -2.254  -9.345
  230    H    ASP  29           H        ASP  29  -4.805  -2.101 -10.430
  231    HA   ASP  29           HA       ASP  29  -5.653   0.491 -11.545
  232    HB2  ASP  29           2HB      ASP  29  -7.284  -1.359 -12.166
  233    HB3  ASP  29           1HB      ASP  29  -7.494  -1.648 -10.444
  234    H    ASP  30           H        ASP  30  -6.993   1.667  -9.800
  235    HA   ASP  30           HA       ASP  30  -5.481   1.726  -7.360
  236    HB2  ASP  30           2HB      ASP  30  -6.771   3.678  -6.749
  237    HB3  ASP  30           1HB      ASP  30  -6.340   3.817  -8.446
  238    H    GLN  31           H        GLN  31  -8.512   0.400  -8.368
  239    HA   GLN  31           HA       GLN  31  -9.180  -0.486  -5.618
  240    HB2  GLN  31           2HB      GLN  31 -10.896  -0.128  -8.111
  241    HB3  GLN  31           1HB      GLN  31 -11.491  -0.858  -6.620
  242    HG2  GLN  31           2HG      GLN  31 -11.084   1.207  -5.392
  243    HG3  GLN  31           1HG      GLN  31 -10.353   1.950  -6.810
  244   HE21  GLN  31          1HE2      GLN  31 -11.690   2.706  -8.471
  245   HE22  GLN  31          2HE2      GLN  31 -13.391   2.933  -8.255
  246    H    THR  32           H        THR  32  -7.326  -1.672  -7.918
  247    HA   THR  32           HA       THR  32  -8.167  -4.368  -8.207
  248    HB   THR  32           HB       THR  32  -5.398  -3.115  -8.168
  249    HG1  THR  32           HG1      THR  32  -6.531  -4.387 -10.379
  250   HG21  THR  32          3HG2      THR  32  -4.511  -5.268  -9.082
  251   HG22  THR  32          1HG2      THR  32  -6.072  -6.035  -8.780
  252   HG23  THR  32          2HG2      THR  32  -5.091  -5.462  -7.428
  253    HA   PRO  33           HA       PRO  33  -7.865  -5.378  -3.796
  254    HB2  PRO  33           2HB      PRO  33  -8.606  -8.008  -3.941
  255    HB3  PRO  33           1HB      PRO  33  -9.762  -6.671  -4.136
  256    HG2  PRO  33           2HG      PRO  33  -8.448  -8.330  -6.249
  257    HG3  PRO  33           1HG      PRO  33 -10.138  -7.797  -6.122
  258    HD2  PRO  33           2HD      PRO  33  -8.311  -6.545  -7.715
  259    HD3  PRO  33           1HD      PRO  33  -9.685  -5.696  -6.975
  260    H    LEU  34           H        LEU  34  -5.811  -5.373  -3.088
  261    HA   LEU  34           HA       LEU  34  -3.653  -6.647  -4.421
  262    HB2  LEU  34           2HB      LEU  34  -3.630  -5.332  -1.681
  263    HB3  LEU  34           1HB      LEU  34  -2.233  -5.669  -2.687
  264    HG   LEU  34           HG       LEU  34  -4.417  -3.641  -3.316
  265   HD11  LEU  34          1HD1      LEU  34  -2.698  -1.935  -2.933
  266   HD12  LEU  34          2HD1      LEU  34  -1.541  -3.185  -2.468
  267   HD13  LEU  34          3HD1      LEU  34  -2.977  -2.896  -1.482
  268   HD21  LEU  34          3HD2      LEU  34  -1.882  -4.261  -4.877
  269   HD22  LEU  34          1HD2      LEU  34  -2.969  -2.902  -5.189
  270   HD23  LEU  34          2HD2      LEU  34  -3.540  -4.553  -5.410
  271    H    LEU  35           H        LEU  35  -5.389  -7.377  -1.366
  272    HA   LEU  35           HA       LEU  35  -3.803  -9.595  -0.530
  273    HB2  LEU  35           2HB      LEU  35  -6.748  -9.011  -0.016
  274    HB3  LEU  35           1HB      LEU  35  -5.934 -10.406   0.662
  275    HG   LEU  35           HG       LEU  35  -6.146  -8.694   2.349
  276   HD11  LEU  35          1HD1      LEU  35  -3.842  -8.438   3.128
  277   HD12  LEU  35          2HD1      LEU  35  -3.214  -8.852   1.531
  278   HD13  LEU  35          3HD1      LEU  35  -4.092 -10.059   2.482
  279   HD21  LEU  35          3HD2      LEU  35  -6.350  -6.717   0.976
  280   HD22  LEU  35          1HD2      LEU  35  -4.654  -6.827   0.493
  281   HD23  LEU  35          2HD2      LEU  35  -5.080  -6.487   2.173
  282    H    GLU  36           H        GLU  36  -6.544  -9.312  -2.740
  283    HA   GLU  36           HA       GLU  36  -7.149 -12.091  -2.927
  284    HB2  GLU  36           2HB      GLU  36  -8.752 -10.196  -3.437
  285    HB3  GLU  36           1HB      GLU  36  -7.863  -9.930  -4.933
  286    HG2  GLU  36           2HG      GLU  36  -9.827 -11.196  -5.456
  287    HG3  GLU  36           1HG      GLU  36  -8.440 -12.267  -5.634
  288    H    TRP  37           H        TRP  37  -5.103  -9.923  -4.719
  289    HA   TRP  37           HA       TRP  37  -4.387 -11.902  -6.760
  290    HB2  TRP  37           2HB      TRP  37  -3.590  -9.007  -6.273
  291    HB3  TRP  37           1HB      TRP  37  -2.883  -9.983  -7.558
  292    HD1  TRP  37           HD1      TRP  37  -6.684  -9.969  -6.684
  293    HE1  TRP  37           HE1      TRP  37  -7.962  -9.147  -8.740
  294    HE3  TRP  37           HE3      TRP  37  -2.718  -8.691  -9.654
  295    HZ2  TRP  37           HZ2      TRP  37  -7.389  -8.093 -11.275
  296    HZ3  TRP  37           HZ3      TRP  37  -3.180  -7.779 -11.897
  297    HH2  TRP  37           HH2      TRP  37  -5.477  -7.489 -12.686
  298    H    GLY  38           H        GLY  38  -3.461 -11.534  -3.613
  299    HA2  GLY  38           2HA      GLY  38  -1.743 -12.413  -2.373
  300    HA3  GLY  38           1HA      GLY  38  -1.195 -13.251  -3.814
  301    H    ILE  39           H        ILE  39  -1.509  -9.839  -3.847
  302    HA   ILE  39           HA       ILE  39   1.206  -9.246  -4.491
  303    HB   ILE  39           HB       ILE  39  -1.185  -7.507  -3.744
  304   HG12  ILE  39          2HG1      ILE  39   0.127  -8.096  -6.438
  305   HG13  ILE  39          1HG1      ILE  39  -1.386  -8.784  -5.873
  306   HG21  ILE  39          1HG2      ILE  39   0.827  -6.266  -3.149
  307   HG22  ILE  39          2HG2      ILE  39   0.046  -5.542  -4.552
  308   HG23  ILE  39          3HG2      ILE  39   1.494  -6.527  -4.765
  309   HD11  ILE  39          3HD1      ILE  39  -1.783  -7.060  -7.494
  310   HD12  ILE  39          1HD1      ILE  39  -0.870  -5.894  -6.540
  311   HD13  ILE  39          2HD1      ILE  39  -2.393  -6.541  -5.923
  312    H    LEU  40           H        LEU  40  -0.777  -8.881  -1.603
  313    HA   LEU  40           HA       LEU  40   1.597  -8.907   0.089
  314    HB2  LEU  40           2HB      LEU  40   0.276  -7.121   1.548
  315    HB3  LEU  40           1HB      LEU  40   1.376  -6.645   0.313
  316    HG   LEU  40           HG       LEU  40  -0.678  -6.377  -1.222
  317   HD11  LEU  40          1HD1      LEU  40  -2.268  -7.640   0.071
  318   HD12  LEU  40          2HD1      LEU  40  -2.803  -5.968  -0.057
  319   HD13  LEU  40          3HD1      LEU  40  -2.080  -6.544   1.446
  320   HD21  LEU  40          3HD2      LEU  40  -0.393  -4.509   1.164
  321   HD22  LEU  40          1HD2      LEU  40  -1.185  -4.123  -0.367
  322   HD23  LEU  40          2HD2      LEU  40   0.547  -4.436  -0.329
  323    H    ASN  41           H        ASN  41   1.312  -9.765   2.103
  324    HA   ASN  41           HA       ASN  41  -1.136 -10.581   3.279
  325    HB2  ASN  41           2HB      ASN  41  -1.235 -12.255   1.510
  326    HB3  ASN  41           1HB      ASN  41   0.429 -12.747   1.809
  327   HD21  ASN  41          1HD2      ASN  41  -2.828 -12.706   3.193
  328   HD22  ASN  41          2HD2      ASN  41  -2.589 -14.061   4.241
  329    H    SER  42           H        SER  42   2.290 -11.668   2.969
  330    HA   SER  42           HA       SER  42   2.672 -11.106   5.816
  331    HB2  SER  42           3HB      SER  42   1.958 -13.430   5.891
  332    HB3  SER  42           2HB      SER  42   3.081 -13.852   4.604
  333    H    MET  43           H        MET  43   4.827 -13.158   3.921
  334    HA   MET  43           HA       MET  43   7.180 -11.817   4.364
  335    HB2  MET  43           2HB      MET  43   8.011 -13.030   2.290
  336    HB3  MET  43           1HB      MET  43   7.223 -14.050   3.483
  337    HG2  MET  43           2HG      MET  43   5.675 -12.926   1.169
  338    HG3  MET  43           1HG      MET  43   6.624 -14.408   1.002
  339    HE1  MET  43           3HE      MET  43   2.416 -14.636   1.904
  340    HE2  MET  43           1HE      MET  43   3.415 -14.360   0.477
  341    HE3  MET  43           2HE      MET  43   3.195 -13.073   1.669
  342    H    ASN  44           H        ASN  44   4.736 -11.000   2.118
  343    HA   ASN  44           HA       ASN  44   6.426  -9.089   0.626
  344    HB2  ASN  44           2HB      ASN  44   4.439  -9.121  -0.996
  345    HB3  ASN  44           1HB      ASN  44   5.349 -10.616  -0.849
  346   HD21  ASN  44          1HD2      ASN  44   3.072 -11.042  -1.987
  347   HD22  ASN  44          2HD2      ASN  44   1.879 -11.702  -0.920
  348    H    ILE  45           H        ILE  45   3.750  -9.192   2.931
  349    HA   ILE  45           HA       ILE  45   2.701  -6.579   2.304
  350    HB   ILE  45           HB       ILE  45   1.440  -8.527   3.451
  351   HG12  ILE  45          2HG1      ILE  45   0.980  -5.855   4.826
  352   HG13  ILE  45          1HG1      ILE  45   0.614  -6.080   3.118
  353   HG21  ILE  45          1HG2      ILE  45   1.352  -8.548   5.904
  354   HG22  ILE  45          2HG2      ILE  45   2.619  -7.326   5.975
  355   HG23  ILE  45          3HG2      ILE  45   2.981  -8.929   5.342
  356   HD11  ILE  45          3HD1      ILE  45  -0.984  -7.789   3.629
  357   HD12  ILE  45          1HD1      ILE  45  -1.345  -6.354   4.594
  358   HD13  ILE  45          2HD1      ILE  45  -0.552  -7.750   5.343
  359    H    VAL  46           H        VAL  46   5.207  -7.765   4.365
  360    HA   VAL  46           HA       VAL  46   5.368  -5.528   6.152
  361    HB   VAL  46           HB       VAL  46   7.516  -7.628   5.626
  362   HG11  VAL  46          1HG1      VAL  46   6.967  -5.911   8.081
  363   HG12  VAL  46          2HG1      VAL  46   8.311  -5.706   6.955
  364   HG13  VAL  46          3HG1      VAL  46   8.214  -7.156   7.954
  365   HG21  VAL  46          3HG2      VAL  46   5.239  -7.761   7.644
  366   HG22  VAL  46          1HG2      VAL  46   6.513  -8.963   7.421
  367   HG23  VAL  46          2HG2      VAL  46   5.316  -8.690   6.151
  368    H    LYS  47           H        LYS  47   6.550  -6.205   2.990
  369    HA   LYS  47           HA       LYS  47   8.591  -4.253   2.749
  370    HB2  LYS  47           2HB      LYS  47   6.871  -5.734   0.753
  371    HB3  LYS  47           1HB      LYS  47   7.839  -4.377   0.200
  372    HG2  LYS  47           2HG      LYS  47   9.045  -6.444  -0.190
  373    HG3  LYS  47           1HG      LYS  47   9.876  -5.476   1.030
  374    HD2  LYS  47           2HD      LYS  47   8.873  -6.897   2.817
  375    HD3  LYS  47           1HD      LYS  47   8.095  -7.880   1.572
  376    HE2  LYS  47           2HE      LYS  47  11.084  -7.546   1.993
  377    HE3  LYS  47           1HE      LYS  47  10.128  -8.978   2.378
  378    HZ1  LYS  47           3HZ      LYS  47   9.610  -9.180   0.003
  379    HZ2  LYS  47           1HZ      LYS  47  11.272  -9.283   0.312
  380    HZ3  LYS  47           2HZ      LYS  47  10.617  -7.863  -0.325
  381    H    LEU  48           H        LEU  48   5.077  -4.084   2.517
  382    HA   LEU  48           HA       LEU  48   4.959  -1.367   1.569
  383    HB2  LEU  48           2HB      LEU  48   2.868  -3.162   2.857
  384    HB3  LEU  48           1HB      LEU  48   2.527  -1.489   2.450
  385    HG   LEU  48           HG       LEU  48   1.641  -2.879   0.698
  386   HD11  LEU  48          1HD1      LEU  48   2.760  -1.962  -1.298
  387   HD12  LEU  48          2HD1      LEU  48   4.157  -1.499  -0.331
  388   HD13  LEU  48          3HD1      LEU  48   2.591  -0.732  -0.049
  389   HD21  LEU  48          3HD2      LEU  48   2.983  -4.403  -0.685
  390   HD22  LEU  48          1HD2      LEU  48   3.001  -4.906   1.005
  391   HD23  LEU  48          2HD2      LEU  48   4.404  -4.088   0.313
  392    H    MET  49           H        MET  49   5.061  -2.891   4.739
  393    HA   MET  49           HA       MET  49   4.397  -0.632   6.337
  394    HB2  MET  49           2HB      MET  49   6.272  -2.907   7.118
  395    HB3  MET  49           1HB      MET  49   5.441  -1.814   8.217
  396    HG2  MET  49           2HG      MET  49   3.308  -2.768   7.621
  397    HG3  MET  49           1HG      MET  49   4.078  -3.800   6.406
  398    HE1  MET  49           3HE      MET  49   3.472  -6.671   8.821
  399    HE2  MET  49           1HE      MET  49   3.621  -6.173   7.138
  400    HE3  MET  49           2HE      MET  49   2.377  -5.458   8.166
  401    H    VAL  50           H        VAL  50   7.575  -2.038   5.481
  402    HA   VAL  50           HA       VAL  50   9.148   0.067   6.584
  403    HB   VAL  50           HB       VAL  50  10.037  -2.235   6.209
  404   HG11  VAL  50          1HG1      VAL  50  10.857  -2.925   3.971
  405   HG12  VAL  50          2HG1      VAL  50  10.083  -1.504   3.257
  406   HG13  VAL  50          3HG1      VAL  50   9.101  -2.761   4.020
  407   HG21  VAL  50          3HG2      VAL  50  11.638  -0.409   6.574
  408   HG22  VAL  50          1HG2      VAL  50  11.683  -0.077   4.840
  409   HG23  VAL  50          2HG2      VAL  50  12.313  -1.602   5.466
  410    H    TYR  51           H        TYR  51   7.667  -0.386   3.420
  411    HA   TYR  51           HA       TYR  51   9.104   1.541   1.932
  412    HB2  TYR  51           2HB      TYR  51   7.430  -0.110   0.922
  413    HB3  TYR  51           1HB      TYR  51   6.143   0.903   1.549
  414    HD1  TYR  51           HD1      TYR  51   9.180   1.055  -0.655
  415    HD2  TYR  51           HD2      TYR  51   5.340   2.735   0.215
  416    HE1  TYR  51           HE1      TYR  51   9.327   2.457  -2.671
  417    HE2  TYR  51           HE2      TYR  51   5.496   4.116  -1.799
  418    HH   TYR  51           HH       TYR  51   7.358   5.089  -3.220
  419    H    ILE  52           H        ILE  52   5.931   1.801   3.466
  420    HA   ILE  52           HA       ILE  52   5.548   4.590   3.014
  421    HB   ILE  52           HB       ILE  52   4.121   2.623   4.859
  422   HG12  ILE  52          2HG1      ILE  52   3.239   3.564   2.094
  423   HG13  ILE  52          1HG1      ILE  52   4.197   2.107   2.332
  424   HG21  ILE  52          1HG2      ILE  52   3.635   4.920   5.551
  425   HG22  ILE  52          2HG2      ILE  52   2.206   4.175   4.832
  426   HG23  ILE  52          3HG2      ILE  52   3.161   5.332   3.904
  427   HD11  ILE  52          3HD1      ILE  52   1.437   2.602   3.438
  428   HD12  ILE  52          1HD1      ILE  52   2.408   1.142   3.664
  429   HD13  ILE  52          2HD1      ILE  52   1.860   1.594   2.052
  430    H    ARG  53           H        ARG  53   6.816   2.714   5.660
  431    HA   ARG  53           HA       ARG  53   7.059   4.520   7.760
  432    HB2  ARG  53           2HB      ARG  53   7.507   2.128   7.928
  433    HB3  ARG  53           1HB      ARG  53   8.909   2.288   6.878
  434    HG2  ARG  53           2HG      ARG  53  10.104   3.543   8.603
  435    HG3  ARG  53           1HG      ARG  53   8.681   3.515   9.650
  436    HD2  ARG  53           2HD      ARG  53   8.801   1.002   9.655
  437    HD3  ARG  53           1HD      ARG  53  10.298   1.116   8.727
  438    HE   ARG  53           HE       ARG  53  11.253   2.330  10.655
  439   HH11  ARG  53          1HH1      ARG  53   8.503   0.217  11.215
  440   HH12  ARG  53          2HH1      ARG  53   8.889  -0.034  12.889
  441   HH21  ARG  53          1HH2      ARG  53  11.723   2.048  12.831
  442   HH22  ARG  53          2HH2      ARG  53  10.734   1.013  13.815
  443    H    ASP  54           H        ASP  54   9.158   4.065   4.978
  444    HA   ASP  54           HA       ASP  54  11.045   6.184   5.724
  445    HB2  ASP  54           2HB      ASP  54  11.865   4.120   4.636
  446    HB3  ASP  54           1HB      ASP  54  10.783   4.373   3.271
  447    H    GLU  55           H        GLU  55   8.711   5.498   3.219
  448    HA   GLU  55           HA       GLU  55   9.043   7.614   1.469
  449    HB2  GLU  55           2HB      GLU  55   8.005   5.467   0.913
  450    HB3  GLU  55           1HB      GLU  55   6.670   5.800   2.003
  451    HG2  GLU  55           2HG      GLU  55   5.974   6.085  -0.279
  452    HG3  GLU  55           1HG      GLU  55   5.935   7.633   0.554
  453    H    MET  56           H        MET  56   6.310   7.155   3.722
  454    HA   MET  56           HA       MET  56   5.761  10.075   3.680
  455    HB2  MET  56           2HB      MET  56   3.965   7.648   3.957
  456    HB3  MET  56           1HB      MET  56   3.428   9.209   4.559
  457    HG2  MET  56           2HG      MET  56   3.426  10.171   2.408
  458    HG3  MET  56           1HG      MET  56   4.371   8.856   1.713
  459    HE1  MET  56           3HE      MET  56   3.415   6.707   0.739
  460    HE2  MET  56           1HE      MET  56   1.870   6.001   1.220
  461    HE3  MET  56           2HE      MET  56   3.165   6.180   2.405
  462    H    GLY  57           H        GLY  57   7.410   8.003   5.485
  463    HA2  GLY  57           2HA      GLY  57   8.341   8.173   7.562
  464    HA3  GLY  57           1HA      GLY  57   7.537   9.723   7.744
  465    H    VAL  58           H        VAL  58   5.741   6.750   7.167
  466    HA   VAL  58           HA       VAL  58   4.917   6.618   9.986
  467    HB   VAL  58           HB       VAL  58   3.268   8.122   9.034
  468   HG11  VAL  58          1HG1      VAL  58   2.759   6.082   6.854
  469   HG12  VAL  58          2HG1      VAL  58   3.568   7.636   6.647
  470   HG13  VAL  58          3HG1      VAL  58   1.858   7.583   7.090
  471   HG21  VAL  58          3HG2      VAL  58   2.020   5.368   9.280
  472   HG22  VAL  58          1HG2      VAL  58   1.162   6.905   9.408
  473   HG23  VAL  58          2HG2      VAL  58   2.373   6.466  10.614
  474    H    SER  59           H        SER  59   5.235   4.597  10.620
  475    HA   SER  59           HA       SER  59   4.993   2.328   8.770
  476    HB2  SER  59           2HB      SER  59   6.998   2.579  10.336
  477    HB3  SER  59           1HB      SER  59   5.906   2.318  11.691
  478    HG   SER  59           HG       SER  59   5.595   0.255  11.052
  479    H    ILE  60           H        ILE  60   3.105   1.276   8.709
  480    HA   ILE  60           HA       ILE  60   0.903   1.839  10.408
  481    HB   ILE  60           HB       ILE  60   1.248  -0.541   8.517
  482   HG12  ILE  60          2HG1      ILE  60   0.109   2.248   8.084
  483   HG13  ILE  60          1HG1      ILE  60   1.396   1.461   7.183
  484   HG21  ILE  60          1HG2      ILE  60  -1.305   0.565   9.769
  485   HG22  ILE  60          2HG2      ILE  60  -0.511  -0.948  10.212
  486   HG23  ILE  60          3HG2      ILE  60  -1.213  -0.765   8.608
  487   HD11  ILE  60          3HD1      ILE  60  -0.213  -0.042   6.169
  488   HD12  ILE  60          1HD1      ILE  60  -0.696   1.638   5.927
  489   HD13  ILE  60          2HD1      ILE  60  -1.511   0.654   7.150
  490    HA   PRO  61           HA       PRO  61   2.261  -0.813  13.872
  491    HB2  PRO  61           2HB      PRO  61  -0.085  -0.627  15.364
  492    HB3  PRO  61           1HB      PRO  61   1.150   0.647  15.319
  493    HG2  PRO  61           2HG      PRO  61  -1.396   0.461  13.752
  494    HG3  PRO  61           1HG      PRO  61  -0.707   1.851  14.626
  495    HD2  PRO  61           2HD      PRO  61  -0.450   1.636  11.962
  496    HD3  PRO  61           1HD      PRO  61   0.874   2.292  12.954
  497    H    SER  62           H        SER  62   1.633  -2.888  14.820
  498    HA   SER  62           HA       SER  62   0.926  -4.750  12.830
  499    HB2  SER  62           2HB      SER  62   1.194  -6.442  14.619
  500    HB3  SER  62           1HB      SER  62   2.515  -5.276  14.618
  501    HG   SER  62           HG       SER  62   2.038  -5.126  16.662
  502    H    THR  63           H        THR  63  -0.925  -3.276  15.410
  503    HA   THR  63           HA       THR  63  -3.256  -4.857  15.367
  504    HB   THR  63           HB       THR  63  -2.799  -3.278  17.187
  505    HG1  THR  63           HG1      THR  63  -4.935  -3.726  17.035
  506   HG21  THR  63          3HG2      THR  63  -3.337  -1.055  15.188
  507   HG22  THR  63          1HG2      THR  63  -1.763  -1.451  15.883
  508   HG23  THR  63          2HG2      THR  63  -3.059  -0.849  16.920
  509    H    HIS  64           H        HIS  64  -2.202  -2.221  13.301
  510    HA   HIS  64           HA       HIS  64  -4.722  -2.187  11.770
  511    HB2  HIS  64           2HB      HIS  64  -2.401  -0.260  11.968
  512    HB3  HIS  64           1HB      HIS  64  -3.562  -0.161  10.648
  513    HD1  HIS  64           HD1      HIS  64  -5.771  -1.074  13.171
  514    HD2  HIS  64           HD2      HIS  64  -3.573   2.382  12.496
  515    HE1  HIS  64           HE1      HIS  64  -7.026   0.763  14.345
  516    HE2  HIS  64           HE2      HIS  64  -5.601   2.820  14.032
  517    H    ILE  65           H        ILE  65  -1.915  -3.945  11.658
  518    HA   ILE  65           HA       ILE  65  -1.762  -4.182   8.773
  519    HB   ILE  65           HB       ILE  65  -0.749  -6.151  10.872
  520   HG12  ILE  65          2HG1      ILE  65   0.405  -4.033  11.177
  521   HG13  ILE  65          1HG1      ILE  65   1.513  -5.145  10.388
  522   HG21  ILE  65          1HG2      ILE  65  -0.127  -5.967   7.892
  523   HG22  ILE  65          2HG2      ILE  65  -1.054  -7.236   8.696
  524   HG23  ILE  65          3HG2      ILE  65   0.663  -7.054   9.039
  525   HD11  ILE  65          3HD1      ILE  65   1.120  -4.043   8.257
  526   HD12  ILE  65          1HD1      ILE  65   1.652  -2.893   9.485
  527   HD13  ILE  65          2HD1      ILE  65  -0.047  -2.961   9.019
  528    H    THR  66           H        THR  66  -3.729  -4.570   7.992
  529    HA   THR  66           HA       THR  66  -4.876  -7.190   8.387
  530    HB   THR  66           HB       THR  66  -6.051  -5.984  10.143
  531    HG1  THR  66           HG1      THR  66  -8.141  -6.428   9.496
  532   HG21  THR  66          3HG2      THR  66  -5.724  -3.671   9.349
  533   HG22  THR  66          1HG2      THR  66  -7.418  -3.984   9.737
  534   HG23  THR  66          2HG2      THR  66  -6.893  -3.945   8.054
  535    H    GLY  67           H        GLY  67  -6.679  -7.559   6.843
  536    HA2  GLY  67           2HA      GLY  67  -5.762  -7.172   4.230
  537    HA3  GLY  67           1HA      GLY  67  -7.314  -7.846   4.692
  538    H    LYS  68           H        LYS  68  -8.533  -5.704   5.923
  539    HA   LYS  68           HA       LYS  68  -9.553  -4.295   3.691
  540    HB2  LYS  68           2HB      LYS  68 -10.914  -3.066   5.353
  541    HB3  LYS  68           1HB      LYS  68 -10.955  -4.810   5.585
  542    HG2  LYS  68           2HG      LYS  68  -9.419  -4.660   7.464
  543    HG3  LYS  68           1HG      LYS  68  -9.210  -2.927   7.210
  544    HD2  LYS  68           2HD      LYS  68 -11.794  -4.318   8.000
  545    HD3  LYS  68           1HD      LYS  68 -10.751  -3.395   9.083
  546    HE2  LYS  68           2HE      LYS  68 -11.187  -1.365   7.699
  547    HE3  LYS  68           1HE      LYS  68 -12.307  -2.308   6.714
  548    HZ1  LYS  68           3HZ      LYS  68 -12.573  -1.643   9.592
  549    HZ2  LYS  68           1HZ      LYS  68 -13.587  -2.733   8.784
  550    HZ3  LYS  68           2HZ      LYS  68 -13.540  -1.108   8.320
  551    H    TYR  69           H        TYR  69  -6.919  -3.522   5.824
  552    HA   TYR  69           HA       TYR  69  -6.890  -0.667   5.185
  553    HB2  TYR  69           2HB      TYR  69  -5.261  -2.424   7.038
  554    HB3  TYR  69           1HB      TYR  69  -4.685  -0.816   6.608
  555    HD1  TYR  69           HD2      TYR  69  -8.327  -1.492   7.095
  556    HD2  TYR  69           HD1      TYR  69  -4.766   0.013   8.909
  557    HE1  TYR  69           HE2      TYR  69  -9.661  -0.516   8.898
  558    HE2  TYR  69           HE1      TYR  69  -6.101   0.992  10.708
  559    HH   TYR  69           HH       TYR  69  -9.290   0.175  11.300
  560    H    PHE  70           H        PHE  70  -5.518  -3.568   3.984
  561    HA   PHE  70           HA       PHE  70  -3.637  -2.089   2.208
  562    HB2  PHE  70           2HB      PHE  70  -3.495  -4.919   3.326
  563    HB3  PHE  70           1HB      PHE  70  -2.493  -4.380   1.986
  564    HD1  PHE  70           HD1      PHE  70  -0.767  -2.598   2.338
  565    HD2  PHE  70           HD2      PHE  70  -2.916  -4.296   5.619
  566    HE1  PHE  70           HE1      PHE  70   0.938  -1.764   3.892
  567    HE2  PHE  70           HE2      PHE  70  -1.203  -3.459   7.165
  568    HZ   PHE  70           HZ       PHE  70   0.727  -2.187   6.301
  569    H    LYS  71           H        LYS  71  -6.593  -2.835   1.996
  570    HA   LYS  71           HA       LYS  71  -6.986  -5.097   0.428
  571    HB2  LYS  71           2HB      LYS  71  -8.599  -3.875   1.976
  572    HB3  LYS  71           1HB      LYS  71  -8.843  -2.709   0.681
  573    HG2  LYS  71           2HG      LYS  71  -9.789  -4.399  -0.740
  574    HG3  LYS  71           1HG      LYS  71  -9.371  -5.667   0.418
  575    HD2  LYS  71           2HD      LYS  71 -11.798  -5.050   0.517
  576    HD3  LYS  71           1HD      LYS  71 -10.965  -4.783   2.049
  577    HE2  LYS  71           2HE      LYS  71 -12.552  -2.954   1.419
  578    HE3  LYS  71           1HE      LYS  71 -10.896  -2.392   1.658
  579    HZ1  LYS  71           3HZ      LYS  71 -11.943  -1.431  -0.309
  580    HZ2  LYS  71           1HZ      LYS  71 -12.138  -2.971  -0.983
  581    HZ3  LYS  71           2HZ      LYS  71 -10.585  -2.344  -0.715
  582    H    ASP  72           H        ASP  72  -6.361  -1.800  -0.431
  583    HA   ASP  72           HA       ASP  72  -5.538  -2.289  -3.066
  584    HB2  ASP  72           2HB      ASP  72  -7.295  -1.013  -4.326
  585    HB3  ASP  72           1HB      ASP  72  -7.923  -2.504  -3.636
  586    H    LEU  73           H        LEU  73  -5.744   0.203  -4.185
  587    HA   LEU  73           HA       LEU  73  -3.774   1.639  -2.742
  588    HB2  LEU  73           2HB      LEU  73  -3.944   1.734  -5.211
  589    HB3  LEU  73           1HB      LEU  73  -5.480   2.575  -5.072
  590    HG   LEU  73           HG       LEU  73  -4.245   4.461  -3.879
  591   HD11  LEU  73          1HD1      LEU  73  -1.795   4.576  -4.157
  592   HD12  LEU  73          2HD1      LEU  73  -1.790   2.938  -4.807
  593   HD13  LEU  73          3HD1      LEU  73  -2.278   3.227  -3.133
  594   HD21  LEU  73          3HD2      LEU  73  -3.294   5.424  -5.954
  595   HD22  LEU  73          1HD2      LEU  73  -4.886   4.714  -6.210
  596   HD23  LEU  73          2HD2      LEU  73  -3.443   3.849  -6.740
  597    H    ASN  74           H        ASN  74  -7.268   2.190  -3.170
  598    HA   ASN  74           HA       ASN  74  -7.378   4.712  -1.795
  599    HB2  ASN  74           2HB      ASN  74  -9.636   2.707  -2.266
  600    HB3  ASN  74           1HB      ASN  74  -9.838   4.395  -1.798
  601   HD21  ASN  74          1HD2      ASN  74 -10.884   2.985  -4.103
  602   HD22  ASN  74          2HD2      ASN  74 -10.292   3.820  -5.499
  603    H    ALA  75           H        ALA  75  -7.724   1.336  -0.813
  604    HA   ALA  75           HA       ALA  75  -8.581   1.743   1.861
  605    HB1  ALA  75           3HB      ALA  75  -6.940  -0.533   0.707
  606    HB2  ALA  75           1HB      ALA  75  -8.705  -0.442   0.742
  607    HB3  ALA  75           2HB      ALA  75  -7.795  -0.563   2.249
  608    H    ILE  76           H        ILE  76  -5.306   1.321   0.513
  609    HA   ILE  76           HA       ILE  76  -3.836   1.845   2.916
  610    HB   ILE  76           HB       ILE  76  -2.996   1.948  -0.017
  611   HG12  ILE  76          2HG1      ILE  76  -2.472  -0.081   2.191
  612   HG13  ILE  76          1HG1      ILE  76  -3.564  -0.309   0.827
  613   HG21  ILE  76          1HG2      ILE  76  -1.519   3.485   1.251
  614   HG22  ILE  76          2HG2      ILE  76  -0.633   2.054   0.721
  615   HG23  ILE  76          3HG2      ILE  76  -1.157   2.194   2.399
  616   HD11  ILE  76          3HD1      ILE  76  -1.608  -0.244  -0.685
  617   HD12  ILE  76          1HD1      ILE  76  -1.541  -1.546   0.507
  618   HD13  ILE  76          2HD1      ILE  76  -0.561  -0.098   0.735
  619    H    SER  77           H        SER  77  -5.186   3.910   0.402
  620    HA   SER  77           HA       SER  77  -3.728   6.277   1.025
  621    HB2  SER  77           2HB      SER  77  -4.940   6.018  -1.134
  622    HB3  SER  77           1HB      SER  77  -6.480   6.026  -0.277
  623    HG   SER  77           HG       SER  77  -4.845   8.175   0.280
  624    H    ARG  78           H        ARG  78  -6.900   5.047   2.089
  625    HA   ARG  78           HA       ARG  78  -7.476   7.279   3.786
  626    HB2  ARG  78           2HB      ARG  78  -8.629   4.468   3.777
  627    HB3  ARG  78           1HB      ARG  78  -9.237   5.776   4.785
  628    HG2  ARG  78           2HG      ARG  78  -9.412   5.481   1.786
  629    HG3  ARG  78           1HG      ARG  78 -10.716   5.653   2.957
  630    HD2  ARG  78           2HD      ARG  78  -8.816   7.785   1.952
  631    HD3  ARG  78           1HD      ARG  78 -10.572   7.730   1.803
  632    HE   ARG  78           HE       ARG  78 -10.341   7.864   4.454
  633   HH11  ARG  78          1HH1      ARG  78  -8.643   9.702   1.988
  634   HH12  ARG  78          2HH1      ARG  78  -8.438  11.103   2.991
  635   HH21  ARG  78          1HH2      ARG  78 -10.038   9.728   5.774
  636   HH22  ARG  78          2HH2      ARG  78  -9.223  11.116   5.124
  637    H    THR  79           H        THR  79  -5.950   4.135   4.302
  638    HA   THR  79           HA       THR  79  -5.845   4.225   7.135
  639    HB   THR  79           HB       THR  79  -4.080   2.694   5.181
  640    HG1  THR  79           HG1      THR  79  -5.767   1.446   5.036
  641   HG21  THR  79          3HG2      THR  79  -3.587   1.190   7.099
  642   HG22  THR  79          1HG2      THR  79  -4.453   2.281   8.180
  643   HG23  THR  79          2HG2      THR  79  -2.967   2.816   7.389
  644    H    VAL  80           H        VAL  80  -3.536   5.185   4.630
  645    HA   VAL  80           HA       VAL  80  -1.436   5.829   6.463
  646    HB   VAL  80           HB       VAL  80  -1.113   5.112   4.023
  647   HG11  VAL  80          1HG1      VAL  80  -1.750   8.023   3.394
  648   HG12  VAL  80          2HG1      VAL  80  -2.717   6.620   2.926
  649   HG13  VAL  80          3HG1      VAL  80  -1.090   6.834   2.270
  650   HG21  VAL  80          3HG2      VAL  80   0.909   6.485   3.701
  651   HG22  VAL  80          1HG2      VAL  80   0.742   5.948   5.371
  652   HG23  VAL  80          2HG2      VAL  80   0.353   7.614   4.939
  653    H    GLU  81           H        GLU  81  -4.037   7.658   4.884
  654    HA   GLU  81           HA       GLU  81  -3.162  10.270   5.641
  655    HB2  GLU  81           2HB      GLU  81  -5.886   9.170   4.863
  656    HB3  GLU  81           1HB      GLU  81  -5.681  10.857   5.304
  657    HG2  GLU  81           2HG      GLU  81  -4.265   9.476   3.008
  658    HG3  GLU  81           1HG      GLU  81  -5.704  10.464   2.852
  659    H    GLN  82           H        GLN  82  -5.416   7.929   7.142
  660    HA   GLN  82           HA       GLN  82  -6.209   9.668   9.272
  661    HB2  GLN  82           2HB      GLN  82  -7.429   7.833  10.204
  662    HB3  GLN  82           1HB      GLN  82  -7.588   7.714   8.462
  663    HG2  GLN  82           2HG      GLN  82  -5.900   5.910   8.434
  664    HG3  GLN  82           1HG      GLN  82  -5.744   6.032  10.185
  665   HE21  GLN  82          1HE2      GLN  82  -6.357   3.889  10.501
  666   HE22  GLN  82          2HE2      GLN  82  -7.976   3.325  10.274
  667    H    LEU  83           H        LEU  83  -3.641   7.267   8.944
  668    HA   LEU  83           HA       LEU  83  -2.841   7.221  11.688
  669    HB2  LEU  83           2HB      LEU  83  -1.415   6.455   9.129
  670    HB3  LEU  83           1HB      LEU  83  -0.641   6.309  10.702
  671    HG   LEU  83           HG       LEU  83  -3.188   4.853   9.873
  672   HD11  LEU  83          1HD1      LEU  83  -1.786   2.839   9.840
  673   HD12  LEU  83          2HD1      LEU  83  -0.353   3.807  10.193
  674   HD13  LEU  83          3HD1      LEU  83  -1.212   4.022   8.663
  675   HD21  LEU  83          3HD2      LEU  83  -3.155   5.293  12.283
  676   HD22  LEU  83          1HD2      LEU  83  -1.515   4.646  12.407
  677   HD23  LEU  83          2HD2      LEU  83  -2.855   3.587  11.975
  678    H    LYS  84           H        LYS  84  -1.638   9.015   8.855
  679    HA   LYS  84           HA       LYS  84   0.314  10.525  10.298
  680    HB2  LYS  84           2HB      LYS  84  -1.059  11.127   7.641
  681    HB3  LYS  84           1HB      LYS  84   0.290  12.055   8.285
  682    HG2  LYS  84           2HG      LYS  84   1.704  10.027   8.192
  683    HG3  LYS  84           1HG      LYS  84   0.360   9.135   7.487
  684    HD2  LYS  84           2HD      LYS  84   1.722  11.549   6.216
  685    HD3  LYS  84           1HD      LYS  84   2.039   9.870   5.802
  686    HE2  LYS  84           2HE      LYS  84   0.600  10.713   4.099
  687    HE3  LYS  84           1HE      LYS  84  -0.411   9.694   5.124
  688    HZ1  LYS  84           3HZ      LYS  84  -1.401  11.581   6.099
  689    HZ2  LYS  84           1HZ      LYS  84  -1.405  11.861   4.424
  690    HZ3  LYS  84           2HZ      LYS  84  -0.266  12.647   5.444
  691    H    ALA  85           H        ALA  85  -3.113  10.774  10.025
  692    HA   ALA  85           HA       ALA  85  -3.373  13.534  10.841
  693    HB1  ALA  85           3HB      ALA  85  -5.763  13.053  10.948
  694    HB2  ALA  85           1HB      ALA  85  -5.453  11.318  10.826
  695    HB3  ALA  85           2HB      ALA  85  -5.091  12.382   9.460
  696    H    GLU  86           H        GLU  86  -3.621  10.341  12.462
  697    HA   GLU  86           HA       GLU  86  -4.284  11.440  15.049
  698    HB2  GLU  86           2HB      GLU  86  -3.106   8.699  14.446
  699    HB3  GLU  86           1HB      GLU  86  -3.933   9.192  15.914
  700    HG2  GLU  86           2HG      GLU  86  -5.116   8.653  13.194
  701    HG3  GLU  86           1HG      GLU  86  -5.475   7.862  14.711
  702    H    SER  87           H        SER  87  -1.357  10.348  13.453
  703    HA   SER  87           HA       SER  87   0.442  10.863  15.629
  704    HB2  SER  87           2HB      SER  87   1.030  10.408  12.675
  705    HB3  SER  87           1HB      SER  87   2.223  10.362  13.978
  706    HG   SER  87           HG       SER  87   0.311   8.503  13.238
  707    H    ALA  88           H        ALA  88  -1.095  12.929  13.385
  708    HA   ALA  88           HA       ALA  88   0.884  14.869  12.840
  709    HB1  ALA  88           3HB      ALA  88  -0.959  16.362  12.238
  710    HB2  ALA  88           1HB      ALA  88  -2.117  15.286  13.028
  711    HB3  ALA  88           2HB      ALA  88  -1.227  14.740  11.609
  712    H    LEU  89           H        LEU  89   1.712  16.473  13.978
  713    HA   LEU  89           HA       LEU  89   1.220  16.787  16.782
  714    HB2  LEU  89           2HB      LEU  89   3.064  18.284  16.804
  715    HB3  LEU  89           1HB      LEU  89   3.480  16.970  15.731
  716    HG   LEU  89           HG       LEU  89   2.545  19.693  14.721
  717   HD11  LEU  89          1HD1      LEU  89   4.891  20.250  14.342
  718   HD12  LEU  89          2HD1      LEU  89   5.401  18.715  15.043
  719   HD13  LEU  89          3HD1      LEU  89   4.620  19.932  16.053
  720   HD21  LEU  89          3HD2      LEU  89   2.303  17.859  13.085
  721   HD22  LEU  89          1HD2      LEU  89   4.011  17.443  13.289
  722   HD23  LEU  89          2HD2      LEU  89   3.552  18.999  12.587
  723    H    GLU  90           H        GLU  90  -0.591  17.905  14.340
  724    HA   GLU  90           HA       GLU  90  -0.832  20.639  14.415
  725    HB2  GLU  90           2HB      GLU  90  -3.073  18.645  13.895
  726    HB3  GLU  90           1HB      GLU  90  -3.035  20.316  13.356
  727    HG2  GLU  90           2HG      GLU  90  -1.309  18.026  12.413
  728    HG3  GLU  90           1HG      GLU  90  -2.500  18.929  11.482
  729   H281  4EM 101          2H28      PYA 142   3.287 -10.757   7.494
  730   H283  4EM 101          3H28      PYA 142   4.643 -10.174   8.451
  731   H303  4EM 101          3H30      PYA 142   1.038 -11.051   8.534
  732   H301  4EM 101          1H30      PYA 142   0.843 -10.951  10.300
  733   H302  4EM 101          2H30      PYA 142   1.723 -12.298   9.566
  734   H312  4EM 101          2H31      PYA 142   2.014  -8.816   8.440
  735   H313  4EM 101          3H31      PYA 142   1.793  -8.666  10.180
  736   H311  4EM 101          1H31      PYA 142   3.383  -8.367   9.469
  737    H32  4EM 101           H32      PYA 142   3.929 -11.664  11.013
  738    H33  4EM 101           H33      PYA 142   5.046  -9.900  11.967
  739    H36  4EM 101           H36      PYA 142   2.700  -8.445  12.057
  740   H373  4EM 101          3H37      PYA 142   1.124  -9.700  14.184
  741   H372  4EM 101          2H37      PYA 142   1.287  -7.958  13.884
  742   H382  4EM 101          2H38      PYA 142  -0.107  -9.866  11.979
  743   H383  4EM 101          3H38      PYA 142  -0.053  -8.113  11.869
  744    H41  4EM 101           H41      PYA 142  -2.039  -9.775  11.559
  745   H423  4EM 101          3H42      PYA 142  -4.316  -8.672  12.084
  746   H422  4EM 101          2H42      PYA 142  -4.092  -9.579  13.581
  747   H433  4EM 101          3H43      PYA 142  -5.379 -10.845  11.783
  748   H432  4EM 101          2H43      PYA 142  -3.914 -11.667  12.342
  749    H44  4EM 101           H44      PYA 142  -3.191 -11.548  10.365
  750    H49  4EM 101           H49      PYA 142  -2.894  -8.057   7.858
  751    H51  4EM 101           H51      PYA 142  -1.314  -9.335   6.205
  752    H50  4EM 101           H50      PYA 142  -1.683 -11.888   6.545
  753    H48  4EM 101           H48      PYA 142  -3.326 -12.136   8.498
  Start of MODEL   17
    1    H1   MET   1           1H       MET   1   4.711  14.721  -1.614
    2    H2   MET   1           2H       MET   1   4.362  14.503   0.021
    3    H3   MET   1           3H       MET   1   5.756  15.339  -0.444
    4    HA   MET   1           HA       MET   1   4.069  16.859   0.316
    5    HB2  MET   1           2HB      MET   1   5.669  17.574  -1.423
    6    HB3  MET   1           1HB      MET   1   4.597  16.975  -2.681
    7    HG2  MET   1           2HG      MET   1   2.928  18.677  -2.080
    8    HG3  MET   1           1HG      MET   1   3.986  19.260  -0.788
    9    HE1  MET   1           3HE      MET   1   4.193  22.127  -3.499
   10    HE2  MET   1           1HE      MET   1   3.874  21.770  -1.802
   11    HE3  MET   1           2HE      MET   1   2.786  21.166  -3.052
   12    H    ASP   2           H        ASP   2   2.950  15.638  -2.888
   13    HA   ASP   2           HA       ASP   2   0.154  15.938  -2.083
   14    HB2  ASP   2           2HB      ASP   2   1.421  15.012  -4.710
   15    HB3  ASP   2           1HB      ASP   2  -0.318  15.106  -4.446
   16    H    GLY   3           H        GLY   3  -1.335  14.207  -2.060
   17    HA2  GLY   3           2HA      GLY   3  -0.480  11.649  -1.158
   18    HA3  GLY   3           1HA      GLY   3  -2.116  12.117  -1.614
   19    H    GLU   4           H        GLU   4  -1.644  12.907  -4.238
   20    HA   GLU   4           HA       GLU   4  -2.012  10.408  -5.544
   21    HB2  GLU   4           2HB      GLU   4  -1.644  13.162  -6.774
   22    HB3  GLU   4           1HB      GLU   4  -2.253  11.730  -7.601
   23    HG2  GLU   4           2HG      GLU   4  -4.146  13.034  -7.073
   24    HG3  GLU   4           1HG      GLU   4  -4.167  11.682  -5.947
   25    H    GLU   5           H        GLU   5   0.609  12.631  -5.306
   26    HA   GLU   5           HA       GLU   5   2.456  11.734  -7.168
   27    HB2  GLU   5           2HB      GLU   5   2.483  13.811  -5.697
   28    HB3  GLU   5           1HB      GLU   5   3.040  12.807  -4.371
   29    HG2  GLU   5           2HG      GLU   5   4.523  13.164  -6.987
   30    HG3  GLU   5           1HG      GLU   5   4.796  14.152  -5.560
   31    H    VAL   6           H        VAL   6   2.067  10.770  -3.726
   32    HA   VAL   6           HA       VAL   6   4.001   8.632  -3.970
   33    HB   VAL   6           HB       VAL   6   3.501   8.058  -1.628
   34   HG11  VAL   6          1HG1      VAL   6   4.300  10.112  -0.560
   35   HG12  VAL   6          2HG1      VAL   6   3.896  11.044  -2.004
   36   HG13  VAL   6          3HG1      VAL   6   5.159   9.813  -2.074
   37   HG21  VAL   6          3HG2      VAL   6   1.083   8.535  -1.572
   38   HG22  VAL   6          1HG2      VAL   6   1.405  10.266  -1.710
   39   HG23  VAL   6          2HG2      VAL   6   1.922   9.379  -0.272
   40    H    LYS   7           H        LYS   7   0.536   8.888  -4.275
   41    HA   LYS   7           HA       LYS   7  -0.183   6.252  -3.566
   42    HB2  LYS   7           2HB      LYS   7  -1.591   8.363  -5.217
   43    HB3  LYS   7           1HB      LYS   7  -2.262   6.738  -5.114
   44    HG2  LYS   7           2HG      LYS   7  -2.250   7.023  -2.573
   45    HG3  LYS   7           1HG      LYS   7  -1.877   8.724  -2.856
   46    HD2  LYS   7           2HD      LYS   7  -4.345   7.236  -3.819
   47    HD3  LYS   7           1HD      LYS   7  -4.288   8.435  -2.534
   48    HE2  LYS   7           2HE      LYS   7  -3.702  10.171  -4.164
   49    HE3  LYS   7           1HE      LYS   7  -3.706   8.975  -5.460
   50    HZ1  LYS   7           3HZ      LYS   7  -5.762  10.252  -5.376
   51    HZ2  LYS   7           1HZ      LYS   7  -6.065   9.710  -3.805
   52    HZ3  LYS   7           2HZ      LYS   7  -6.055   8.613  -5.092
   53    H    GLU   8           H        GLU   8   0.479   7.655  -6.791
   54    HA   GLU   8           HA       GLU   8   0.084   5.201  -8.196
   55    HB2  GLU   8           2HB      GLU   8   1.079   6.286 -10.126
   56    HB3  GLU   8           1HB      GLU   8  -0.076   7.355  -9.338
   57    HG2  GLU   8           2HG      GLU   8   1.666   8.727  -8.420
   58    HG3  GLU   8           1HG      GLU   8   2.913   7.561  -8.872
   59    H    LYS   9           H        LYS   9   2.814   6.532  -6.455
   60    HA   LYS   9           HA       LYS   9   4.775   4.738  -7.558
   61    HB2  LYS   9           2HB      LYS   9   4.888   6.411  -5.029
   62    HB3  LYS   9           1HB      LYS   9   6.245   5.523  -5.720
   63    HG2  LYS   9           2HG      LYS   9   6.043   6.939  -7.783
   64    HG3  LYS   9           1HG      LYS   9   4.800   7.884  -6.958
   65    HD2  LYS   9           2HD      LYS   9   7.735   7.620  -6.223
   66    HD3  LYS   9           1HD      LYS   9   6.874   9.074  -6.731
   67    HE2  LYS   9           2HE      LYS   9   5.508   8.896  -4.612
   68    HE3  LYS   9           1HE      LYS   9   6.580   7.596  -4.092
   69    HZ1  LYS   9           3HZ      LYS   9   7.377  10.387  -4.707
   70    HZ2  LYS   9           1HZ      LYS   9   8.433   9.152  -4.238
   71    HZ3  LYS   9           2HZ      LYS   9   7.249   9.701  -3.169
   72    H    ILE  10           H        ILE  10   2.491   4.617  -4.893
   73    HA   ILE  10           HA       ILE  10   3.451   2.258  -3.638
   74    HB   ILE  10           HB       ILE  10   0.506   2.986  -4.015
   75   HG12  ILE  10          2HG1      ILE  10   1.621   4.898  -2.981
   76   HG13  ILE  10          1HG1      ILE  10   0.633   4.089  -1.777
   77   HG21  ILE  10          1HG2      ILE  10   1.855   1.228  -1.933
   78   HG22  ILE  10          2HG2      ILE  10   0.812   0.685  -3.248
   79   HG23  ILE  10          3HG2      ILE  10   0.141   1.661  -1.940
   80   HD11  ILE  10          3HD1      ILE  10   2.671   3.024  -0.864
   81   HD12  ILE  10          1HD1      ILE  10   2.738   4.785  -0.827
   82   HD13  ILE  10          2HD1      ILE  10   3.629   3.903  -2.061
   83    H    ARG  11           H        ARG  11   1.110   2.791  -6.246
   84    HA   ARG  11           HA       ARG  11   0.502   0.195  -7.011
   85    HB2  ARG  11           2HB      ARG  11   0.641   2.764  -8.610
   86    HB3  ARG  11           1HB      ARG  11   0.156   1.254  -9.364
   87    HG2  ARG  11           2HG      ARG  11  -1.689   1.084  -7.666
   88    HG3  ARG  11           1HG      ARG  11  -1.253   2.710  -7.125
   89    HD2  ARG  11           2HD      ARG  11  -3.105   2.854  -8.697
   90    HD3  ARG  11           1HD      ARG  11  -1.662   3.551  -9.442
   91    HE   ARG  11           HE       ARG  11  -2.312   0.745 -10.013
   92   HH11  ARG  11          1HH1      ARG  11  -2.268   4.048 -11.224
   93   HH12  ARG  11          2HH1      ARG  11  -2.452   3.564 -12.878
   94   HH21  ARG  11          1HH2      ARG  11  -2.540   0.135 -12.200
   95   HH22  ARG  11          2HH2      ARG  11  -2.604   1.355 -13.428
   96    H    ARG  12           H        ARG  12   3.160   2.227  -8.257
   97    HA   ARG  12           HA       ARG  12   4.060   0.282 -10.162
   98    HB2  ARG  12           2HB      ARG  12   4.953   2.996  -9.290
   99    HB3  ARG  12           1HB      ARG  12   6.196   1.973  -9.986
  100    HG2  ARG  12           2HG      ARG  12   5.174   3.415 -11.701
  101    HG3  ARG  12           1HG      ARG  12   4.889   1.709 -12.043
  102    HD2  ARG  12           2HD      ARG  12   2.597   1.946 -11.068
  103    HD3  ARG  12           1HD      ARG  12   2.890   3.671 -10.859
  104    HE   ARG  12           HE       ARG  12   2.792   2.277 -13.477
  105   HH11  ARG  12          1HH1      ARG  12   2.204   5.181 -11.556
  106   HH12  ARG  12          2HH1      ARG  12   1.506   6.056 -12.879
  107   HH21  ARG  12          1HH2      ARG  12   1.867   3.410 -15.168
  108   HH22  ARG  12          2HH2      ARG  12   1.314   5.040 -14.938
  109    H    TYR  13           H        TYR  13   5.130   1.234  -6.931
  110    HA   TYR  13           HA       TYR  13   7.417  -0.387  -6.676
  111    HB2  TYR  13           2HB      TYR  13   6.887   1.306  -4.993
  112    HB3  TYR  13           1HB      TYR  13   5.395   0.479  -4.574
  113    HD1  TYR  13           HD1      TYR  13   9.091  -0.266  -4.782
  114    HD2  TYR  13           HD2      TYR  13   5.453  -0.863  -2.608
  115    HE1  TYR  13           HE1      TYR  13  10.309  -1.553  -3.095
  116    HE2  TYR  13           HE2      TYR  13   6.694  -2.142  -0.915
  117    HH   TYR  13           HH       TYR  13   8.963  -3.584  -1.046
  118    H    ILE  14           H        ILE  14   4.018  -1.090  -6.107
  119    HA   ILE  14           HA       ILE  14   4.125  -3.696  -5.146
  120    HB   ILE  14           HB       ILE  14   2.062  -2.212  -6.804
  121   HG12  ILE  14          2HG1      ILE  14   2.346  -1.404  -4.495
  122   HG13  ILE  14          1HG1      ILE  14   0.766  -2.150  -4.682
  123   HG21  ILE  14          1HG2      ILE  14   0.429  -4.005  -6.291
  124   HG22  ILE  14          2HG2      ILE  14   1.756  -4.996  -5.673
  125   HG23  ILE  14          3HG2      ILE  14   1.716  -4.525  -7.374
  126   HD11  ILE  14          3HD1      ILE  14   1.626  -4.178  -3.571
  127   HD12  ILE  14          1HD1      ILE  14   1.761  -2.739  -2.559
  128   HD13  ILE  14          2HD1      ILE  14   3.186  -3.377  -3.372
  129    H    MET  15           H        MET  15   4.010  -2.560  -8.528
  130    HA   MET  15           HA       MET  15   3.971  -5.216  -9.627
  131    HB2  MET  15           2HB      MET  15   4.731  -2.678 -11.109
  132    HB3  MET  15           1HB      MET  15   4.081  -4.171 -11.783
  133    HG2  MET  15           2HG      MET  15   2.680  -2.026 -10.233
  134    HG3  MET  15           1HG      MET  15   2.254  -2.733 -11.789
  135    HE1  MET  15           3HE      MET  15   0.590  -4.774 -12.020
  136    HE2  MET  15           1HE      MET  15   0.475  -6.035 -10.795
  137    HE3  MET  15           2HE      MET  15   2.023  -5.716 -11.584
  138    H    GLU  16           H        GLU  16   6.557  -2.837  -9.051
  139    HA   GLU  16           HA       GLU  16   8.499  -4.277 -10.643
  140    HB2  GLU  16           2HB      GLU  16   8.773  -1.809  -8.879
  141    HB3  GLU  16           1HB      GLU  16  10.065  -2.458  -9.890
  142    HG2  GLU  16           2HG      GLU  16   8.757  -2.042 -11.910
  143    HG3  GLU  16           1HG      GLU  16   7.383  -1.497 -10.948
  144    H    ASP  17           H        ASP  17   7.628  -4.147  -7.271
  145    HA   ASP  17           HA       ASP  17  10.042  -5.729  -6.519
  146    HB2  ASP  17           2HB      ASP  17   9.821  -3.569  -5.317
  147    HB3  ASP  17           1HB      ASP  17   8.202  -4.009  -4.790
  148    H    LEU  18           H        LEU  18   6.590  -5.388  -5.614
  149    HA   LEU  18           HA       LEU  18   6.497  -7.843  -4.178
  150    HB2  LEU  18           2HB      LEU  18   4.289  -6.010  -5.144
  151    HB3  LEU  18           1HB      LEU  18   3.960  -7.452  -4.212
  152    HG   LEU  18           HG       LEU  18   3.900  -5.568  -2.720
  153   HD11  LEU  18          1HD1      LEU  18   5.572  -6.179  -1.049
  154   HD12  LEU  18          2HD1      LEU  18   6.480  -7.087  -2.258
  155   HD13  LEU  18          3HD1      LEU  18   4.859  -7.607  -1.790
  156   HD21  LEU  18          3HD2      LEU  18   5.757  -4.042  -2.306
  157   HD22  LEU  18          1HD2      LEU  18   5.240  -3.943  -3.983
  158   HD23  LEU  18          2HD2      LEU  18   6.714  -4.819  -3.572
  159    H    ILE  19           H        ILE  19   5.518  -6.987  -7.476
  160    HA   ILE  19           HA       ILE  19   4.801  -9.733  -8.124
  161    HB   ILE  19           HB       ILE  19   4.800  -7.157  -9.722
  162   HG12  ILE  19          2HG1      ILE  19   2.369  -7.737 -10.078
  163   HG13  ILE  19          1HG1      ILE  19   2.588  -9.123  -9.032
  164   HG21  ILE  19          1HG2      ILE  19   4.017  -8.389 -11.721
  165   HG22  ILE  19          2HG2      ILE  19   4.331  -9.914 -10.885
  166   HG23  ILE  19          3HG2      ILE  19   5.666  -8.827 -11.270
  167   HD11  ILE  19          3HD1      ILE  19   1.481  -7.300  -7.904
  168   HD12  ILE  19          1HD1      ILE  19   2.858  -6.241  -8.223
  169   HD13  ILE  19          2HD1      ILE  19   3.043  -7.643  -7.161
  170    H    GLY  20           H        GLY  20   7.393  -7.397  -8.871
  171    HA2  GLY  20           2HA      GLY  20   9.694  -8.093  -9.089
  172    HA3  GLY  20           1HA      GLY  20   9.145  -9.620  -9.773
  173    HA   PRO  21           HA       PRO  21  10.630  -6.807 -13.201
  174    HB2  PRO  21           2HB      PRO  21  11.580  -8.864 -14.827
  175    HB3  PRO  21           1HB      PRO  21  12.525  -8.065 -13.557
  176    HG2  PRO  21           2HG      PRO  21  11.066 -10.676 -13.452
  177    HG3  PRO  21           1HG      PRO  21  12.664 -10.241 -12.803
  178    HD2  PRO  21           2HD      PRO  21  10.483 -10.386 -11.213
  179    HD3  PRO  21           1HD      PRO  21  11.773  -9.202 -10.917
  180    H    SER  22           H        SER  22   8.927  -9.930 -13.820
  181    HA   SER  22           HA       SER  22   7.636  -8.950 -16.216
  182    HB2  SER  22           2HB      SER  22   7.081 -11.484 -14.613
  183    HB3  SER  22           1HB      SER  22   6.487 -11.130 -16.238
  184    HG   SER  22           HG       SER  22   8.851 -10.866 -16.718
  185    H    ALA  23           H        ALA  23   6.542  -7.095 -15.492
  186    HA   ALA  23           HA       ALA  23   4.465  -7.386 -13.401
  187    HB1  ALA  23           3HB      ALA  23   6.302  -5.918 -12.771
  188    HB2  ALA  23           1HB      ALA  23   4.823  -4.977 -12.985
  189    HB3  ALA  23           2HB      ALA  23   6.073  -4.952 -14.232
  190    H    LYS  24           H        LYS  24   2.408  -7.059 -13.956
  191    HA   LYS  24           HA       LYS  24   1.696  -5.782 -16.538
  192    HB2  LYS  24           2HB      LYS  24   0.173  -7.834 -14.893
  193    HB3  LYS  24           1HB      LYS  24  -0.422  -7.087 -16.371
  194    HG2  LYS  24           2HG      LYS  24   1.437  -8.147 -17.635
  195    HG3  LYS  24           1HG      LYS  24   1.985  -8.920 -16.141
  196    HD2  LYS  24           2HD      LYS  24  -0.143 -10.145 -15.964
  197    HD3  LYS  24           1HD      LYS  24  -0.755  -9.325 -17.404
  198    HE2  LYS  24           2HE      LYS  24   1.040 -10.389 -18.747
  199    HE3  LYS  24           1HE      LYS  24   1.598 -11.245 -17.309
  200    HZ1  LYS  24           3HZ      LYS  24  -0.518 -12.376 -17.190
  201    HZ2  LYS  24           1HZ      LYS  24   0.172 -12.621 -18.713
  202    HZ3  LYS  24           2HZ      LYS  24  -1.099 -11.523 -18.523
  203    H    GLU  25           H        GLU  25   1.681  -3.638 -15.648
  204    HA   GLU  25           HA       GLU  25  -0.041  -2.992 -13.416
  205    HB2  GLU  25           2HB      GLU  25   0.387  -0.619 -13.991
  206    HB3  GLU  25           1HB      GLU  25   1.832  -1.571 -13.764
  207    HG2  GLU  25           2HG      GLU  25   2.159  -1.709 -16.203
  208    HG3  GLU  25           1HG      GLU  25   0.697  -0.744 -16.437
  209    H    ASP  26           H        ASP  26  -0.717  -3.831 -16.556
  210    HA   ASP  26           HA       ASP  26  -2.992  -2.242 -17.075
  211    HB2  ASP  26           2HB      ASP  26  -2.353  -5.059 -18.073
  212    HB3  ASP  26           1HB      ASP  26  -3.553  -3.980 -18.774
  213    H    GLU  27           H        GLU  27  -2.396  -5.171 -15.284
  214    HA   GLU  27           HA       GLU  27  -5.159  -5.855 -14.712
  215    HB2  GLU  27           2HB      GLU  27  -2.629  -6.865 -13.339
  216    HB3  GLU  27           1HB      GLU  27  -4.199  -7.655 -13.375
  217    HG2  GLU  27           2HG      GLU  27  -2.349  -7.259 -15.739
  218    HG3  GLU  27           1HG      GLU  27  -2.578  -8.757 -14.849
  219    H    LEU  28           H        LEU  28  -2.482  -4.261 -13.182
  220    HA   LEU  28           HA       LEU  28  -3.538  -3.775 -10.601
  221    HB2  LEU  28           2HB      LEU  28  -1.169  -3.739 -11.050
  222    HB3  LEU  28           1HB      LEU  28  -1.385  -2.512 -12.276
  223    HG   LEU  28           HG       LEU  28  -2.262  -1.066 -10.243
  224   HD11  LEU  28          1HD1      LEU  28  -0.499  -3.032  -8.790
  225   HD12  LEU  28          2HD1      LEU  28  -2.224  -2.754  -8.526
  226   HD13  LEU  28          3HD1      LEU  28  -1.061  -1.484  -8.152
  227   HD21  LEU  28          3HD2      LEU  28   0.608  -1.581 -10.934
  228   HD22  LEU  28          1HD2      LEU  28   0.091  -0.261  -9.902
  229   HD23  LEU  28          2HD2      LEU  28  -0.460  -0.339 -11.567
  230    H    ASP  29           H        ASP  29  -4.606  -2.020  -9.803
  231    HA   ASP  29           HA       ASP  29  -4.904   0.475 -11.278
  232    HB2  ASP  29           2HB      ASP  29  -6.901  -1.043 -11.915
  233    HB3  ASP  29           1HB      ASP  29  -7.376  -0.972 -10.217
  234    H    ASP  30           H        ASP  30  -6.195   2.040  -9.691
  235    HA   ASP  30           HA       ASP  30  -5.108   2.123  -7.121
  236    HB2  ASP  30           2HB      ASP  30  -5.903   4.183  -8.062
  237    HB3  ASP  30           1HB      ASP  30  -7.481   3.502  -8.414
  238    H    GLN  31           H        GLN  31  -8.245   0.940  -8.286
  239    HA   GLN  31           HA       GLN  31  -8.969   0.124  -5.522
  240    HB2  GLN  31           2HB      GLN  31 -11.340   0.187  -6.383
  241    HB3  GLN  31           1HB      GLN  31 -10.505   1.733  -6.320
  242    HG2  GLN  31           2HG      GLN  31 -10.022   1.485  -8.776
  243    HG3  GLN  31           1HG      GLN  31 -11.084   0.071  -8.775
  244   HE21  GLN  31          1HE2      GLN  31 -11.353   2.607 -10.221
  245   HE22  GLN  31          2HE2      GLN  31 -12.873   3.281  -9.752
  246    H    THR  32           H        THR  32  -7.682  -1.330  -8.119
  247    HA   THR  32           HA       THR  32  -9.093  -3.820  -8.069
  248    HB   THR  32           HB       THR  32  -6.183  -3.262  -8.778
  249    HG1  THR  32           HG1      THR  32  -6.938  -3.417 -10.890
  250   HG21  THR  32          3HG2      THR  32  -6.398  -5.643  -8.112
  251   HG22  THR  32          1HG2      THR  32  -6.135  -5.496  -9.848
  252   HG23  THR  32          2HG2      THR  32  -7.753  -5.836  -9.229
  253    HA   PRO  33           HA       PRO  33  -7.907  -4.884  -3.812
  254    HB2  PRO  33           2HB      PRO  33  -8.861  -7.493  -3.818
  255    HB3  PRO  33           1HB      PRO  33  -9.879  -6.055  -3.598
  256    HG2  PRO  33           2HG      PRO  33  -9.420  -7.669  -6.067
  257    HG3  PRO  33           1HG      PRO  33 -10.926  -6.966  -5.435
  258    HD2  PRO  33           2HD      PRO  33  -9.558  -5.812  -7.455
  259    HD3  PRO  33           1HD      PRO  33 -10.455  -4.849  -6.262
  260    H    LEU  34           H        LEU  34  -5.786  -5.076  -3.500
  261    HA   LEU  34           HA       LEU  34  -3.966  -6.570  -5.069
  262    HB2  LEU  34           2HB      LEU  34  -3.631  -5.257  -2.352
  263    HB3  LEU  34           1HB      LEU  34  -2.315  -6.020  -3.218
  264    HG   LEU  34           HG       LEU  34  -2.129  -3.639  -3.498
  265   HD11  LEU  34          1HD1      LEU  34  -2.128  -3.367  -5.931
  266   HD12  LEU  34          2HD1      LEU  34  -3.148  -4.798  -6.108
  267   HD13  LEU  34          3HD1      LEU  34  -1.507  -4.952  -5.474
  268   HD21  LEU  34          3HD2      LEU  34  -4.939  -3.579  -4.580
  269   HD22  LEU  34          1HD2      LEU  34  -3.820  -2.216  -4.527
  270   HD23  LEU  34          2HD2      LEU  34  -4.399  -2.940  -3.029
  271    H    LEU  35           H        LEU  35  -5.240  -7.223  -1.738
  272    HA   LEU  35           HA       LEU  35  -3.653  -9.585  -1.409
  273    HB2  LEU  35           2HB      LEU  35  -6.225  -8.899   0.040
  274    HB3  LEU  35           1HB      LEU  35  -5.172 -10.238   0.457
  275    HG   LEU  35           HG       LEU  35  -3.360  -8.258   0.658
  276   HD11  LEU  35          1HD1      LEU  35  -4.311  -6.242   1.617
  277   HD12  LEU  35          2HD1      LEU  35  -5.942  -6.835   1.295
  278   HD13  LEU  35          3HD1      LEU  35  -4.842  -6.483  -0.045
  279   HD21  LEU  35          3HD2      LEU  35  -3.875  -9.838   2.438
  280   HD22  LEU  35          1HD2      LEU  35  -5.344  -8.940   2.844
  281   HD23  LEU  35          2HD2      LEU  35  -3.756  -8.200   3.075
  282    H    GLU  36           H        GLU  36  -6.958  -9.107  -2.567
  283    HA   GLU  36           HA       GLU  36  -7.752 -11.793  -2.820
  284    HB2  GLU  36           2HB      GLU  36  -9.352  -9.909  -3.001
  285    HB3  GLU  36           1HB      GLU  36  -8.590  -9.384  -4.501
  286    HG2  GLU  36           2HG      GLU  36  -9.252 -11.554  -5.546
  287    HG3  GLU  36           1HG      GLU  36 -10.092 -11.982  -4.056
  288    H    TRP  37           H        TRP  37  -5.743  -9.723  -4.832
  289    HA   TRP  37           HA       TRP  37  -5.665 -11.717  -7.025
  290    HB2  TRP  37           2HB      TRP  37  -4.654  -8.862  -6.774
  291    HB3  TRP  37           1HB      TRP  37  -4.178  -9.896  -8.117
  292    HD1  TRP  37           HD1      TRP  37  -7.727  -9.265  -6.564
  293    HE1  TRP  37           HE1      TRP  37  -9.318  -8.634  -8.467
  294    HE3  TRP  37           HE3      TRP  37  -4.408  -9.353 -10.464
  295    HZ2  TRP  37           HZ2      TRP  37  -9.202  -8.221 -11.253
  296    HZ3  TRP  37           HZ3      TRP  37  -5.241  -8.826 -12.724
  297    HH2  TRP  37           HH2      TRP  37  -7.588  -8.273 -13.109
  298    H    GLY  38           H        GLY  38  -4.332 -11.720  -4.149
  299    HA2  GLY  38           2HA      GLY  38  -2.634 -12.925  -3.238
  300    HA3  GLY  38           1HA      GLY  38  -2.312 -13.587  -4.833
  301    H    ILE  39           H        ILE  39  -2.215 -10.171  -4.228
  302    HA   ILE  39           HA       ILE  39   0.562 -10.023  -5.070
  303    HB   ILE  39           HB       ILE  39  -1.591  -7.929  -4.560
  304   HG12  ILE  39          2HG1      ILE  39  -0.348  -8.928  -7.161
  305   HG13  ILE  39          1HG1      ILE  39  -1.947  -9.352  -6.575
  306   HG21  ILE  39          1HG2      ILE  39  -0.088  -6.249  -5.520
  307   HG22  ILE  39          2HG2      ILE  39   1.203  -7.446  -5.606
  308   HG23  ILE  39          3HG2      ILE  39   0.580  -6.934  -4.037
  309   HD11  ILE  39          3HD1      ILE  39  -2.627  -6.999  -6.831
  310   HD12  ILE  39          1HD1      ILE  39  -2.093  -7.732  -8.343
  311   HD13  ILE  39          2HD1      ILE  39  -1.025  -6.628  -7.476
  312    H    LEU  40           H        LEU  40  -1.444  -9.211  -2.249
  313    HA   LEU  40           HA       LEU  40   0.987  -8.740  -0.590
  314    HB2  LEU  40           2HB      LEU  40  -1.884  -7.979   0.061
  315    HB3  LEU  40           1HB      LEU  40  -0.434  -7.478   0.915
  316    HG   LEU  40           HG       LEU  40  -1.295  -6.606  -1.863
  317   HD11  LEU  40          1HD1      LEU  40  -1.480  -4.370  -0.858
  318   HD12  LEU  40          2HD1      LEU  40  -1.117  -5.053   0.732
  319   HD13  LEU  40          3HD1      LEU  40  -2.585  -5.535  -0.134
  320   HD21  LEU  40          3HD2      LEU  40   1.237  -5.889  -0.368
  321   HD22  LEU  40          1HD2      LEU  40   0.649  -5.092  -1.833
  322   HD23  LEU  40          2HD2      LEU  40   1.100  -6.791  -1.885
  323    H    ASN  41           H        ASN  41   1.529 -10.508   0.524
  324    HA   ASN  41           HA       ASN  41  -0.517 -12.511   1.270
  325    HB2  ASN  41           2HB      ASN  41   2.460 -12.900   0.765
  326    HB3  ASN  41           1HB      ASN  41   1.400 -14.162   1.369
  327   HD21  ASN  41          1HD2      ASN  41   0.736 -11.815  -1.245
  328   HD22  ASN  41          2HD2      ASN  41   0.608 -12.991  -2.487
  329    H    SER  42           H        SER  42   2.766 -11.594   2.529
  330    HA   SER  42           HA       SER  42   1.758 -11.611   5.266
  331    HB2  SER  42           3HB      SER  42   1.871 -14.046   4.623
  332    HB3  SER  42           2HB      SER  42   3.595 -13.852   4.313
  333    H    MET  43           H        MET  43   4.870 -12.415   3.662
  334    HA   MET  43           HA       MET  43   6.277 -10.569   5.474
  335    HB2  MET  43           2HB      MET  43   7.332 -12.703   3.578
  336    HB3  MET  43           1HB      MET  43   8.332 -11.745   4.665
  337    HG2  MET  43           2HG      MET  43   6.146 -13.645   5.581
  338    HG3  MET  43           1HG      MET  43   7.853 -14.057   5.484
  339    HE1  MET  43           3HE      MET  43   5.912 -11.394   8.752
  340    HE2  MET  43           1HE      MET  43   5.048 -12.579   7.773
  341    HE3  MET  43           2HE      MET  43   5.599 -11.069   7.047
  342    H    ASN  44           H        ASN  44   5.137 -10.728   2.311
  343    HA   ASN  44           HA       ASN  44   7.004  -8.752   1.239
  344    HB2  ASN  44           2HB      ASN  44   5.900  -9.099  -0.883
  345    HB3  ASN  44           1HB      ASN  44   6.264 -10.662  -0.170
  346   HD21  ASN  44          1HD2      ASN  44   4.353 -10.080  -2.234
  347   HD22  ASN  44          2HD2      ASN  44   2.802 -10.552  -1.645
  348    H    ILE  45           H        ILE  45   3.741  -8.968   2.508
  349    HA   ILE  45           HA       ILE  45   2.788  -6.379   1.776
  350    HB   ILE  45           HB       ILE  45   1.416  -8.368   2.624
  351   HG12  ILE  45          2HG1      ILE  45   0.903  -5.656   3.931
  352   HG13  ILE  45          1HG1      ILE  45   0.335  -6.173   2.344
  353   HG21  ILE  45          1HG2      ILE  45   2.789  -8.894   4.604
  354   HG22  ILE  45          2HG2      ILE  45   1.101  -8.664   5.033
  355   HG23  ILE  45          3HG2      ILE  45   2.280  -7.392   5.374
  356   HD11  ILE  45          3HD1      ILE  45  -0.468  -7.382   4.988
  357   HD12  ILE  45          1HD1      ILE  45  -1.043  -7.892   3.395
  358   HD13  ILE  45          2HD1      ILE  45  -1.438  -6.279   4.001
  359    H    VAL  46           H        VAL  46   5.032  -7.496   4.093
  360    HA   VAL  46           HA       VAL  46   5.006  -5.347   5.983
  361    HB   VAL  46           HB       VAL  46   7.111  -7.495   5.435
  362   HG11  VAL  46          1HG1      VAL  46   7.886  -7.082   7.750
  363   HG12  VAL  46          2HG1      VAL  46   6.727  -5.759   7.899
  364   HG13  VAL  46          3HG1      VAL  46   8.059  -5.639   6.749
  365   HG21  VAL  46          3HG2      VAL  46   4.823  -7.479   7.441
  366   HG22  VAL  46          1HG2      VAL  46   6.037  -8.748   7.269
  367   HG23  VAL  46          2HG2      VAL  46   4.883  -8.441   5.963
  368    H    LYS  47           H        LYS  47   6.463  -5.886   2.893
  369    HA   LYS  47           HA       LYS  47   8.530  -3.949   2.909
  370    HB2  LYS  47           2HB      LYS  47   6.890  -5.219   0.701
  371    HB3  LYS  47           1HB      LYS  47   7.961  -3.884   0.319
  372    HG2  LYS  47           2HG      LYS  47   9.038  -6.040  -0.117
  373    HG3  LYS  47           1HG      LYS  47   9.887  -5.116   1.123
  374    HD2  LYS  47           2HD      LYS  47   8.659  -6.512   2.865
  375    HD3  LYS  47           1HD      LYS  47   8.077  -7.509   1.534
  376    HE2  LYS  47           2HE      LYS  47  10.035  -8.522   2.610
  377    HE3  LYS  47           1HE      LYS  47  10.405  -8.075   0.943
  378    HZ1  LYS  47           3HZ      LYS  47  11.099  -6.456   3.326
  379    HZ2  LYS  47           1HZ      LYS  47  11.530  -6.119   1.729
  380    HZ3  LYS  47           2HZ      LYS  47  12.164  -7.476   2.510
  381    H    LEU  48           H        LEU  48   5.066  -3.708   2.582
  382    HA   LEU  48           HA       LEU  48   4.945  -0.985   1.739
  383    HB2  LEU  48           2HB      LEU  48   2.884  -2.786   3.047
  384    HB3  LEU  48           1HB      LEU  48   2.539  -1.104   2.688
  385    HG   LEU  48           HG       LEU  48   1.597  -2.506   0.938
  386   HD11  LEU  48          1HD1      LEU  48   2.434  -0.295   0.239
  387   HD12  LEU  48          2HD1      LEU  48   2.586  -1.465  -1.068
  388   HD13  LEU  48          3HD1      LEU  48   4.013  -0.994  -0.143
  389   HD21  LEU  48          3HD2      LEU  48   2.934  -3.925  -0.549
  390   HD22  LEU  48          1HD2      LEU  48   3.067  -4.479   1.119
  391   HD23  LEU  48          2HD2      LEU  48   4.392  -3.571   0.383
  392    H    MET  49           H        MET  49   5.072  -2.546   4.949
  393    HA   MET  49           HA       MET  49   4.429  -0.374   6.609
  394    HB2  MET  49           2HB      MET  49   6.614  -2.434   7.167
  395    HB3  MET  49           1HB      MET  49   5.871  -1.385   8.363
  396    HG2  MET  49           2HG      MET  49   3.737  -2.554   8.080
  397    HG3  MET  49           1HG      MET  49   4.479  -3.607   6.860
  398    HE1  MET  49           3HE      MET  49   4.460  -6.190   9.783
  399    HE2  MET  49           1HE      MET  49   4.003  -5.841   8.117
  400    HE3  MET  49           2HE      MET  49   3.164  -5.044   9.451
  401    H    VAL  50           H        VAL  50   7.679  -1.387   5.567
  402    HA   VAL  50           HA       VAL  50   9.037   0.891   6.632
  403    HB   VAL  50           HB       VAL  50  10.176  -1.268   6.456
  404   HG11  VAL  50          1HG1      VAL  50  10.896  -2.228   4.298
  405   HG12  VAL  50          2HG1      VAL  50  10.003  -0.968   3.438
  406   HG13  VAL  50          3HG1      VAL  50   9.135  -2.155   4.418
  407   HG21  VAL  50          3HG2      VAL  50  11.516   0.825   4.704
  408   HG22  VAL  50          1HG2      VAL  50  12.335  -0.555   5.438
  409   HG23  VAL  50          2HG2      VAL  50  11.629   0.700   6.461
  410    H    TYR  51           H        TYR  51   7.571   0.203   3.517
  411    HA   TYR  51           HA       TYR  51   8.884   2.164   1.931
  412    HB2  TYR  51           2HB      TYR  51   7.371   0.232   1.101
  413    HB3  TYR  51           1HB      TYR  51   6.008   1.246   1.516
  414    HD1  TYR  51           HD1      TYR  51   9.116   1.193  -0.565
  415    HD2  TYR  51           HD2      TYR  51   5.224   2.885  -0.056
  416    HE1  TYR  51           HE1      TYR  51   9.293   2.280  -2.754
  417    HE2  TYR  51           HE2      TYR  51   5.409   3.964  -2.250
  418    HH   TYR  51           HH       TYR  51   7.654   3.150  -4.550
  419    H    ILE  52           H        ILE  52   5.763   2.146   3.552
  420    HA   ILE  52           HA       ILE  52   5.033   4.839   3.051
  421    HB   ILE  52           HB       ILE  52   3.983   2.804   5.060
  422   HG12  ILE  52          2HG1      ILE  52   2.745   3.615   2.391
  423   HG13  ILE  52          1HG1      ILE  52   3.895   2.291   2.515
  424   HG21  ILE  52          1HG2      ILE  52   3.347   5.068   5.774
  425   HG22  ILE  52          2HG2      ILE  52   1.938   4.173   5.200
  426   HG23  ILE  52          3HG2      ILE  52   2.685   5.395   4.169
  427   HD11  ILE  52          3HD1      ILE  52   1.634   1.491   2.464
  428   HD12  ILE  52          1HD1      ILE  52   1.229   2.435   3.899
  429   HD13  ILE  52          2HD1      ILE  52   2.400   1.112   4.005
  430    H    ARG  53           H        ARG  53   6.745   3.229   5.648
  431    HA   ARG  53           HA       ARG  53   6.880   5.334   7.524
  432    HB2  ARG  53           2HB      ARG  53   7.494   2.972   8.017
  433    HB3  ARG  53           1HB      ARG  53   8.928   3.150   7.010
  434    HG2  ARG  53           2HG      ARG  53   9.782   4.902   8.555
  435    HG3  ARG  53           1HG      ARG  53   8.359   4.683   9.574
  436    HD2  ARG  53           2HD      ARG  53   9.035   2.331   9.988
  437    HD3  ARG  53           1HD      ARG  53  10.475   2.583   8.987
  438    HE   ARG  53           HE       ARG  53  10.709   4.546  10.809
  439   HH11  ARG  53          1HH1      ARG  53  10.153   1.101  11.193
  440   HH12  ARG  53          2HH1      ARG  53  10.946   1.012  12.732
  441   HH21  ARG  53          1HH2      ARG  53  11.734   4.440  12.820
  442   HH22  ARG  53          2HH2      ARG  53  11.850   2.927  13.660
  443    H    ASP  54           H        ASP  54   8.637   4.782   4.538
  444    HA   ASP  54           HA       ASP  54  10.567   6.932   5.094
  445    HB2  ASP  54           2HB      ASP  54  11.264   4.753   3.976
  446    HB3  ASP  54           1HB      ASP  54  10.312   5.239   2.578
  447    H    GLU  55           H        GLU  55   8.223   6.197   2.478
  448    HA   GLU  55           HA       GLU  55   8.362   8.718   1.240
  449    HB2  GLU  55           2HB      GLU  55   6.470   6.374   1.025
  450    HB3  GLU  55           1HB      GLU  55   6.016   7.894   0.262
  451    HG2  GLU  55           2HG      GLU  55   7.108   6.286  -1.287
  452    HG3  GLU  55           1HG      GLU  55   7.922   7.842  -1.194
  453    H    MET  56           H        MET  56   5.624   7.423   3.205
  454    HA   MET  56           HA       MET  56   4.519  10.128   3.495
  455    HB2  MET  56           2HB      MET  56   3.454   7.364   4.126
  456    HB3  MET  56           1HB      MET  56   2.654   8.794   4.773
  457    HG2  MET  56           2HG      MET  56   1.586   7.994   2.711
  458    HG3  MET  56           1HG      MET  56   2.235   9.621   2.530
  459    HE1  MET  56           3HE      MET  56   3.908   5.836   0.504
  460    HE2  MET  56           1HE      MET  56   2.345   5.933   1.315
  461    HE3  MET  56           2HE      MET  56   3.835   5.971   2.260
  462    H    GLY  57           H        GLY  57   6.703   8.211   5.169
  463    HA2  GLY  57           2HA      GLY  57   7.910   8.740   7.053
  464    HA3  GLY  57           1HA      GLY  57   6.930  10.181   7.249
  465    H    VAL  58           H        VAL  58   5.329   7.077   7.067
  466    HA   VAL  58           HA       VAL  58   5.059   6.942  10.009
  467    HB   VAL  58           HB       VAL  58   3.162   8.306   9.327
  468   HG11  VAL  58          1HG1      VAL  58   1.428   7.526   7.743
  469   HG12  VAL  58          2HG1      VAL  58   2.420   6.110   7.370
  470   HG13  VAL  58          3HG1      VAL  58   2.998   7.728   6.958
  471   HG21  VAL  58          3HG2      VAL  58   1.299   6.966  10.202
  472   HG22  VAL  58          1HG2      VAL  58   2.770   6.646  11.122
  473   HG23  VAL  58          2HG2      VAL  58   2.211   5.483   9.917
  474    H    SER  59           H        SER  59   5.304   4.898  10.710
  475    HA   SER  59           HA       SER  59   5.401   2.655   8.885
  476    HB2  SER  59           2HB      SER  59   6.056   1.407  10.991
  477    HB3  SER  59           1HB      SER  59   7.073   2.801  10.633
  478    HG   SER  59           HG       SER  59   4.899   2.797  12.468
  479    H    ILE  60           H        ILE  60   3.826   1.154   8.571
  480    HA   ILE  60           HA       ILE  60   1.310   1.166   9.994
  481    HB   ILE  60           HB       ILE  60   2.409  -0.965   8.100
  482   HG12  ILE  60          2HG1      ILE  60   2.129   1.323   7.017
  483   HG13  ILE  60          1HG1      ILE  60   1.171   0.040   6.286
  484   HG21  ILE  60          1HG2      ILE  60  -0.421  -0.520   9.131
  485   HG22  ILE  60          2HG2      ILE  60   0.650  -1.866   9.524
  486   HG23  ILE  60          3HG2      ILE  60   0.036  -1.684   7.886
  487   HD11  ILE  60          3HD1      ILE  60  -0.823   0.856   7.466
  488   HD12  ILE  60          1HD1      ILE  60  -0.096   2.103   6.453
  489   HD13  ILE  60          2HD1      ILE  60   0.144   2.140   8.197
  490    HA   PRO  61           HA       PRO  61   3.050  -1.664  13.167
  491    HB2  PRO  61           2HB      PRO  61   0.922  -1.557  14.904
  492    HB3  PRO  61           1HB      PRO  61   2.130  -0.259  14.797
  493    HG2  PRO  61           2HG      PRO  61  -0.601  -0.385  13.576
  494    HG3  PRO  61           1HG      PRO  61   0.207   0.969  14.399
  495    HD2  PRO  61           2HD      PRO  61   0.063   0.741  11.677
  496    HD3  PRO  61           1HD      PRO  61   1.396   1.574  12.506
  497    H    SER  62           H        SER  62   2.274  -3.696  14.157
  498    HA   SER  62           HA       SER  62   1.461  -5.478  12.124
  499    HB2  SER  62           2HB      SER  62   1.580  -7.178  14.061
  500    HB3  SER  62           1HB      SER  62   3.051  -6.274  13.703
  501    HG   SER  62           HG       SER  62   2.943  -5.887  15.785
  502    H    THR  63           H        THR  63  -0.362  -3.833  14.611
  503    HA   THR  63           HA       THR  63  -2.679  -5.544  14.565
  504    HB   THR  63           HB       THR  63  -2.158  -4.199  16.550
  505    HG1  THR  63           HG1      THR  63  -4.597  -4.199  15.319
  506   HG21  THR  63          3HG2      THR  63  -1.198  -2.211  15.463
  507   HG22  THR  63          1HG2      THR  63  -2.483  -1.762  16.588
  508   HG23  THR  63          2HG2      THR  63  -2.795  -1.764  14.853
  509    H    HIS  64           H        HIS  64  -1.546  -2.973  12.531
  510    HA   HIS  64           HA       HIS  64  -4.182  -2.479  11.314
  511    HB2  HIS  64           2HB      HIS  64  -1.466  -1.181  10.968
  512    HB3  HIS  64           1HB      HIS  64  -2.747  -0.912   9.790
  513    HD1  HIS  64           HD1      HIS  64  -2.393  -0.660  13.565
  514    HD2  HIS  64           HD2      HIS  64  -4.237   1.262  10.387
  515    HE1  HIS  64           HE1      HIS  64  -3.536   1.322  14.565
  516    HE2  HIS  64           HE2      HIS  64  -4.768   2.402  12.650
  517    H    ILE  65           H        ILE  65  -1.867  -4.819  10.994
  518    HA   ILE  65           HA       ILE  65  -1.854  -5.071   8.121
  519    HB   ILE  65           HB       ILE  65  -1.068  -7.173  10.191
  520   HG12  ILE  65          2HG1      ILE  65   0.311  -5.211  10.557
  521   HG13  ILE  65          1HG1      ILE  65   1.295  -6.395   9.704
  522   HG21  ILE  65          1HG2      ILE  65   0.250  -8.171   8.329
  523   HG22  ILE  65          2HG2      ILE  65  -0.419  -6.969   7.223
  524   HG23  ILE  65          3HG2      ILE  65  -1.480  -8.156   7.985
  525   HD11  ILE  65          3HD1      ILE  65  -0.070  -4.012   8.461
  526   HD12  ILE  65          1HD1      ILE  65   0.955  -5.175   7.615
  527   HD13  ILE  65          2HD1      ILE  65   1.640  -4.135   8.872
  528    H    THR  66           H        THR  66  -3.915  -5.150   7.447
  529    HA   THR  66           HA       THR  66  -5.327  -7.654   7.820
  530    HB   THR  66           HB       THR  66  -6.368  -6.325   9.586
  531    HG1  THR  66           HG1      THR  66  -8.390  -6.784   9.004
  532   HG21  THR  66          3HG2      THR  66  -5.784  -4.064   8.785
  533   HG22  THR  66          1HG2      THR  66  -7.498  -4.190   9.184
  534   HG23  THR  66          2HG2      THR  66  -6.985  -4.208   7.494
  535    H    GLY  67           H        GLY  67  -6.988  -7.961   6.215
  536    HA2  GLY  67           2HA      GLY  67  -6.241  -7.297   3.604
  537    HA3  GLY  67           1HA      GLY  67  -7.781  -7.989   4.091
  538    H    LYS  68           H        LYS  68  -8.536  -5.806   5.801
  539    HA   LYS  68           HA       LYS  68 -10.001  -4.254   3.936
  540    HB2  LYS  68           2HB      LYS  68 -10.874  -4.828   6.125
  541    HB3  LYS  68           1HB      LYS  68  -9.541  -4.007   6.927
  542    HG2  LYS  68           2HG      LYS  68 -10.372  -1.837   6.103
  543    HG3  LYS  68           1HG      LYS  68 -11.723  -2.654   5.305
  544    HD2  LYS  68           2HD      LYS  68 -12.383  -1.657   7.486
  545    HD3  LYS  68           1HD      LYS  68 -12.588  -3.410   7.471
  546    HE2  LYS  68           2HE      LYS  68 -10.480  -3.674   8.728
  547    HE3  LYS  68           1HE      LYS  68 -10.237  -1.929   8.703
  548    HZ1  LYS  68           3HZ      LYS  68 -12.242  -1.668  10.024
  549    HZ2  LYS  68           1HZ      LYS  68 -11.137  -2.681  10.804
  550    HZ3  LYS  68           2HZ      LYS  68 -12.483  -3.340  10.028
  551    H    TYR  69           H        TYR  69  -7.173  -3.408   5.969
  552    HA   TYR  69           HA       TYR  69  -7.233  -0.618   5.101
  553    HB2  TYR  69           2HB      TYR  69  -5.440  -2.084   7.058
  554    HB3  TYR  69           1HB      TYR  69  -5.215  -0.388   6.629
  555    HD1  TYR  69           HD2      TYR  69  -8.316   0.232   6.469
  556    HD2  TYR  69           HD1      TYR  69  -5.867  -1.626   9.441
  557    HE1  TYR  69           HE2      TYR  69  -9.898   0.929   8.195
  558    HE2  TYR  69           HE1      TYR  69  -7.459  -0.923  11.169
  559    HH   TYR  69           HH       TYR  69  -9.216   0.738  11.534
  560    H    PHE  70           H        PHE  70  -5.771  -3.488   4.058
  561    HA   PHE  70           HA       PHE  70  -3.863  -1.999   2.331
  562    HB2  PHE  70           2HB      PHE  70  -3.826  -4.858   3.343
  563    HB3  PHE  70           1HB      PHE  70  -2.834  -4.336   1.990
  564    HD1  PHE  70           HD2      PHE  70  -3.366  -3.946   5.643
  565    HD2  PHE  70           HD1      PHE  70  -0.858  -2.993   2.313
  566    HE1  PHE  70           HE2      PHE  70  -1.597  -3.203   7.169
  567    HE2  PHE  70           HE1      PHE  70   0.900  -2.248   3.854
  568    HZ   PHE  70           HZ       PHE  70   0.535  -2.352   6.277
  569    H    LYS  71           H        LYS  71  -6.874  -2.801   2.152
  570    HA   LYS  71           HA       LYS  71  -7.349  -4.851   0.382
  571    HB2  LYS  71           2HB      LYS  71  -8.904  -2.918   1.721
  572    HB3  LYS  71           1HB      LYS  71  -9.272  -2.614   0.036
  573    HG2  LYS  71           2HG      LYS  71  -9.474  -5.372   1.289
  574    HG3  LYS  71           1HG      LYS  71 -10.819  -4.230   1.293
  575    HD2  LYS  71           2HD      LYS  71  -9.423  -5.189  -1.232
  576    HD3  LYS  71           1HD      LYS  71 -10.878  -5.932  -0.569
  577    HE2  LYS  71           2HE      LYS  71 -12.196  -4.022  -0.999
  578    HE3  LYS  71           1HE      LYS  71 -10.790  -2.976  -1.199
  579    HZ1  LYS  71           3HZ      LYS  71 -11.479  -5.184  -3.048
  580    HZ2  LYS  71           1HZ      LYS  71 -10.283  -4.001  -3.254
  581    HZ3  LYS  71           2HZ      LYS  71 -11.918  -3.570  -3.284
  582    H    ASP  72           H        ASP  72  -6.736  -1.490  -0.295
  583    HA   ASP  72           HA       ASP  72  -6.155  -1.989  -3.107
  584    HB2  ASP  72           2HB      ASP  72  -8.111   0.215  -2.224
  585    HB3  ASP  72           1HB      ASP  72  -7.612  -0.127  -3.870
  586    H    LEU  73           H        LEU  73  -5.429   0.214  -4.048
  587    HA   LEU  73           HA       LEU  73  -3.437   1.522  -2.545
  588    HB2  LEU  73           2HB      LEU  73  -3.870   1.462  -5.141
  589    HB3  LEU  73           1HB      LEU  73  -4.939   2.808  -4.839
  590    HG   LEU  73           HG       LEU  73  -1.948   2.715  -4.898
  591   HD11  LEU  73          1HD1      LEU  73  -2.199   4.902  -5.964
  592   HD12  LEU  73          2HD1      LEU  73  -3.935   4.877  -5.642
  593   HD13  LEU  73          3HD1      LEU  73  -3.220   3.692  -6.735
  594   HD21  LEU  73          3HD2      LEU  73  -3.318   4.735  -3.095
  595   HD22  LEU  73          1HD2      LEU  73  -1.603   4.696  -3.519
  596   HD23  LEU  73          2HD2      LEU  73  -2.299   3.404  -2.546
  597    H    ASN  74           H        ASN  74  -6.804   2.475  -3.408
  598    HA   ASN  74           HA       ASN  74  -6.907   4.880  -1.953
  599    HB2  ASN  74           2HB      ASN  74  -9.391   4.697  -2.088
  600    HB3  ASN  74           1HB      ASN  74  -8.602   4.413  -3.630
  601   HD21  ASN  74          1HD2      ASN  74  -8.782   2.446  -4.612
  602   HD22  ASN  74          2HD2      ASN  74  -9.800   1.177  -4.021
  603    H    ALA  75           H        ALA  75  -7.534   1.555  -0.901
  604    HA   ALA  75           HA       ALA  75  -8.670   2.138   1.638
  605    HB1  ALA  75           3HB      ALA  75  -8.830  -0.072   0.602
  606    HB2  ALA  75           1HB      ALA  75  -8.133  -0.186   2.219
  607    HB3  ALA  75           2HB      ALA  75  -7.093  -0.307   0.795
  608    H    ILE  76           H        ILE  76  -5.302   1.420   0.707
  609    HA   ILE  76           HA       ILE  76  -4.051   1.835   3.214
  610    HB   ILE  76           HB       ILE  76  -2.966   2.117   0.384
  611   HG12  ILE  76          2HG1      ILE  76  -2.561  -0.079   2.451
  612   HG13  ILE  76          1HG1      ILE  76  -3.723  -0.174   1.128
  613   HG21  ILE  76          1HG2      ILE  76  -1.358   2.127   2.977
  614   HG22  ILE  76          2HG2      ILE  76  -1.568   3.499   1.890
  615   HG23  ILE  76          3HG2      ILE  76  -0.677   2.081   1.344
  616   HD11  ILE  76          3HD1      ILE  76  -0.728  -0.021   0.881
  617   HD12  ILE  76          1HD1      ILE  76  -1.869  -0.074  -0.470
  618   HD13  ILE  76          2HD1      ILE  76  -1.749  -1.443   0.637
  619    H    SER  77           H        SER  77  -4.934   4.000   0.608
  620    HA   SER  77           HA       SER  77  -3.537   6.288   1.551
  621    HB2  SER  77           2HB      SER  77  -4.285   5.921  -0.828
  622    HB3  SER  77           1HB      SER  77  -5.948   6.220  -0.306
  623    HG   SER  77           HG       SER  77  -3.789   8.018   0.044
  624    H    ARG  78           H        ARG  78  -6.716   4.946   2.215
  625    HA   ARG  78           HA       ARG  78  -7.649   7.259   3.711
  626    HB2  ARG  78           2HB      ARG  78  -8.863   4.483   3.415
  627    HB3  ARG  78           1HB      ARG  78  -9.631   5.820   4.268
  628    HG2  ARG  78           2HG      ARG  78  -8.905   5.841   1.326
  629    HG3  ARG  78           1HG      ARG  78 -10.507   5.482   1.959
  630    HD2  ARG  78           2HD      ARG  78 -10.907   7.719   2.568
  631    HD3  ARG  78           1HD      ARG  78  -9.189   8.098   2.680
  632    HE   ARG  78           HE       ARG  78  -9.117   8.513   0.447
  633   HH11  ARG  78          1HH1      ARG  78 -12.259   7.156   1.131
  634   HH12  ARG  78          2HH1      ARG  78 -12.894   7.544  -0.433
  635   HH21  ARG  78          1HH2      ARG  78  -9.909   8.965  -1.577
  636   HH22  ARG  78          2HH2      ARG  78 -11.550   8.577  -1.981
  637    H    THR  79           H        THR  79  -5.877   4.353   4.408
  638    HA   THR  79           HA       THR  79  -6.374   4.478   7.291
  639    HB   THR  79           HB       THR  79  -4.386   2.766   5.750
  640    HG1  THR  79           HG1      THR  79  -6.160   1.808   5.122
  641   HG21  THR  79          3HG2      THR  79  -5.476   2.441   8.572
  642   HG22  THR  79          1HG2      THR  79  -3.822   2.905   8.164
  643   HG23  THR  79          2HG2      THR  79  -4.418   1.296   7.750
  644    H    VAL  80           H        VAL  80  -3.898   5.392   4.997
  645    HA   VAL  80           HA       VAL  80  -1.791   5.784   6.900
  646    HB   VAL  80           HB       VAL  80  -1.440   5.131   4.452
  647   HG11  VAL  80          1HG1      VAL  80  -3.002   6.730   3.419
  648   HG12  VAL  80          2HG1      VAL  80  -1.383   6.885   2.741
  649   HG13  VAL  80          3HG1      VAL  80  -1.968   8.081   3.902
  650   HG21  VAL  80          3HG2      VAL  80   0.082   7.580   5.433
  651   HG22  VAL  80          1HG2      VAL  80   0.625   6.460   4.178
  652   HG23  VAL  80          2HG2      VAL  80   0.429   5.898   5.839
  653    H    GLU  81           H        GLU  81  -4.233   7.834   5.380
  654    HA   GLU  81           HA       GLU  81  -3.259  10.365   6.229
  655    HB2  GLU  81           2HB      GLU  81  -5.581  11.177   5.848
  656    HB3  GLU  81           1HB      GLU  81  -5.003  10.189   4.507
  657    HG2  GLU  81           2HG      GLU  81  -6.318   8.302   5.211
  658    HG3  GLU  81           1HG      GLU  81  -6.728   9.073   6.736
  659    H    GLN  82           H        GLN  82  -5.245   7.898   7.772
  660    HA   GLN  82           HA       GLN  82  -6.149   9.374  10.032
  661    HB2  GLN  82           2HB      GLN  82  -5.795   6.364   9.709
  662    HB3  GLN  82           1HB      GLN  82  -6.684   7.137  11.018
  663    HG2  GLN  82           2HG      GLN  82  -7.410   7.255   8.083
  664    HG3  GLN  82           1HG      GLN  82  -8.157   6.210   9.286
  665   HE21  GLN  82          1HE2      GLN  82  -7.999   9.422   8.002
  666   HE22  GLN  82          2HE2      GLN  82  -9.289  10.089   8.935
  667    H    LEU  83           H        LEU  83  -3.444   7.158   9.517
  668    HA   LEU  83           HA       LEU  83  -2.391   7.230  12.152
  669    HB2  LEU  83           2HB      LEU  83  -0.996   6.637   9.524
  670    HB3  LEU  83           1HB      LEU  83  -0.335   6.292  11.118
  671    HG   LEU  83           HG       LEU  83  -2.845   5.018   9.956
  672   HD11  LEU  83          1HD1      LEU  83  -0.080   3.839  10.343
  673   HD12  LEU  83          2HD1      LEU  83  -0.833   4.255   8.800
  674   HD13  LEU  83          3HD1      LEU  83  -1.518   2.969   9.791
  675   HD21  LEU  83          3HD2      LEU  83  -2.720   3.491  11.902
  676   HD22  LEU  83          1HD2      LEU  83  -2.999   5.160  12.392
  677   HD23  LEU  83          2HD2      LEU  83  -1.392   4.448  12.564
  678    H    LYS  84           H        LYS  84  -1.812   9.237   9.310
  679    HA   LYS  84           HA       LYS  84   0.190  10.876  10.613
  680    HB2  LYS  84           2HB      LYS  84  -1.353  11.305   8.034
  681    HB3  LYS  84           1HB      LYS  84  -0.066  12.365   8.612
  682    HG2  LYS  84           2HG      LYS  84   1.492  10.366   8.546
  683    HG3  LYS  84           1HG      LYS  84   0.202   9.467   7.742
  684    HD2  LYS  84           2HD      LYS  84   1.555  11.994   6.718
  685    HD3  LYS  84           1HD      LYS  84   1.787  10.361   6.096
  686    HE2  LYS  84           2HE      LYS  84  -0.470  10.289   5.248
  687    HE3  LYS  84           1HE      LYS  84  -0.885  11.805   6.052
  688    HZ1  LYS  84           3HZ      LYS  84   0.808  12.899   4.638
  689    HZ2  LYS  84           1HZ      LYS  84  -0.480  12.242   3.767
  690    HZ3  LYS  84           2HZ      LYS  84   1.008  11.455   3.792
  691    H    ALA  85           H        ALA  85  -3.266  10.845  10.527
  692    HA   ALA  85           HA       ALA  85  -3.678  13.593  11.339
  693    HB1  ALA  85           3HB      ALA  85  -5.426  12.337  10.123
  694    HB2  ALA  85           1HB      ALA  85  -6.015  12.900  11.692
  695    HB3  ALA  85           2HB      ALA  85  -5.558  11.208  11.474
  696    H    GLU  86           H        GLU  86  -3.363  10.448  12.916
  697    HA   GLU  86           HA       GLU  86  -3.687  11.411  15.621
  698    HB2  GLU  86           2HB      GLU  86  -2.457   8.824  14.557
  699    HB3  GLU  86           1HB      GLU  86  -2.882   9.135  16.239
  700    HG2  GLU  86           2HG      GLU  86  -5.231   9.157  15.730
  701    HG3  GLU  86           1HG      GLU  86  -4.914   9.139  13.993
  702    H    SER  87           H        SER  87  -1.030  10.757  13.391
  703    HA   SER  87           HA       SER  87   1.131  11.336  15.178
  704    HB2  SER  87           2HB      SER  87   1.439  10.065  13.061
  705    HB3  SER  87           1HB      SER  87   1.085  11.526  12.142
  706    HG   SER  87           HG       SER  87   3.318  11.236  12.345
  707    H    ALA  88           H        ALA  88  -1.027  13.371  13.306
  708    HA   ALA  88           HA       ALA  88   0.406  15.796  13.529
  709    HB1  ALA  88           3HB      ALA  88  -1.717  16.937  13.187
  710    HB2  ALA  88           1HB      ALA  88  -2.606  15.440  13.474
  711    HB3  ALA  88           2HB      ALA  88  -1.552  15.583  12.065
  712    H    LEU  89           H        LEU  89   1.314  15.867  15.435
  713    HA   LEU  89           HA       LEU  89   0.347  15.514  18.009
  714    HB2  LEU  89           2HB      LEU  89   2.312  16.692  18.771
  715    HB3  LEU  89           1HB      LEU  89   2.737  15.648  17.435
  716    HG   LEU  89           HG       LEU  89   2.529  18.693  17.361
  717   HD11  LEU  89          1HD1      LEU  89   4.919  16.838  17.137
  718   HD12  LEU  89          2HD1      LEU  89   4.516  17.854  18.523
  719   HD13  LEU  89          3HD1      LEU  89   4.968  18.598  16.989
  720   HD21  LEU  89          3HD2      LEU  89   3.405  18.586  15.051
  721   HD22  LEU  89          1HD2      LEU  89   1.823  17.812  15.176
  722   HD23  LEU  89          2HD2      LEU  89   3.285  16.823  15.082
  723    H    GLU  90           H        GLU  90   0.042  18.223  15.850
  724    HA   GLU  90           HA       GLU  90  -0.881  20.215  17.583
  725    HB2  GLU  90           2HB      GLU  90  -1.693  19.779  14.670
  726    HB3  GLU  90           1HB      GLU  90  -1.793  21.294  15.562
  727    HG2  GLU  90           2HG      GLU  90   0.734  19.829  14.758
  728    HG3  GLU  90           1HG      GLU  90   0.113  21.312  14.046
  729   H281  4EM 101          2H28      PYA 142   3.489 -11.431   9.376
  730   H283  4EM 101          3H28      PYA 142   3.025 -13.098   9.703
  731   H303  4EM 101          3H30      PYA 142   0.639 -13.555  10.519
  732   H301  4EM 101          1H30      PYA 142  -0.038 -12.537   9.232
  733   H302  4EM 101          2H30      PYA 142  -0.420 -12.209  10.929
  734   H312  4EM 101          2H31      PYA 142   2.044  -9.554   9.959
  735   H313  4EM 101          3H31      PYA 142   0.786 -10.213   8.912
  736   H311  4EM 101          1H31      PYA 142   0.409  -9.817  10.595
  737    H32  4EM 101           H32      PYA 142   2.489 -12.580  12.045
  738    H33  4EM 101           H33      PYA 142   3.503 -10.603  12.797
  739    H36  4EM 101           H36      PYA 142   0.542 -13.077  13.089
  740   H373  4EM 101          3H37      PYA 142  -1.219 -13.082  14.477
  741   H372  4EM 101          2H37      PYA 142  -0.271 -11.921  15.392
  742   H382  4EM 101          2H38      PYA 142  -1.372 -10.066  14.237
  743   H383  4EM 101          3H38      PYA 142  -2.572 -11.106  14.999
  744    H41  4EM 101           H41      PYA 142  -1.321  -9.798  12.184
  745   H423  4EM 101          3H42      PYA 142  -1.543  -9.971   9.935
  746   H422  4EM 101          2H42      PYA 142  -3.128  -9.390  10.406
  747   H433  4EM 101          3H43      PYA 142  -4.077 -11.587  10.210
  748   H432  4EM 101          2H43      PYA 142  -2.470 -12.307   9.996
  749    H44  4EM 101           H44      PYA 142  -2.437 -11.668   7.975
  750    H49  4EM 101           H49      PYA 142  -2.499  -8.434   6.452
  751    H51  4EM 101           H51      PYA 142  -1.380  -9.650   4.416
  752    H50  4EM 101           H50      PYA 142  -2.463 -12.001   4.191
  753    H48  4EM 101           H48      PYA 142  -4.209 -12.197   6.060
  Start of MODEL   18
    1    H1   MET   1           1H       MET   1   3.963  17.243   1.226
    2    H2   MET   1           2H       MET   1   2.318  17.590   1.295
    3    H3   MET   1           3H       MET   1   3.108  17.573  -0.188
    4    HA   MET   1           HA       MET   1   3.560  15.219   0.047
    5    HB2  MET   1           2HB      MET   1   1.811  15.460   2.535
    6    HB3  MET   1           1HB      MET   1   2.411  13.949   1.861
    7    HG2  MET   1           2HG      MET   1   4.737  14.705   2.321
    8    HG3  MET   1           1HG      MET   1   4.085  16.166   3.074
    9    HE1  MET   1           3HE      MET   1   5.384  14.033   6.146
   10    HE2  MET   1           1HE      MET   1   5.500  15.581   5.310
   11    HE3  MET   1           2HE      MET   1   6.115  14.115   4.543
   12    H    ASP   2           H        ASP   2   2.474  15.469  -1.921
   13    HA   ASP   2           HA       ASP   2  -0.335  15.965  -2.151
   14    HB2  ASP   2           2HB      ASP   2   1.287  16.591  -3.930
   15    HB3  ASP   2           1HB      ASP   2   1.659  14.892  -4.199
   16    H    GLY   3           H        GLY   3  -1.989  14.501  -2.635
   17    HA2  GLY   3           2HA      GLY   3  -1.855  11.997  -1.306
   18    HA3  GLY   3           1HA      GLY   3  -3.225  12.638  -2.201
   19    H    GLU   4           H        GLU   4  -2.264  12.832  -4.776
   20    HA   GLU   4           HA       GLU   4  -2.385  10.083  -5.604
   21    HB2  GLU   4           2HB      GLU   4  -2.009  12.602  -7.262
   22    HB3  GLU   4           1HB      GLU   4  -2.291  10.995  -7.933
   23    HG2  GLU   4           2HG      GLU   4  -4.468  10.932  -6.629
   24    HG3  GLU   4           1HG      GLU   4  -4.195  12.626  -6.222
   25    H    GLU   5           H        GLU   5   0.163  12.390  -5.207
   26    HA   GLU   5           HA       GLU   5   2.321  11.243  -6.551
   27    HB2  GLU   5           2HB      GLU   5   2.494  13.407  -5.414
   28    HB3  GLU   5           1HB      GLU   5   2.183  12.655  -3.857
   29    HG2  GLU   5           2HG      GLU   5   4.507  13.173  -3.963
   30    HG3  GLU   5           1HG      GLU   5   4.342  11.422  -4.067
   31    H    VAL   6           H        VAL   6   1.280  10.716  -3.168
   32    HA   VAL   6           HA       VAL   6   3.251   8.687  -2.729
   33    HB   VAL   6           HB       VAL   6   2.334   8.430  -0.494
   34   HG11  VAL   6          1HG1      VAL   6   3.806  10.348  -0.897
   35   HG12  VAL   6          2HG1      VAL   6   2.588  10.759   0.314
   36   HG13  VAL   6          3HG1      VAL   6   2.416  11.347  -1.343
   37   HG21  VAL   6          3HG2      VAL   6   0.337   9.648   0.297
   38   HG22  VAL   6          1HG2      VAL   6  -0.091   8.523  -0.991
   39   HG23  VAL   6          2HG2      VAL   6   0.045  10.249  -1.339
   40    H    LYS   7           H        LYS   7  -0.223   8.638  -3.421
   41    HA   LYS   7           HA       LYS   7  -0.772   5.941  -2.989
   42    HB2  LYS   7           2HB      LYS   7  -1.984   7.928  -4.925
   43    HB3  LYS   7           1HB      LYS   7  -2.588   6.281  -4.791
   44    HG2  LYS   7           2HG      LYS   7  -3.064   6.697  -2.371
   45    HG3  LYS   7           1HG      LYS   7  -2.584   8.383  -2.605
   46    HD2  LYS   7           2HD      LYS   7  -4.906   6.933  -3.933
   47    HD3  LYS   7           1HD      LYS   7  -5.009   8.231  -2.747
   48    HE2  LYS   7           2HE      LYS   7  -4.023   9.796  -4.370
   49    HE3  LYS   7           1HE      LYS   7  -3.892   8.502  -5.559
   50    HZ1  LYS   7           3HZ      LYS   7  -5.816   9.729  -6.073
   51    HZ2  LYS   7           1HZ      LYS   7  -6.364   9.728  -4.477
   52    HZ3  LYS   7           2HZ      LYS   7  -6.372   8.299  -5.372
   53    H    GLU   8           H        GLU   8   0.297   7.490  -6.046
   54    HA   GLU   8           HA       GLU   8   0.221   5.098  -7.571
   55    HB2  GLU   8           2HB      GLU   8   1.409   6.306  -9.322
   56    HB3  GLU   8           1HB      GLU   8   0.125   7.310  -8.654
   57    HG2  GLU   8           2HG      GLU   8   1.762   8.605  -7.371
   58    HG3  GLU   8           1HG      GLU   8   3.060   7.552  -7.919
   59    H    LYS   9           H        LYS   9   2.768   6.599  -5.616
   60    HA   LYS   9           HA       LYS   9   4.878   4.916  -6.565
   61    HB2  LYS   9           2HB      LYS   9   4.653   6.603  -4.056
   62    HB3  LYS   9           1HB      LYS   9   6.119   5.739  -4.525
   63    HG2  LYS   9           2HG      LYS   9   6.234   7.052  -6.611
   64    HG3  LYS   9           1HG      LYS   9   4.761   7.916  -6.152
   65    HD2  LYS   9           2HD      LYS   9   7.413   7.959  -4.669
   66    HD3  LYS   9           1HD      LYS   9   6.749   9.257  -5.661
   67    HE2  LYS   9           2HE      LYS   9   4.816   9.414  -4.069
   68    HE3  LYS   9           1HE      LYS   9   5.611   8.215  -3.041
   69    HZ1  LYS   9           3HZ      LYS   9   7.460   9.707  -2.766
   70    HZ2  LYS   9           1HZ      LYS   9   6.030  10.486  -2.318
   71    HZ3  LYS   9           2HZ      LYS   9   6.759  10.846  -3.800
   72    H    ILE  10           H        ILE  10   2.498   4.578  -3.989
   73    HA   ILE  10           HA       ILE  10   3.602   2.243  -2.778
   74    HB   ILE  10           HB       ILE  10   0.657   3.004  -2.986
   75   HG12  ILE  10          2HG1      ILE  10   1.854   4.828  -1.907
   76   HG13  ILE  10          1HG1      ILE  10   0.936   3.968  -0.686
   77   HG21  ILE  10          1HG2      ILE  10   0.342   1.602  -0.961
   78   HG22  ILE  10          2HG2      ILE  10   2.039   1.116  -1.053
   79   HG23  ILE  10          3HG2      ILE  10   0.918   0.664  -2.339
   80   HD11  ILE  10          3HD1      ILE  10   3.114   4.595   0.148
   81   HD12  ILE  10          1HD1      ILE  10   3.907   3.745  -1.175
   82   HD13  ILE  10          2HD1      ILE  10   3.003   2.839   0.042
   83    H    ARG  11           H        ARG  11   1.371   2.800  -5.477
   84    HA   ARG  11           HA       ARG  11   0.887   0.062  -6.118
   85    HB2  ARG  11           2HB      ARG  11   0.628   2.523  -7.882
   86    HB3  ARG  11           1HB      ARG  11   0.032   0.922  -8.301
   87    HG2  ARG  11           2HG      ARG  11  -0.935   2.663  -6.020
   88    HG3  ARG  11           1HG      ARG  11  -1.774   2.359  -7.538
   89    HD2  ARG  11           2HD      ARG  11  -2.860   0.935  -6.052
   90    HD3  ARG  11           1HD      ARG  11  -1.704  -0.152  -6.820
   91    HE   ARG  11           HE       ARG  11  -1.120   1.118  -4.206
   92   HH11  ARG  11          1HH1      ARG  11  -1.534  -1.803  -6.096
   93   HH12  ARG  11          2HH1      ARG  11  -0.982  -2.848  -4.833
   94   HH21  ARG  11          1HH2      ARG  11  -0.403  -0.269  -2.540
   95   HH22  ARG  11          2HH2      ARG  11  -0.340  -1.976  -2.815
   96    H    ARG  12           H        ARG  12   3.303   2.409  -7.204
   97    HA   ARG  12           HA       ARG  12   4.323   0.846  -9.354
   98    HB2  ARG  12           2HB      ARG  12   5.097   3.415  -8.049
   99    HB3  ARG  12           1HB      ARG  12   6.446   2.519  -8.736
  100    HG2  ARG  12           2HG      ARG  12   5.544   4.138 -10.355
  101    HG3  ARG  12           1HG      ARG  12   5.368   2.478 -10.928
  102    HD2  ARG  12           2HD      ARG  12   2.981   2.531 -10.112
  103    HD3  ARG  12           1HD      ARG  12   3.197   4.247  -9.757
  104    HE   ARG  12           HE       ARG  12   3.835   3.515 -12.472
  105   HH11  ARG  12          1HH1      ARG  12   1.215   4.474 -10.327
  106   HH12  ARG  12          2HH1      ARG  12   0.218   5.054 -11.619
  107   HH21  ARG  12          1HH2      ARG  12   2.536   4.216 -14.135
  108   HH22  ARG  12          2HH2      ARG  12   0.979   4.907 -13.804
  109    H    TYR  13           H        TYR  13   5.388   1.425  -6.039
  110    HA   TYR  13           HA       TYR  13   7.619  -0.197  -5.885
  111    HB2  TYR  13           2HB      TYR  13   6.905   1.275  -4.061
  112    HB3  TYR  13           1HB      TYR  13   5.485   0.272  -3.764
  113    HD1  TYR  13           HD1      TYR  13   9.223  -0.249  -4.085
  114    HD2  TYR  13           HD2      TYR  13   5.674  -1.117  -1.870
  115    HE1  TYR  13           HE1      TYR  13  10.548  -1.541  -2.493
  116    HE2  TYR  13           HE2      TYR  13   7.013  -2.407  -0.270
  117    HH   TYR  13           HH       TYR  13   9.328  -3.667  -0.390
  118    H    ILE  14           H        ILE  14   4.223  -1.122  -5.583
  119    HA   ILE  14           HA       ILE  14   4.531  -3.854  -5.039
  120    HB   ILE  14           HB       ILE  14   2.316  -2.308  -6.426
  121   HG12  ILE  14          2HG1      ILE  14   2.670  -1.838  -4.007
  122   HG13  ILE  14          1HG1      ILE  14   1.105  -2.588  -4.305
  123   HG21  ILE  14          1HG2      ILE  14   2.273  -5.239  -5.657
  124   HG22  ILE  14          2HG2      ILE  14   2.162  -4.571  -7.288
  125   HG23  ILE  14          3HG2      ILE  14   0.855  -4.295  -6.136
  126   HD11  ILE  14          3HD1      ILE  14   2.018  -4.746  -3.537
  127   HD12  ILE  14          1HD1      ILE  14   2.132  -3.485  -2.310
  128   HD13  ILE  14          2HD1      ILE  14   3.564  -3.954  -3.221
  129    H    MET  15           H        MET  15   4.123  -2.202  -8.185
  130    HA   MET  15           HA       MET  15   4.237  -4.593  -9.743
  131    HB2  MET  15           2HB      MET  15   4.787  -1.761 -10.738
  132    HB3  MET  15           1HB      MET  15   4.219  -3.135 -11.681
  133    HG2  MET  15           2HG      MET  15   2.702  -1.575  -9.599
  134    HG3  MET  15           1HG      MET  15   2.364  -1.683 -11.321
  135    HE1  MET  15           3HE      MET  15   1.015  -3.608 -12.428
  136    HE2  MET  15           1HE      MET  15   0.828  -5.206 -11.704
  137    HE3  MET  15           2HE      MET  15   2.438  -4.611 -12.116
  138    H    GLU  16           H        GLU  16   6.719  -2.255  -8.787
  139    HA   GLU  16           HA       GLU  16   8.703  -3.157 -10.657
  140    HB2  GLU  16           2HB      GLU  16   9.012  -1.283  -8.289
  141    HB3  GLU  16           1HB      GLU  16  10.196  -1.528  -9.569
  142    HG2  GLU  16           2HG      GLU  16   7.482  -0.212  -9.782
  143    HG3  GLU  16           1HG      GLU  16   9.059   0.545  -9.948
  144    H    ASP  17           H        ASP  17   8.255  -3.308  -7.141
  145    HA   ASP  17           HA       ASP  17  10.603  -5.031  -6.809
  146    HB2  ASP  17           2HB      ASP  17  10.311  -3.132  -5.258
  147    HB3  ASP  17           1HB      ASP  17   8.737  -3.747  -4.772
  148    H    LEU  18           H        LEU  18   7.178  -5.095  -5.739
  149    HA   LEU  18           HA       LEU  18   7.366  -7.744  -4.716
  150    HB2  LEU  18           2HB      LEU  18   4.975  -5.943  -5.185
  151    HB3  LEU  18           1HB      LEU  18   4.822  -7.548  -4.496
  152    HG   LEU  18           HG       LEU  18   4.794  -6.055  -2.644
  153   HD11  LEU  18          1HD1      LEU  18   6.747  -6.669  -1.320
  154   HD12  LEU  18          2HD1      LEU  18   7.628  -7.138  -2.775
  155   HD13  LEU  18          3HD1      LEU  18   6.196  -8.042  -2.274
  156   HD21  LEU  18          3HD2      LEU  18   5.676  -4.019  -3.724
  157   HD22  LEU  18          1HD2      LEU  18   7.312  -4.685  -3.656
  158   HD23  LEU  18          2HD2      LEU  18   6.439  -4.311  -2.168
  159    H    ILE  19           H        ILE  19   6.154  -6.535  -7.828
  160    HA   ILE  19           HA       ILE  19   5.600  -9.260  -8.749
  161    HB   ILE  19           HB       ILE  19   5.297  -6.564 -10.123
  162   HG12  ILE  19          2HG1      ILE  19   2.897  -7.189 -10.318
  163   HG13  ILE  19          1HG1      ILE  19   3.222  -8.713  -9.532
  164   HG21  ILE  19          1HG2      ILE  19   4.929  -9.298 -11.399
  165   HG22  ILE  19          2HG2      ILE  19   6.153  -8.098 -11.821
  166   HG23  ILE  19          3HG2      ILE  19   4.448  -7.765 -12.136
  167   HD11  ILE  19          3HD1      ILE  19   2.110  -7.197  -8.056
  168   HD12  ILE  19          1HD1      ILE  19   3.378  -5.990  -8.279
  169   HD13  ILE  19          2HD1      ILE  19   3.739  -7.519  -7.465
  170    H    GLY  20           H        GLY  20   7.656  -6.548  -9.879
  171    HA2  GLY  20           2HA      GLY  20  10.128  -7.217 -10.024
  172    HA3  GLY  20           1HA      GLY  20   9.547  -8.498 -11.083
  173    HA   PRO  21           HA       PRO  21  10.683  -4.587 -13.545
  174    HB2  PRO  21           2HB      PRO  21  12.406  -5.836 -15.312
  175    HB3  PRO  21           1HB      PRO  21  12.925  -5.167 -13.754
  176    HG2  PRO  21           2HG      PRO  21  12.258  -8.013 -14.444
  177    HG3  PRO  21           1HG      PRO  21  13.634  -7.369 -13.513
  178    HD2  PRO  21           2HD      PRO  21  11.481  -8.424 -12.274
  179    HD3  PRO  21           1HD      PRO  21  12.359  -7.036 -11.587
  180    H    SER  22           H        SER  22   9.605  -7.821 -14.393
  181    HA   SER  22           HA       SER  22   8.369  -6.904 -16.906
  182    HB2  SER  22           2HB      SER  22   8.485  -9.694 -15.686
  183    HB3  SER  22           1HB      SER  22   7.919  -9.286 -17.307
  184    HG   SER  22           HG       SER  22  10.474  -8.422 -16.672
  185    H    ALA  23           H        ALA  23   7.257  -5.528 -14.983
  186    HA   ALA  23           HA       ALA  23   5.163  -6.667 -13.466
  187    HB1  ALA  23           3HB      ALA  23   5.508  -3.804 -14.392
  188    HB2  ALA  23           1HB      ALA  23   6.196  -4.506 -12.923
  189    HB3  ALA  23           2HB      ALA  23   4.446  -4.354 -13.092
  190    H    LYS  24           H        LYS  24   2.867  -6.237 -13.708
  191    HA   LYS  24           HA       LYS  24   1.941  -6.441 -16.520
  192    HB2  LYS  24           2HB      LYS  24   0.518  -7.631 -14.112
  193    HB3  LYS  24           1HB      LYS  24   0.242  -7.993 -15.810
  194    HG2  LYS  24           2HG      LYS  24   2.649  -8.797 -14.146
  195    HG3  LYS  24           1HG      LYS  24   1.336  -9.853 -14.673
  196    HD2  LYS  24           2HD      LYS  24   2.024  -9.529 -17.035
  197    HD3  LYS  24           1HD      LYS  24   3.327  -8.454 -16.509
  198    HE2  LYS  24           2HE      LYS  24   4.302 -10.362 -15.197
  199    HE3  LYS  24           1HE      LYS  24   3.053 -11.414 -15.865
  200    HZ1  LYS  24           3HZ      LYS  24   5.071 -11.647 -17.112
  201    HZ2  LYS  24           1HZ      LYS  24   5.154  -9.983 -17.386
  202    HZ3  LYS  24           2HZ      LYS  24   3.919 -10.889 -18.082
  203    H    GLU  25           H        GLU  25   1.605  -4.169 -16.649
  204    HA   GLU  25           HA       GLU  25   0.131  -2.673 -14.691
  205    HB2  GLU  25           2HB      GLU  25   0.584  -1.800 -17.571
  206    HB3  GLU  25           1HB      GLU  25   0.254  -0.786 -16.173
  207    HG2  GLU  25           2HG      GLU  25   2.497  -0.419 -16.243
  208    HG3  GLU  25           1HG      GLU  25   2.561  -1.919 -15.323
  209    H    ASP  26           H        ASP  26  -0.753  -4.695 -17.258
  210    HA   ASP  26           HA       ASP  26  -3.218  -3.730 -18.168
  211    HB2  ASP  26           2HB      ASP  26  -2.217  -6.604 -17.954
  212    HB3  ASP  26           1HB      ASP  26  -3.596  -6.082 -18.917
  213    H    GLU  27           H        GLU  27  -2.459  -5.039 -15.107
  214    HA   GLU  27           HA       GLU  27  -5.309  -5.644 -14.496
  215    HB2  GLU  27           2HB      GLU  27  -4.498  -7.406 -12.976
  216    HB3  GLU  27           1HB      GLU  27  -4.019  -7.710 -14.640
  217    HG2  GLU  27           2HG      GLU  27  -1.754  -6.853 -14.122
  218    HG3  GLU  27           1HG      GLU  27  -2.247  -6.601 -12.446
  219    H    LEU  28           H        LEU  28  -2.806  -3.559 -13.872
  220    HA   LEU  28           HA       LEU  28  -3.134  -3.257 -11.024
  221    HB2  LEU  28           2HB      LEU  28  -0.956  -2.858 -12.050
  222    HB3  LEU  28           1HB      LEU  28  -1.637  -1.593 -13.063
  223    HG   LEU  28           HG       LEU  28  -2.192  -0.313 -10.951
  224   HD11  LEU  28          1HD1      LEU  28  -2.209  -2.121  -9.323
  225   HD12  LEU  28          2HD1      LEU  28  -1.012  -0.914  -8.857
  226   HD13  LEU  28          3HD1      LEU  28  -0.491  -2.425  -9.603
  227   HD21  LEU  28          3HD2      LEU  28   0.107   0.482 -10.572
  228   HD22  LEU  28          1HD2      LEU  28  -0.287   0.314 -12.281
  229   HD23  LEU  28          2HD2      LEU  28   0.709  -0.903 -11.484
  230    H    ASP  29           H        ASP  29  -4.558  -1.970 -10.043
  231    HA   ASP  29           HA       ASP  29  -5.370   0.597 -11.111
  232    HB2  ASP  29           2HB      ASP  29  -7.431  -1.607 -10.664
  233    HB3  ASP  29           1HB      ASP  29  -7.878   0.072 -10.430
  234    H    ASP  30           H        ASP  30  -6.636   1.787  -9.544
  235    HA   ASP  30           HA       ASP  30  -5.663   1.668  -6.871
  236    HB2  ASP  30           2HB      ASP  30  -7.145   3.603  -6.496
  237    HB3  ASP  30           1HB      ASP  30  -6.217   3.799  -7.975
  238    H    GLN  31           H        GLN  31  -8.619   0.695  -8.510
  239    HA   GLN  31           HA       GLN  31  -9.996  -0.086  -6.059
  240    HB2  GLN  31           2HB      GLN  31 -10.810  -0.159  -8.987
  241    HB3  GLN  31           1HB      GLN  31 -11.844  -0.742  -7.683
  242    HG2  GLN  31           2HG      GLN  31 -11.857   1.522  -6.693
  243    HG3  GLN  31           1HG      GLN  31 -10.833   2.101  -8.008
  244   HE21  GLN  31          1HE2      GLN  31 -14.024   0.957  -7.145
  245   HE22  GLN  31          2HE2      GLN  31 -14.832   1.528  -8.559
  246    H    THR  32           H        THR  32  -7.836  -1.581  -8.283
  247    HA   THR  32           HA       THR  32  -8.752  -4.243  -8.260
  248    HB   THR  32           HB       THR  32  -5.893  -3.232  -8.367
  249    HG1  THR  32           HG1      THR  32  -6.323  -4.062 -10.641
  250   HG21  THR  32          3HG2      THR  32  -5.314  -5.492  -9.277
  251   HG22  THR  32          1HG2      THR  32  -6.948  -6.047  -8.867
  252   HG23  THR  32          2HG2      THR  32  -5.831  -5.559  -7.591
  253    HA   PRO  33           HA       PRO  33  -7.996  -4.972  -3.822
  254    HB2  PRO  33           2HB      PRO  33  -9.182  -7.431  -3.694
  255    HB3  PRO  33           1HB      PRO  33 -10.133  -5.930  -3.788
  256    HG2  PRO  33           2HG      PRO  33  -9.482  -7.891  -5.950
  257    HG3  PRO  33           1HG      PRO  33 -11.004  -7.036  -5.626
  258    HD2  PRO  33           2HD      PRO  33  -9.193  -6.255  -7.543
  259    HD3  PRO  33           1HD      PRO  33 -10.333  -5.146  -6.750
  260    H    LEU  34           H        LEU  34  -5.823  -5.285  -3.612
  261    HA   LEU  34           HA       LEU  34  -4.298  -7.095  -5.204
  262    HB2  LEU  34           2HB      LEU  34  -3.474  -5.647  -2.665
  263    HB3  LEU  34           1HB      LEU  34  -2.389  -6.468  -3.766
  264    HG   LEU  34           HG       LEU  34  -2.091  -4.205  -4.282
  265   HD11  LEU  34          1HD1      LEU  34  -2.967  -3.805  -6.531
  266   HD12  LEU  34          2HD1      LEU  34  -4.136  -5.112  -6.322
  267   HD13  LEU  34          3HD1      LEU  34  -2.406  -5.464  -6.344
  268   HD21  LEU  34          3HD2      LEU  34  -5.059  -3.733  -4.225
  269   HD22  LEU  34          1HD2      LEU  34  -3.819  -2.534  -4.601
  270   HD23  LEU  34          2HD2      LEU  34  -3.892  -3.249  -2.992
  271    H    LEU  35           H        LEU  35  -5.769  -7.345  -2.002
  272    HA   LEU  35           HA       LEU  35  -4.426  -9.638  -1.023
  273    HB2  LEU  35           2HB      LEU  35  -7.299  -8.776  -0.595
  274    HB3  LEU  35           1HB      LEU  35  -6.470  -9.992   0.363
  275    HG   LEU  35           HG       LEU  35  -5.630  -7.073   0.259
  276   HD11  LEU  35          1HD1      LEU  35  -7.338  -8.499   2.320
  277   HD12  LEU  35          2HD1      LEU  35  -7.902  -7.288   1.164
  278   HD13  LEU  35          3HD1      LEU  35  -6.752  -6.834   2.417
  279   HD21  LEU  35          3HD2      LEU  35  -4.878  -9.279   2.220
  280   HD22  LEU  35          1HD2      LEU  35  -4.329  -7.599   2.266
  281   HD23  LEU  35          2HD2      LEU  35  -3.830  -8.654   0.946
  282    H    GLU  36           H        GLU  36  -7.454  -9.286  -2.796
  283    HA   GLU  36           HA       GLU  36  -8.138 -12.031  -2.972
  284    HB2  GLU  36           2HB      GLU  36  -9.073  -9.552  -4.455
  285    HB3  GLU  36           1HB      GLU  36  -9.737 -11.141  -4.806
  286    HG2  GLU  36           2HG      GLU  36 -11.145  -9.743  -3.291
  287    HG3  GLU  36           1HG      GLU  36 -10.725 -11.327  -2.650
  288    H    TRP  37           H        TRP  37  -6.179  -9.901  -4.904
  289    HA   TRP  37           HA       TRP  37  -6.009 -11.809  -7.151
  290    HB2  TRP  37           2HB      TRP  37  -4.960  -8.984  -6.757
  291    HB3  TRP  37           1HB      TRP  37  -4.560  -9.960  -8.168
  292    HD1  TRP  37           HD1      TRP  37  -8.066  -9.494  -6.506
  293    HE1  TRP  37           HE1      TRP  37  -9.678  -8.613  -8.268
  294    HE3  TRP  37           HE3      TRP  37  -4.821  -9.041 -10.403
  295    HZ2  TRP  37           HZ2      TRP  37  -9.626  -7.842 -10.962
  296    HZ3  TRP  37           HZ3      TRP  37  -5.698  -8.239 -12.549
  297    HH2  TRP  37           HH2      TRP  37  -8.043  -7.647 -12.831
  298    H    GLY  38           H        GLY  38  -4.612 -11.728  -4.222
  299    HA2  GLY  38           2HA      GLY  38  -2.951 -13.081  -3.390
  300    HA3  GLY  38           1HA      GLY  38  -2.627 -13.644  -5.020
  301    H    ILE  39           H        ILE  39  -2.533 -10.272  -4.553
  302    HA   ILE  39           HA       ILE  39   0.325 -10.129  -5.064
  303    HB   ILE  39           HB       ILE  39  -1.817  -7.954  -4.904
  304   HG12  ILE  39          2HG1      ILE  39  -0.561  -9.273  -7.353
  305   HG13  ILE  39          1HG1      ILE  39  -2.196  -9.555  -6.787
  306   HG21  ILE  39          1HG2      ILE  39   1.033  -7.737  -5.921
  307   HG22  ILE  39          2HG2      ILE  39   0.416  -7.045  -4.420
  308   HG23  ILE  39          3HG2      ILE  39  -0.179  -6.455  -5.973
  309   HD11  ILE  39          3HD1      ILE  39  -1.110  -6.968  -7.890
  310   HD12  ILE  39          1HD1      ILE  39  -2.758  -7.227  -7.309
  311   HD13  ILE  39          2HD1      ILE  39  -2.168  -8.108  -8.720
  312    H    LEU  40           H        LEU  40  -2.026  -9.459  -2.535
  313    HA   LEU  40           HA       LEU  40   0.150  -9.166  -0.548
  314    HB2  LEU  40           2HB      LEU  40  -2.595  -7.829  -0.415
  315    HB3  LEU  40           1HB      LEU  40  -1.287  -7.662   0.748
  316    HG   LEU  40           HG       LEU  40  -1.251  -6.621  -2.106
  317   HD11  LEU  40          1HD1      LEU  40  -1.366  -4.389  -1.071
  318   HD12  LEU  40          2HD1      LEU  40  -1.575  -5.138   0.516
  319   HD13  LEU  40          3HD1      LEU  40  -2.801  -5.363  -0.742
  320   HD21  LEU  40          3HD2      LEU  40   0.804  -6.337   0.103
  321   HD22  LEU  40          1HD2      LEU  40   0.839  -5.493  -1.450
  322   HD23  LEU  40          2HD2      LEU  40   0.979  -7.248  -1.403
  323    H    ASN  41           H        ASN  41  -0.428  -9.998   1.549
  324    HA   ASN  41           HA       ASN  41  -2.729 -11.261   2.421
  325    HB2  ASN  41           2HB      ASN  41  -2.466 -12.968   0.644
  326    HB3  ASN  41           1HB      ASN  41  -0.791 -13.237   1.104
  327   HD21  ASN  41          1HD2      ASN  41  -1.111 -15.426   1.436
  328   HD22  ASN  41          2HD2      ASN  41  -1.976 -16.060   2.788
  329    H    SER  42           H        SER  42   0.733 -11.689   2.219
  330    HA   SER  42           HA       SER  42   1.313 -11.591   5.023
  331    HB2  SER  42           3HB      SER  42   0.277 -13.842   4.850
  332    HB3  SER  42           2HB      SER  42   1.345 -14.272   3.531
  333    H    MET  43           H        MET  43   3.800 -13.086   4.696
  334    HA   MET  43           HA       MET  43   5.852 -11.992   4.619
  335    HB2  MET  43           2HB      MET  43   7.054 -13.104   2.710
  336    HB3  MET  43           1HB      MET  43   6.070 -14.176   3.694
  337    HG2  MET  43           2HG      MET  43   5.178 -13.021   1.058
  338    HG3  MET  43           1HG      MET  43   5.940 -14.597   1.248
  339    HE1  MET  43           3HE      MET  43   3.171 -14.334  -0.225
  340    HE2  MET  43           1HE      MET  43   2.720 -12.929   0.736
  341    HE3  MET  43           2HE      MET  43   1.725 -14.386   0.792
  342    H    ASN  44           H        ASN  44   4.516 -11.398   1.325
  343    HA   ASN  44           HA       ASN  44   6.505  -9.375   0.804
  344    HB2  ASN  44           2HB      ASN  44   5.519  -9.251  -1.419
  345    HB3  ASN  44           1HB      ASN  44   5.803 -10.919  -0.952
  346   HD21  ASN  44          1HD2      ASN  44   4.024  -9.908  -2.997
  347   HD22  ASN  44          2HD2      ASN  44   2.445 -10.453  -2.594
  348    H    ILE  45           H        ILE  45   3.469  -9.291   2.280
  349    HA   ILE  45           HA       ILE  45   2.615  -6.657   1.527
  350    HB   ILE  45           HB       ILE  45   1.135  -8.593   2.362
  351   HG12  ILE  45          2HG1      ILE  45   0.770  -5.884   3.737
  352   HG13  ILE  45          1HG1      ILE  45   0.285  -6.250   2.083
  353   HG21  ILE  45          1HG2      ILE  45   2.086  -7.663   5.108
  354   HG22  ILE  45          2HG2      ILE  45   2.465  -9.218   4.359
  355   HG23  ILE  45          3HG2      ILE  45   0.798  -8.832   4.800
  356   HD11  ILE  45          3HD1      ILE  45  -1.312  -7.903   2.931
  357   HD12  ILE  45          1HD1      ILE  45  -1.610  -6.290   3.579
  358   HD13  ILE  45          2HD1      ILE  45  -0.826  -7.511   4.584
  359    H    VAL  46           H        VAL  46   4.887  -7.962   3.719
  360    HA   VAL  46           HA       VAL  46   4.866  -5.943   5.753
  361    HB   VAL  46           HB       VAL  46   6.998  -8.032   5.117
  362   HG11  VAL  46          1HG1      VAL  46   7.851  -6.286   6.617
  363   HG12  VAL  46          2HG1      VAL  46   7.638  -7.796   7.505
  364   HG13  VAL  46          3HG1      VAL  46   6.458  -6.493   7.683
  365   HG21  VAL  46          3HG2      VAL  46   5.864  -9.419   6.864
  366   HG22  VAL  46          1HG2      VAL  46   4.838  -9.133   5.456
  367   HG23  VAL  46          2HG2      VAL  46   4.568  -8.227   6.945
  368    H    LYS  47           H        LYS  47   6.297  -6.300   2.656
  369    HA   LYS  47           HA       LYS  47   8.468  -4.506   2.808
  370    HB2  LYS  47           2HB      LYS  47   6.778  -5.475   0.482
  371    HB3  LYS  47           1HB      LYS  47   8.041  -4.275   0.247
  372    HG2  LYS  47           2HG      LYS  47   8.937  -6.427  -0.324
  373    HG3  LYS  47           1HG      LYS  47   9.711  -5.883   1.169
  374    HD2  LYS  47           2HD      LYS  47   8.208  -7.343   2.479
  375    HD3  LYS  47           1HD      LYS  47   7.417  -7.861   0.996
  376    HE2  LYS  47           2HE      LYS  47   8.974  -9.572   1.685
  377    HE3  LYS  47           1HE      LYS  47   9.600  -8.807   0.224
  378    HZ1  LYS  47           3HZ      LYS  47  11.041  -7.457   1.645
  379    HZ2  LYS  47           1HZ      LYS  47  11.340  -9.107   1.811
  380    HZ3  LYS  47           2HZ      LYS  47  10.478  -8.283   3.004
  381    H    LEU  48           H        LEU  48   5.030  -4.039   2.493
  382    HA   LEU  48           HA       LEU  48   5.048  -1.308   1.656
  383    HB2  LEU  48           2HB      LEU  48   2.880  -3.015   2.932
  384    HB3  LEU  48           1HB      LEU  48   2.620  -1.331   2.515
  385    HG   LEU  48           HG       LEU  48   1.675  -2.736   0.772
  386   HD11  LEU  48          1HD1      LEU  48   4.200  -1.392  -0.273
  387   HD12  LEU  48          2HD1      LEU  48   2.658  -0.592   0.042
  388   HD13  LEU  48          3HD1      LEU  48   2.772  -1.811  -1.224
  389   HD21  LEU  48          3HD2      LEU  48   3.039  -4.771   1.070
  390   HD22  LEU  48          1HD2      LEU  48   4.432  -3.952   0.354
  391   HD23  LEU  48          2HD2      LEU  48   2.992  -4.270  -0.617
  392    H    MET  49           H        MET  49   5.027  -2.921   4.799
  393    HA   MET  49           HA       MET  49   4.308  -0.771   6.480
  394    HB2  MET  49           2HB      MET  49   6.305  -2.957   7.229
  395    HB3  MET  49           1HB      MET  49   5.309  -2.006   8.325
  396    HG2  MET  49           2HG      MET  49   3.302  -3.133   7.507
  397    HG3  MET  49           1HG      MET  49   4.278  -4.057   6.356
  398    HE1  MET  49           3HE      MET  49   2.435  -5.746   8.203
  399    HE2  MET  49           1HE      MET  49   3.534  -6.938   8.890
  400    HE3  MET  49           2HE      MET  49   3.660  -6.499   7.186
  401    H    VAL  50           H        VAL  50   7.507  -1.952   5.493
  402    HA   VAL  50           HA       VAL  50   8.976   0.127   6.820
  403    HB   VAL  50           HB       VAL  50   9.938  -2.136   6.503
  404   HG11  VAL  50          1HG1      VAL  50   9.070  -2.704   4.280
  405   HG12  VAL  50          2HG1      VAL  50  10.827  -2.852   4.295
  406   HG13  VAL  50          3HG1      VAL  50  10.071  -1.446   3.537
  407   HG21  VAL  50          3HG2      VAL  50  11.583   0.031   5.141
  408   HG22  VAL  50          1HG2      VAL  50  12.223  -1.463   5.824
  409   HG23  VAL  50          2HG2      VAL  50  11.486  -0.256   6.881
  410    H    TYR  51           H        TYR  51   7.629  -0.287   3.611
  411    HA   TYR  51           HA       TYR  51   9.213   1.559   2.167
  412    HB2  TYR  51           2HB      TYR  51   7.596  -0.093   1.108
  413    HB3  TYR  51           1HB      TYR  51   6.273   0.929   1.643
  414    HD1  TYR  51           HD1      TYR  51   9.457   1.126  -0.330
  415    HD2  TYR  51           HD2      TYR  51   5.501   2.646   0.178
  416    HE1  TYR  51           HE1      TYR  51   9.712   2.474  -2.366
  417    HE2  TYR  51           HE2      TYR  51   5.751   3.988  -1.858
  418    HH   TYR  51           HH       TYR  51   8.115   3.534  -4.119
  419    H    ILE  52           H        ILE  52   6.028   1.881   3.619
  420    HA   ILE  52           HA       ILE  52   5.596   4.617   3.055
  421    HB   ILE  52           HB       ILE  52   4.292   2.763   5.100
  422   HG12  ILE  52          2HG1      ILE  52   3.232   3.517   2.340
  423   HG13  ILE  52          1HG1      ILE  52   4.290   2.133   2.569
  424   HG21  ILE  52          1HG2      ILE  52   3.808   5.117   5.643
  425   HG22  ILE  52          2HG2      ILE  52   2.358   4.305   5.050
  426   HG23  ILE  52          3HG2      ILE  52   3.258   5.396   3.992
  427   HD11  ILE  52          3HD1      ILE  52   1.597   2.491   3.857
  428   HD12  ILE  52          1HD1      ILE  52   2.664   1.091   4.002
  429   HD13  ILE  52          2HD1      ILE  52   1.962   1.506   2.438
  430    H    ARG  53           H        ARG  53   7.072   2.929   5.749
  431    HA   ARG  53           HA       ARG  53   7.451   5.086   7.534
  432    HB2  ARG  53           2HB      ARG  53   7.756   2.743   8.207
  433    HB3  ARG  53           1HB      ARG  53   9.123   2.586   7.106
  434    HG2  ARG  53           2HG      ARG  53  10.371   4.275   8.438
  435    HG3  ARG  53           1HG      ARG  53   9.006   4.385   9.553
  436    HD2  ARG  53           2HD      ARG  53   9.291   1.965  10.085
  437    HD3  ARG  53           1HD      ARG  53  10.709   1.927   9.028
  438    HE   ARG  53           HE       ARG  53  11.798   3.489  10.526
  439   HH11  ARG  53          1HH1      ARG  53   8.905   1.974  11.832
  440   HH12  ARG  53          2HH1      ARG  53   9.361   2.256  13.482
  441   HH21  ARG  53          1HH2      ARG  53  12.353   3.887  12.693
  442   HH22  ARG  53          2HH2      ARG  53  11.305   3.339  13.966
  443    H    ASP  54           H        ASP  54   9.397   3.922   4.797
  444    HA   ASP  54           HA       ASP  54  11.549   5.841   5.235
  445    HB2  ASP  54           2HB      ASP  54  12.065   3.576   4.387
  446    HB3  ASP  54           1HB      ASP  54  11.038   3.844   2.986
  447    H    GLU  55           H        GLU  55   8.614   5.673   3.438
  448    HA   GLU  55           HA       GLU  55   9.360   7.576   1.365
  449    HB2  GLU  55           2HB      GLU  55   8.003   5.606   0.771
  450    HB3  GLU  55           1HB      GLU  55   6.779   6.063   1.947
  451    HG2  GLU  55           2HG      GLU  55   6.043   6.557  -0.317
  452    HG3  GLU  55           1HG      GLU  55   6.195   8.037   0.626
  453    H    MET  56           H        MET  56   6.719   7.356   3.747
  454    HA   MET  56           HA       MET  56   6.375  10.302   3.682
  455    HB2  MET  56           2HB      MET  56   4.463   7.999   4.205
  456    HB3  MET  56           1HB      MET  56   4.047   9.649   4.653
  457    HG2  MET  56           2HG      MET  56   3.983  10.369   2.417
  458    HG3  MET  56           1HG      MET  56   4.880   8.969   1.833
  459    HE1  MET  56           3HE      MET  56   3.819   6.900   0.878
  460    HE2  MET  56           1HE      MET  56   2.315   6.201   1.475
  461    HE3  MET  56           2HE      MET  56   3.694   6.381   2.561
  462    H    GLY  57           H        GLY  57   7.858   8.052   5.536
  463    HA2  GLY  57           2HA      GLY  57   8.938   8.346   7.548
  464    HA3  GLY  57           1HA      GLY  57   8.083   9.861   7.773
  465    H    VAL  58           H        VAL  58   6.057   7.163   7.108
  466    HA   VAL  58           HA       VAL  58   5.336   6.983   9.985
  467    HB   VAL  58           HB       VAL  58   3.752   8.520   8.950
  468   HG11  VAL  58          1HG1      VAL  58   3.964   7.897   6.580
  469   HG12  VAL  58          2HG1      VAL  58   2.268   7.887   7.072
  470   HG13  VAL  58          3HG1      VAL  58   3.143   6.365   6.896
  471   HG21  VAL  58          3HG2      VAL  58   1.622   7.381   9.439
  472   HG22  VAL  58          1HG2      VAL  58   2.849   6.975  10.643
  473   HG23  VAL  58          2HG2      VAL  58   2.436   5.816   9.376
  474    H    SER  59           H        SER  59   5.502   4.945  10.642
  475    HA   SER  59           HA       SER  59   5.492   2.653   8.896
  476    HB2  SER  59           2HB      SER  59   5.362   2.806  11.943
  477    HB3  SER  59           1HB      SER  59   5.801   1.384  10.990
  478    HG   SER  59           HG       SER  59   7.209   3.834  11.223
  479    H    ILE  60           H        ILE  60   3.698   1.355   8.416
  480    HA   ILE  60           HA       ILE  60   1.106   1.793   9.605
  481    HB   ILE  60           HB       ILE  60   2.034  -0.732   8.148
  482   HG12  ILE  60          2HG1      ILE  60   2.105   1.512   6.784
  483   HG13  ILE  60          1HG1      ILE  60   1.284   0.126   6.077
  484   HG21  ILE  60          1HG2      ILE  60  -0.760   0.296   8.833
  485   HG22  ILE  60          2HG2      ILE  60   0.047  -1.112   9.523
  486   HG23  ILE  60          3HG2      ILE  60  -0.420  -1.117   7.825
  487   HD11  ILE  60          3HD1      ILE  60  -0.055   2.428   7.487
  488   HD12  ILE  60          1HD1      ILE  60  -0.882   1.045   6.769
  489   HD13  ILE  60          2HD1      ILE  60   0.016   2.173   5.747
  490    HA   PRO  61           HA       PRO  61   2.592  -0.340  13.375
  491    HB2  PRO  61           2HB      PRO  61   0.256  -0.032  14.834
  492    HB3  PRO  61           1HB      PRO  61   1.469   1.249  14.650
  493    HG2  PRO  61           2HG      PRO  61  -1.095   0.859  13.154
  494    HG3  PRO  61           1HG      PRO  61  -0.397   2.351  13.826
  495    HD2  PRO  61           2HD      PRO  61  -0.206   1.755  11.202
  496    HD3  PRO  61           1HD      PRO  61   1.095   2.609  12.057
  497    H    SER  62           H        SER  62   1.991  -2.313  14.555
  498    HA   SER  62           HA       SER  62   1.201  -4.345  12.719
  499    HB2  SER  62           2HB      SER  62   1.581  -5.913  14.625
  500    HB3  SER  62           1HB      SER  62   2.930  -4.816  14.363
  501    HG   SER  62           HG       SER  62   2.506  -3.807  16.197
  502    H    THR  63           H        THR  63  -0.563  -2.532  15.102
  503    HA   THR  63           HA       THR  63  -2.887  -4.214  15.255
  504    HB   THR  63           HB       THR  63  -2.379  -2.616  17.040
  505    HG1  THR  63           HG1      THR  63  -4.712  -3.064  16.106
  506   HG21  THR  63          3HG2      THR  63  -1.367  -0.795  15.695
  507   HG22  THR  63          1HG2      THR  63  -2.640  -0.188  16.759
  508   HG23  THR  63          2HG2      THR  63  -2.958  -0.402  15.037
  509    H    HIS  64           H        HIS  64  -1.704  -1.965  12.940
  510    HA   HIS  64           HA       HIS  64  -4.285  -1.774  11.515
  511    HB2  HIS  64           2HB      HIS  64  -1.887   0.051  11.595
  512    HB3  HIS  64           1HB      HIS  64  -3.014   0.108  10.236
  513    HD1  HIS  64           HD1      HIS  64  -4.779  -0.649  13.370
  514    HD2  HIS  64           HD2      HIS  64  -3.584   2.753  11.297
  515    HE1  HIS  64           HE1      HIS  64  -6.207   1.210  14.247
  516    HE2  HIS  64           HE2      HIS  64  -5.512   3.244  12.949
  517    H    ILE  65           H        ILE  65  -1.648  -3.700  11.494
  518    HA   ILE  65           HA       ILE  65  -1.624  -4.205   8.642
  519    HB   ILE  65           HB       ILE  65  -0.799  -6.102  10.891
  520   HG12  ILE  65          2HG1      ILE  65   0.549  -4.093  11.086
  521   HG13  ILE  65          1HG1      ILE  65   1.551  -5.344  10.357
  522   HG21  ILE  65          1HG2      ILE  65   0.526  -7.252   9.134
  523   HG22  ILE  65          2HG2      ILE  65  -0.127  -6.148   7.920
  524   HG23  ILE  65          3HG2      ILE  65  -1.200  -7.268   8.766
  525   HD11  ILE  65          3HD1      ILE  65   1.863  -3.148   9.325
  526   HD12  ILE  65          1HD1      ILE  65   0.166  -3.130   8.851
  527   HD13  ILE  65          2HD1      ILE  65   1.257  -4.338   8.170
  528    H    THR  66           H        THR  66  -3.703  -4.466   7.970
  529    HA   THR  66           HA       THR  66  -4.938  -6.980   8.617
  530    HB   THR  66           HB       THR  66  -5.984  -5.776  10.395
  531    HG1  THR  66           HG1      THR  66  -7.590  -6.905   9.498
  532   HG21  THR  66          3HG2      THR  66  -6.672  -3.548   8.449
  533   HG22  THR  66          1HG2      THR  66  -5.435  -3.473   9.712
  534   HG23  THR  66          2HG2      THR  66  -7.136  -3.620  10.149
  535    H    GLY  67           H        GLY  67  -6.643  -7.542   7.203
  536    HA2  GLY  67           2HA      GLY  67  -6.167  -7.072   4.509
  537    HA3  GLY  67           1HA      GLY  67  -7.605  -7.830   5.173
  538    H    LYS  68           H        LYS  68  -8.743  -5.757   6.592
  539    HA   LYS  68           HA       LYS  68 -10.205  -4.374   4.642
  540    HB2  LYS  68           2HB      LYS  68 -11.127  -3.057   6.564
  541    HB3  LYS  68           1HB      LYS  68 -11.158  -4.801   6.808
  542    HG2  LYS  68           2HG      LYS  68  -9.102  -4.618   8.197
  543    HG3  LYS  68           1HG      LYS  68  -9.153  -2.866   8.003
  544    HD2  LYS  68           2HD      LYS  68 -11.327  -2.791   9.168
  545    HD3  LYS  68           1HD      LYS  68 -11.312  -4.552   9.324
  546    HE2  LYS  68           2HE      LYS  68  -9.233  -4.382  10.693
  547    HE3  LYS  68           1HE      LYS  68  -9.329  -2.623  10.590
  548    HZ1  LYS  68           3HZ      LYS  68 -10.216  -3.473  12.665
  549    HZ2  LYS  68           1HZ      LYS  68 -11.360  -4.393  11.831
  550    HZ3  LYS  68           2HZ      LYS  68 -11.425  -2.710  11.771
  551    H    TYR  69           H        TYR  69  -7.183  -3.526   6.100
  552    HA   TYR  69           HA       TYR  69  -7.267  -0.727   5.246
  553    HB2  TYR  69           2HB      TYR  69  -5.420  -2.339   7.019
  554    HB3  TYR  69           1HB      TYR  69  -4.865  -0.807   6.343
  555    HD1  TYR  69           HD2      TYR  69  -8.427  -1.346   7.376
  556    HD2  TYR  69           HD1      TYR  69  -4.651   0.321   8.477
  557    HE1  TYR  69           HE2      TYR  69  -9.509  -0.068   9.158
  558    HE2  TYR  69           HE1      TYR  69  -5.749   1.599  10.236
  559    HH   TYR  69           HH       TYR  69  -7.986   2.482  10.741
  560    H    PHE  70           H        PHE  70  -5.824  -3.760   4.307
  561    HA   PHE  70           HA       PHE  70  -4.203  -2.439   2.187
  562    HB2  PHE  70           2HB      PHE  70  -3.864  -5.116   3.604
  563    HB3  PHE  70           1HB      PHE  70  -2.956  -4.683   2.163
  564    HD1  PHE  70           HD1      PHE  70  -1.388  -2.691   2.240
  565    HD2  PHE  70           HD2      PHE  70  -3.151  -4.322   5.783
  566    HE1  PHE  70           HE1      PHE  70   0.334  -1.597   3.604
  567    HE2  PHE  70           HE2      PHE  70  -1.426  -3.221   7.137
  568    HZ   PHE  70           HZ       PHE  70   0.319  -1.857   6.051
  569    H    LYS  71           H        LYS  71  -7.151  -3.226   2.152
  570    HA   LYS  71           HA       LYS  71  -7.693  -5.368   0.456
  571    HB2  LYS  71           2HB      LYS  71  -9.030  -2.652   0.656
  572    HB3  LYS  71           1HB      LYS  71  -9.668  -3.946  -0.355
  573    HG2  LYS  71           2HG      LYS  71  -9.987  -5.354   1.614
  574    HG3  LYS  71           1HG      LYS  71  -9.295  -4.094   2.640
  575    HD2  LYS  71           2HD      LYS  71 -11.751  -4.089   2.751
  576    HD3  LYS  71           1HD      LYS  71 -11.140  -2.579   2.078
  577    HE2  LYS  71           2HE      LYS  71 -11.968  -4.795   0.219
  578    HE3  LYS  71           1HE      LYS  71 -13.209  -3.802   0.969
  579    HZ1  LYS  71           3HZ      LYS  71 -10.993  -2.824  -0.747
  580    HZ2  LYS  71           1HZ      LYS  71 -12.171  -1.853  -0.023
  581    HZ3  LYS  71           2HZ      LYS  71 -12.609  -2.979  -1.203
  582    H    ASP  72           H        ASP  72  -7.177  -2.017  -0.369
  583    HA   ASP  72           HA       ASP  72  -5.902  -2.482  -2.898
  584    HB2  ASP  72           2HB      ASP  72  -7.739  -1.116  -4.139
  585    HB3  ASP  72           1HB      ASP  72  -8.102  -2.797  -3.775
  586    H    LEU  73           H        LEU  73  -6.042  -0.056  -4.043
  587    HA   LEU  73           HA       LEU  73  -4.378   1.511  -2.357
  588    HB2  LEU  73           2HB      LEU  73  -4.170   1.480  -4.831
  589    HB3  LEU  73           1HB      LEU  73  -5.711   2.312  -4.959
  590    HG   LEU  73           HG       LEU  73  -4.719   4.274  -3.740
  591   HD11  LEU  73          1HD1      LEU  73  -2.262   4.394  -3.457
  592   HD12  LEU  73          2HD1      LEU  73  -2.120   2.712  -3.965
  593   HD13  LEU  73          3HD1      LEU  73  -2.971   3.119  -2.472
  594   HD21  LEU  73          3HD2      LEU  73  -4.814   4.314  -6.176
  595   HD22  LEU  73          1HD2      LEU  73  -3.283   3.442  -6.281
  596   HD23  LEU  73          2HD2      LEU  73  -3.326   5.078  -5.626
  597    H    ASN  74           H        ASN  74  -7.819   1.597  -3.082
  598    HA   ASN  74           HA       ASN  74  -8.330   4.234  -2.058
  599    HB2  ASN  74           2HB      ASN  74 -10.299   1.925  -2.278
  600    HB3  ASN  74           1HB      ASN  74 -10.691   3.638  -2.166
  601   HD21  ASN  74          1HD2      ASN  74  -8.519   4.373  -4.137
  602   HD22  ASN  74          2HD2      ASN  74  -9.152   3.896  -5.664
  603    H    ALA  75           H        ALA  75  -8.045   1.042  -0.638
  604    HA   ALA  75           HA       ALA  75  -9.021   1.765   1.980
  605    HB1  ALA  75           3HB      ALA  75  -9.059  -0.573   1.208
  606    HB2  ALA  75           1HB      ALA  75  -8.091  -0.416   2.679
  607    HB3  ALA  75           2HB      ALA  75  -7.297  -0.580   1.110
  608    H    ILE  76           H        ILE  76  -5.814   1.326   0.521
  609    HA   ILE  76           HA       ILE  76  -4.247   1.935   2.816
  610    HB   ILE  76           HB       ILE  76  -3.529   1.848  -0.143
  611   HG12  ILE  76          2HG1      ILE  76  -2.979  -0.106   2.130
  612   HG13  ILE  76          1HG1      ILE  76  -4.215  -0.322   0.894
  613   HG21  ILE  76          1HG2      ILE  76  -1.595   2.077   2.203
  614   HG22  ILE  76          2HG2      ILE  76  -1.913   3.341   1.013
  615   HG23  ILE  76          3HG2      ILE  76  -1.137   1.839   0.512
  616   HD11  ILE  76          3HD1      ILE  76  -2.302  -1.703   0.449
  617   HD12  ILE  76          1HD1      ILE  76  -1.231  -0.303   0.478
  618   HD13  ILE  76          2HD1      ILE  76  -2.439  -0.469  -0.805
  619    H    SER  77           H        SER  77  -5.616   3.982   0.278
  620    HA   SER  77           HA       SER  77  -4.062   6.318   0.780
  621    HB2  SER  77           2HB      SER  77  -5.973   7.522  -0.380
  622    HB3  SER  77           1HB      SER  77  -5.332   6.155  -1.292
  623    HG   SER  77           HG       SER  77  -7.832   6.527  -0.251
  624    H    ARG  78           H        ARG  78  -7.128   5.101   2.035
  625    HA   ARG  78           HA       ARG  78  -7.702   7.339   3.741
  626    HB2  ARG  78           2HB      ARG  78  -8.832   4.509   3.692
  627    HB3  ARG  78           1HB      ARG  78  -9.500   5.837   4.641
  628    HG2  ARG  78           2HG      ARG  78  -9.286   5.807   1.612
  629    HG3  ARG  78           1HG      ARG  78 -10.742   5.410   2.526
  630    HD2  ARG  78           2HD      ARG  78  -9.319   8.095   2.608
  631    HD3  ARG  78           1HD      ARG  78 -10.755   7.737   1.641
  632    HE   ARG  78           HE       ARG  78 -11.631   7.059   4.053
  633   HH11  ARG  78          1HH1      ARG  78  -9.874   9.950   3.120
  634   HH12  ARG  78          2HH1      ARG  78 -10.597  10.929   4.358
  635   HH21  ARG  78          1HH2      ARG  78 -12.538   8.352   5.682
  636   HH22  ARG  78          2HH2      ARG  78 -12.100  10.024   5.806
  637    H    THR  79           H        THR  79  -5.964   4.338   4.094
  638    HA   THR  79           HA       THR  79  -5.777   4.330   6.957
  639    HB   THR  79           HB       THR  79  -4.208   2.849   4.806
  640    HG1  THR  79           HG1      THR  79  -6.160   1.956   4.868
  641   HG21  THR  79          3HG2      THR  79  -3.377   1.361   6.625
  642   HG22  THR  79          1HG2      THR  79  -4.088   2.440   7.824
  643   HG23  THR  79          2HG2      THR  79  -2.765   3.009   6.804
  644    H    VAL  80           H        VAL  80  -3.628   5.296   4.326
  645    HA   VAL  80           HA       VAL  80  -1.379   5.760   6.021
  646    HB   VAL  80           HB       VAL  80  -1.280   5.034   3.580
  647   HG11  VAL  80          1HG1      VAL  80  -2.876   6.612   2.595
  648   HG12  VAL  80          2HG1      VAL  80  -1.301   6.754   1.815
  649   HG13  VAL  80          3HG1      VAL  80  -1.811   7.970   2.986
  650   HG21  VAL  80          3HG2      VAL  80   0.399   7.445   4.348
  651   HG22  VAL  80          1HG2      VAL  80   0.789   6.276   3.084
  652   HG23  VAL  80          2HG2      VAL  80   0.725   5.762   4.770
  653    H    GLU  81           H        GLU  81  -3.990   7.754   4.741
  654    HA   GLU  81           HA       GLU  81  -2.766  10.275   5.420
  655    HB2  GLU  81           2HB      GLU  81  -4.852  11.325   4.792
  656    HB3  GLU  81           1HB      GLU  81  -4.500  10.058   3.622
  657    HG2  GLU  81           2HG      GLU  81  -6.156   8.588   4.656
  658    HG3  GLU  81           1HG      GLU  81  -6.474   9.787   5.908
  659    H    GLN  82           H        GLN  82  -5.062   8.061   6.981
  660    HA   GLN  82           HA       GLN  82  -5.804   9.825   9.088
  661    HB2  GLN  82           2HB      GLN  82  -7.075   8.058  10.004
  662    HB3  GLN  82           1HB      GLN  82  -7.139   7.797   8.268
  663    HG2  GLN  82           2HG      GLN  82  -5.389   6.035   8.517
  664    HG3  GLN  82           1HG      GLN  82  -5.433   6.266  10.258
  665   HE21  GLN  82          1HE2      GLN  82  -8.230   6.235   8.060
  666   HE22  GLN  82          2HE2      GLN  82  -8.950   4.812   8.716
  667    H    LEU  83           H        LEU  83  -3.142   7.645   8.637
  668    HA   LEU  83           HA       LEU  83  -2.301   7.497  11.362
  669    HB2  LEU  83           2HB      LEU  83  -0.830   7.015   8.754
  670    HB3  LEU  83           1HB      LEU  83  -0.116   6.738  10.339
  671    HG   LEU  83           HG       LEU  83  -2.589   5.308   9.289
  672   HD11  LEU  83          1HD1      LEU  83  -0.568   4.657   8.051
  673   HD12  LEU  83          2HD1      LEU  83  -1.142   3.343   9.074
  674   HD13  LEU  83          3HD1      LEU  83   0.259   4.298   9.571
  675   HD21  LEU  83          3HD2      LEU  83  -0.965   4.876  11.824
  676   HD22  LEU  83          1HD2      LEU  83  -2.269   3.829  11.250
  677   HD23  LEU  83          2HD2      LEU  83  -2.619   5.487  11.726
  678    H    LYS  84           H        LYS  84  -1.202   9.437   8.574
  679    HA   LYS  84           HA       LYS  84   0.658  11.027  10.057
  680    HB2  LYS  84           2HB      LYS  84  -0.629  11.457   7.333
  681    HB3  LYS  84           1HB      LYS  84   0.623  12.514   7.988
  682    HG2  LYS  84           2HG      LYS  84   2.202  10.653   8.069
  683    HG3  LYS  84           1HG      LYS  84   0.964   9.542   7.493
  684    HD2  LYS  84           2HD      LYS  84   1.760  11.941   5.819
  685    HD3  LYS  84           1HD      LYS  84   2.749  10.480   5.809
  686    HE2  LYS  84           2HE      LYS  84   1.249  10.316   3.949
  687    HE3  LYS  84           1HE      LYS  84   0.670   9.190   5.174
  688    HZ1  LYS  84           3HZ      LYS  84  -0.991  10.817   5.815
  689    HZ2  LYS  84           1HZ      LYS  84  -1.137  10.403   4.184
  690    HZ3  LYS  84           2HZ      LYS  84  -0.446  11.877   4.622
  691    H    ALA  85           H        ALA  85  -2.735  11.161   9.680
  692    HA   ALA  85           HA       ALA  85  -3.038  13.877  10.628
  693    HB1  ALA  85           3HB      ALA  85  -5.105  11.686  10.324
  694    HB2  ALA  85           1HB      ALA  85  -4.682  12.889   9.098
  695    HB3  ALA  85           2HB      ALA  85  -5.429  13.397  10.614
  696    H    GLU  86           H        GLU  86  -3.601  10.606  12.043
  697    HA   GLU  86           HA       GLU  86  -4.480  11.754  14.575
  698    HB2  GLU  86           2HB      GLU  86  -4.157   8.844  13.755
  699    HB3  GLU  86           1HB      GLU  86  -4.835   9.380  15.288
  700    HG2  GLU  86           2HG      GLU  86  -6.016   9.789  12.517
  701    HG3  GLU  86           1HG      GLU  86  -6.622   8.737  13.794
  702    H    SER  87           H        SER  87  -1.864   9.505  13.613
  703    HA   SER  87           HA       SER  87  -0.395   9.723  16.071
  704    HB2  SER  87           2HB      SER  87  -0.134   7.772  14.563
  705    HB3  SER  87           1HB      SER  87   0.523   8.817  13.309
  706    HG   SER  87           HG       SER  87   2.323   9.165  14.548
  707    H    ALA  88           H        ALA  88  -0.770  11.763  13.378
  708    HA   ALA  88           HA       ALA  88   0.027  13.752  12.751
  709    HB1  ALA  88           3HB      ALA  88   0.349  14.366  15.112
  710    HB2  ALA  88           1HB      ALA  88   1.643  15.039  14.115
  711    HB3  ALA  88           2HB      ALA  88   1.938  13.604  15.105
  712    H    LEU  89           H        LEU  89   1.907  14.687  11.645
  713    HA   LEU  89           HA       LEU  89   3.463  12.681  10.270
  714    HB2  LEU  89           2HB      LEU  89   4.411  14.760   9.074
  715    HB3  LEU  89           1HB      LEU  89   2.716  14.367   8.860
  716    HG   LEU  89           HG       LEU  89   2.190  16.151  10.631
  717   HD11  LEU  89          1HD1      LEU  89   4.395  16.435  11.661
  718   HD12  LEU  89          2HD1      LEU  89   3.834  17.959  10.980
  719   HD13  LEU  89          3HD1      LEU  89   5.057  17.013  10.128
  720   HD21  LEU  89          3HD2      LEU  89   3.453  17.044   8.029
  721   HD22  LEU  89          1HD2      LEU  89   2.312  17.979   8.999
  722   HD23  LEU  89          2HD2      LEU  89   1.794  16.473   8.240
  723    H    GLU  90           H        GLU  90   3.870  14.445  13.115
  724    HA   GLU  90           HA       GLU  90   6.816  14.409  13.077
  725    HB2  GLU  90           2HB      GLU  90   6.515  15.902  15.157
  726    HB3  GLU  90           1HB      GLU  90   6.077  16.598  13.602
  727    HG2  GLU  90           2HG      GLU  90   3.673  16.052  14.094
  728    HG3  GLU  90           1HG      GLU  90   4.166  15.520  15.702
  729   H281  4EM 101          2H28      PYA 142   0.971 -11.610   7.924
  730   H283  4EM 101          3H28      PYA 142   2.081 -12.285   9.113
  731   H303  4EM 101          3H30      PYA 142  -2.120 -13.008   9.383
  732   H301  4EM 101          1H30      PYA 142  -1.181 -13.726   8.073
  733   H302  4EM 101          2H30      PYA 142  -1.470 -11.985   8.114
  734   H312  4EM 101          2H31      PYA 142  -0.320 -10.555   9.819
  735   H313  4EM 101          3H31      PYA 142  -0.933 -11.560  11.133
  736   H311  4EM 101          1H31      PYA 142   0.806 -11.278  10.988
  737    H32  4EM 101           H32      PYA 142   0.403 -14.765   9.745
  738    H33  4EM 101           H33      PYA 142   1.661 -14.441  11.722
  739    H36  4EM 101           H36      PYA 142  -2.301 -13.242  10.735
  740   H373  4EM 101          3H37      PYA 142  -3.529 -15.087  12.177
  741   H372  4EM 101          2H37      PYA 142  -2.617 -14.248  13.432
  742   H382  4EM 101          2H38      PYA 142  -4.932 -13.416  13.260
  743   H383  4EM 101          3H38      PYA 142  -4.649 -12.965  11.579
  744    H41  4EM 101           H41      PYA 142  -4.602 -10.794  11.485
  745   H423  4EM 101          3H42      PYA 142  -3.487  -9.150  13.633
  746   H422  4EM 101          2H42      PYA 142  -4.437  -8.611  12.253
  747   H433  4EM 101          3H43      PYA 142  -1.579  -9.562  12.092
  748   H432  4EM 101          2H43      PYA 142  -2.074  -7.874  12.167
  749    H44  4EM 101           H44      PYA 142  -2.249  -7.949  10.102
  750    H49  4EM 101           H49      PYA 142  -0.924 -10.133   7.789
  751    H51  4EM 101           H51      PYA 142  -1.626  -9.079   5.501
  752    H50  4EM 101           H50      PYA 142  -3.965  -7.974   5.818
  753    H48  4EM 101           H48      PYA 142  -4.711  -8.491   8.223
  Start of MODEL   19
    1    H1   MET   1           1H       MET   1   5.999  16.383  -2.128
    2    H2   MET   1           2H       MET   1   5.692  17.852  -2.897
    3    H3   MET   1           3H       MET   1   6.681  16.707  -3.639
    4    HA   MET   1           HA       MET   1   4.483  16.773  -4.634
    5    HB2  MET   1           2HB      MET   1   5.047  14.206  -3.076
    6    HB3  MET   1           1HB      MET   1   3.986  14.328  -4.480
    7    HG2  MET   1           2HG      MET   1   6.103  13.392  -5.156
    8    HG3  MET   1           1HG      MET   1   5.941  15.001  -5.861
    9    HE1  MET   1           3HE      MET   1   9.817  14.808  -5.233
   10    HE2  MET   1           1HE      MET   1   8.548  15.096  -6.423
   11    HE3  MET   1           2HE      MET   1   8.781  13.480  -5.751
   12    H    ASP   2           H        ASP   2   2.181  16.140  -4.357
   13    HA   ASP   2           HA       ASP   2   1.004  17.502  -2.140
   14    HB2  ASP   2           2HB      ASP   2  -0.425  15.685  -4.135
   15    HB3  ASP   2           1HB      ASP   2  -1.144  16.975  -3.168
   16    H    GLY   3           H        GLY   3   1.543  14.121  -2.915
   17    HA2  GLY   3           2HA      GLY   3   1.849  12.607  -0.976
   18    HA3  GLY   3           1HA      GLY   3   0.355  13.261  -0.318
   19    H    GLU   4           H        GLU   4  -0.809  13.279  -3.146
   20    HA   GLU   4           HA       GLU   4  -2.007  10.666  -2.927
   21    HB2  GLU   4           2HB      GLU   4  -2.506  12.876  -4.941
   22    HB3  GLU   4           1HB      GLU   4  -3.428  11.378  -4.861
   23    HG2  GLU   4           2HG      GLU   4  -3.719  12.159  -2.293
   24    HG3  GLU   4           1HG      GLU   4  -3.477  13.740  -3.023
   25    H    GLU   5           H        GLU   5   0.284  12.154  -5.101
   26    HA   GLU   5           HA       GLU   5   0.596  10.017  -6.921
   27    HB2  GLU   5           2HB      GLU   5   1.545  12.219  -7.392
   28    HB3  GLU   5           1HB      GLU   5   2.578  12.124  -5.965
   29    HG2  GLU   5           2HG      GLU   5   3.757  10.180  -7.003
   30    HG3  GLU   5           1HG      GLU   5   2.764  10.386  -8.444
   31    H    VAL   6           H        VAL   6   1.889  10.621  -3.676
   32    HA   VAL   6           HA       VAL   6   3.814   8.532  -3.718
   33    HB   VAL   6           HB       VAL   6   2.431   9.633  -1.258
   34   HG11  VAL   6          1HG1      VAL   6   4.497   8.952  -0.082
   35   HG12  VAL   6          2HG1      VAL   6   5.133   8.297  -1.592
   36   HG13  VAL   6          3HG1      VAL   6   3.706   7.572  -0.847
   37   HG21  VAL   6          3HG2      VAL   6   3.352  11.505  -2.552
   38   HG22  VAL   6          1HG2      VAL   6   4.919  10.692  -2.637
   39   HG23  VAL   6          2HG2      VAL   6   4.296  11.252  -1.083
   40    H    LYS   7           H        LYS   7   0.397   8.670  -2.982
   41    HA   LYS   7           HA       LYS   7   0.094   6.037  -1.990
   42    HB2  LYS   7           2HB      LYS   7  -1.899   7.946  -3.239
   43    HB3  LYS   7           1HB      LYS   7  -2.350   6.369  -2.596
   44    HG2  LYS   7           2HG      LYS   7  -1.469   7.062  -0.361
   45    HG3  LYS   7           1HG      LYS   7  -1.108   8.660  -1.019
   46    HD2  LYS   7           2HD      LYS   7  -3.848   7.386  -0.745
   47    HD3  LYS   7           1HD      LYS   7  -3.203   8.691   0.244
   48    HE2  LYS   7           2HE      LYS   7  -3.164  10.172  -1.702
   49    HE3  LYS   7           1HE      LYS   7  -3.746   8.862  -2.733
   50    HZ1  LYS   7           3HZ      LYS   7  -5.527  10.341  -2.097
   51    HZ2  LYS   7           1HZ      LYS   7  -5.224  10.062  -0.459
   52    HZ3  LYS   7           2HZ      LYS   7  -5.779   8.804  -1.438
   53    H    GLU   8           H        GLU   8  -0.122   7.341  -5.360
   54    HA   GLU   8           HA       GLU   8  -0.747   4.761  -6.435
   55    HB2  GLU   8           2HB      GLU   8  -0.312   5.593  -8.656
   56    HB3  GLU   8           1HB      GLU   8  -1.232   6.797  -7.766
   57    HG2  GLU   8           2HG      GLU   8   0.605   8.262  -7.606
   58    HG3  GLU   8           1HG      GLU   8   1.772   7.002  -7.986
   59    H    LYS   9           H        LYS   9   2.267   6.430  -5.701
   60    HA   LYS   9           HA       LYS   9   4.067   4.672  -6.996
   61    HB2  LYS   9           2HB      LYS   9   4.484   6.415  -4.539
   62    HB3  LYS   9           1HB      LYS   9   5.774   5.534  -5.346
   63    HG2  LYS   9           2HG      LYS   9   5.245   6.863  -7.438
   64    HG3  LYS   9           1HG      LYS   9   4.162   7.844  -6.454
   65    HD2  LYS   9           2HD      LYS   9   7.163   7.520  -6.098
   66    HD3  LYS   9           1HD      LYS   9   6.310   8.968  -6.633
   67    HE2  LYS   9           2HE      LYS   9   5.265   9.203  -4.416
   68    HE3  LYS   9           1HE      LYS   9   6.034   7.708  -3.878
   69    HZ1  LYS   9           3HZ      LYS   9   7.511  10.118  -4.749
   70    HZ2  LYS   9           1HZ      LYS   9   8.161   8.716  -4.083
   71    HZ3  LYS   9           2HZ      LYS   9   7.176   9.706  -3.147
   72    H    ILE  10           H        ILE  10   2.277   4.358  -4.024
   73    HA   ILE  10           HA       ILE  10   3.649   2.201  -2.840
   74    HB   ILE  10           HB       ILE  10   0.622   2.594  -2.910
   75   HG12  ILE  10          2HG1      ILE  10   1.601   4.681  -2.121
   76   HG13  ILE  10          1HG1      ILE  10   0.852   3.850  -0.772
   77   HG21  ILE  10          1HG2      ILE  10   0.629   1.427  -0.744
   78   HG22  ILE  10          2HG2      ILE  10   2.371   1.178  -0.886
   79   HG23  ILE  10          3HG2      ILE  10   1.271   0.420  -2.040
   80   HD11  ILE  10          3HD1      ILE  10   3.078   3.118  -0.018
   81   HD12  ILE  10          1HD1      ILE  10   2.920   4.872  -0.108
   82   HD13  ILE  10          2HD1      ILE  10   3.798   4.008  -1.365
   83    H    ARG  11           H        ARG  11   1.154   2.336  -5.347
   84    HA   ARG  11           HA       ARG  11   0.880  -0.497  -5.700
   85    HB2  ARG  11           2HB      ARG  11  -0.328   1.962  -6.928
   86    HB3  ARG  11           1HB      ARG  11  -0.443   0.458  -7.842
   87    HG2  ARG  11           2HG      ARG  11  -2.426   0.887  -6.412
   88    HG3  ARG  11           1HG      ARG  11  -1.612  -0.626  -6.059
   89    HD2  ARG  11           2HD      ARG  11  -0.386   0.819  -4.195
   90    HD3  ARG  11           1HD      ARG  11  -1.793   1.861  -4.394
   91    HE   ARG  11           HE       ARG  11  -2.687  -0.760  -4.084
   92   HH11  ARG  11          1HH1      ARG  11  -1.150   1.736  -2.139
   93   HH12  ARG  11          2HH1      ARG  11  -1.774   1.111  -0.650
   94   HH21  ARG  11          1HH2      ARG  11  -3.425  -1.592  -2.150
   95   HH22  ARG  11          2HH2      ARG  11  -3.076  -0.787  -0.666
   96    H    ARG  12           H        ARG  12   2.527   2.085  -7.429
   97    HA   ARG  12           HA       ARG  12   3.523   0.624  -9.623
   98    HB2  ARG  12           2HB      ARG  12   4.503   3.095  -8.176
   99    HB3  ARG  12           1HB      ARG  12   5.539   2.350  -9.383
  100    HG2  ARG  12           2HG      ARG  12   4.190   4.285 -10.223
  101    HG3  ARG  12           1HG      ARG  12   3.968   2.795 -11.139
  102    HD2  ARG  12           2HD      ARG  12   1.823   2.417 -10.185
  103    HD3  ARG  12           1HD      ARG  12   2.084   3.629  -8.937
  104    HE   ARG  12           HE       ARG  12   2.114   5.268 -10.888
  105   HH11  ARG  12          1HH1      ARG  12   0.130   2.373 -10.868
  106   HH12  ARG  12          2HH1      ARG  12  -1.090   3.060 -11.889
  107   HH21  ARG  12          1HH2      ARG  12   0.508   6.185 -12.145
  108   HH22  ARG  12          2HH2      ARG  12  -0.872   5.244 -12.619
  109    H    TYR  13           H        TYR  13   5.058   1.387  -6.510
  110    HA   TYR  13           HA       TYR  13   7.414   0.007  -6.542
  111    HB2  TYR  13           2HB      TYR  13   6.791   1.425  -4.697
  112    HB3  TYR  13           1HB      TYR  13   5.412   0.417  -4.296
  113    HD1  TYR  13           HD1      TYR  13   9.146  -0.125  -4.689
  114    HD2  TYR  13           HD2      TYR  13   5.657  -0.722  -2.282
  115    HE1  TYR  13           HE1      TYR  13  10.514  -1.226  -2.968
  116    HE2  TYR  13           HE2      TYR  13   7.025  -1.819  -0.572
  117    HH   TYR  13           HH       TYR  13  10.393  -1.678  -0.527
  118    H    ILE  14           H        ILE  14   4.252  -1.387  -5.709
  119    HA   ILE  14           HA       ILE  14   5.080  -3.959  -4.982
  120    HB   ILE  14           HB       ILE  14   2.456  -3.047  -6.230
  121   HG12  ILE  14          2HG1      ILE  14   2.902  -1.973  -4.070
  122   HG13  ILE  14          1HG1      ILE  14   1.605  -3.144  -3.884
  123   HG21  ILE  14          1HG2      ILE  14   1.459  -5.116  -5.280
  124   HG22  ILE  14          2HG2      ILE  14   3.079  -5.688  -4.869
  125   HG23  ILE  14          3HG2      ILE  14   2.626  -5.449  -6.557
  126   HD11  ILE  14          3HD1      ILE  14   3.100  -3.250  -2.009
  127   HD12  ILE  14          1HD1      ILE  14   4.485  -3.519  -3.058
  128   HD13  ILE  14          2HD1      ILE  14   3.222  -4.749  -2.922
  129    H    MET  15           H        MET  15   4.059  -2.760  -8.169
  130    HA   MET  15           HA       MET  15   4.372  -5.306  -9.495
  131    HB2  MET  15           2HB      MET  15   4.060  -2.513 -10.691
  132    HB3  MET  15           1HB      MET  15   3.738  -4.046 -11.505
  133    HG2  MET  15           2HG      MET  15   2.233  -3.030  -9.082
  134    HG3  MET  15           1HG      MET  15   1.680  -2.884 -10.748
  135    HE1  MET  15           3HE      MET  15   0.784  -6.447 -11.774
  136    HE2  MET  15           1HE      MET  15   2.203  -5.481 -12.178
  137    HE3  MET  15           2HE      MET  15   0.606  -4.718 -12.109
  138    H    GLU  16           H        GLU  16   6.294  -2.345  -9.229
  139    HA   GLU  16           HA       GLU  16   8.220  -2.891 -11.232
  140    HB2  GLU  16           2HB      GLU  16   8.514  -1.129  -8.769
  141    HB3  GLU  16           1HB      GLU  16   9.580  -1.117 -10.165
  142    HG2  GLU  16           2HG      GLU  16   6.739  -0.135  -9.975
  143    HG3  GLU  16           1HG      GLU  16   8.189   0.782 -10.339
  144    H    ASP  17           H        ASP  17   7.943  -3.783  -7.833
  145    HA   ASP  17           HA       ASP  17  10.772  -4.725  -7.800
  146    HB2  ASP  17           2HB      ASP  17  10.301  -2.596  -6.504
  147    HB3  ASP  17           1HB      ASP  17   9.215  -3.519  -5.471
  148    H    LEU  18           H        LEU  18   7.642  -5.123  -6.110
  149    HA   LEU  18           HA       LEU  18   8.477  -7.470  -4.707
  150    HB2  LEU  18           2HB      LEU  18   5.768  -6.130  -5.016
  151    HB3  LEU  18           1HB      LEU  18   5.965  -7.608  -4.099
  152    HG   LEU  18           HG       LEU  18   5.942  -5.782  -2.535
  153   HD11  LEU  18          1HD1      LEU  18   7.509  -7.588  -2.014
  154   HD12  LEU  18          2HD1      LEU  18   8.071  -6.045  -1.389
  155   HD13  LEU  18          3HD1      LEU  18   8.810  -6.721  -2.839
  156   HD21  LEU  18          3HD2      LEU  18   6.524  -3.923  -4.021
  157   HD22  LEU  18          1HD2      LEU  18   8.198  -4.479  -4.093
  158   HD23  LEU  18          2HD2      LEU  18   7.518  -3.900  -2.569
  159    H    ILE  19           H        ILE  19   6.356  -6.977  -7.527
  160    HA   ILE  19           HA       ILE  19   5.959  -9.763  -8.074
  161    HB   ILE  19           HB       ILE  19   5.571  -7.241  -9.740
  162   HG12  ILE  19          2HG1      ILE  19   3.186  -7.913  -9.778
  163   HG13  ILE  19          1HG1      ILE  19   3.570  -9.380  -8.906
  164   HG21  ILE  19          1HG2      ILE  19   6.389  -8.899 -11.339
  165   HG22  ILE  19          2HG2      ILE  19   4.671  -8.598 -11.605
  166   HG23  ILE  19          3HG2      ILE  19   5.190 -10.067 -10.775
  167   HD11  ILE  19          3HD1      ILE  19   4.152  -8.061  -6.948
  168   HD12  ILE  19          1HD1      ILE  19   2.506  -7.751  -7.499
  169   HD13  ILE  19          2HD1      ILE  19   3.783  -6.582  -7.846
  170    H    GLY  20           H        GLY  20   8.325  -7.311  -9.025
  171    HA2  GLY  20           2HA      GLY  20  10.658  -8.016  -9.185
  172    HA3  GLY  20           1HA      GLY  20  10.117  -9.436 -10.071
  173    HA   PRO  21           HA       PRO  21  11.489  -6.290 -13.238
  174    HB2  PRO  21           2HB      PRO  21  12.950  -8.015 -14.783
  175    HB3  PRO  21           1HB      PRO  21  13.607  -7.306 -13.292
  176    HG2  PRO  21           2HG      PRO  21  12.368 -10.020 -13.685
  177    HG3  PRO  21           1HG      PRO  21  13.887  -9.587 -12.864
  178    HD2  PRO  21           2HD      PRO  21  11.603 -10.031 -11.471
  179    HD3  PRO  21           1HD      PRO  21  12.801  -8.823 -10.946
  180    H    SER  22           H        SER  22   9.550  -9.089 -13.233
  181    HA   SER  22           HA       SER  22   8.527  -8.543 -15.965
  182    HB2  SER  22           2HB      SER  22   9.718 -10.741 -15.779
  183    HB3  SER  22           1HB      SER  22   8.591 -11.229 -14.514
  184    HG   SER  22           HG       SER  22   8.222 -11.808 -16.884
  185    H    ALA  23           H        ALA  23   7.023  -7.025 -15.101
  186    HA   ALA  23           HA       ALA  23   4.856  -8.119 -13.401
  187    HB1  ALA  23           3HB      ALA  23   5.894  -6.041 -12.589
  188    HB2  ALA  23           1HB      ALA  23   4.202  -5.775 -13.022
  189    HB3  ALA  23           2HB      ALA  23   5.490  -5.233 -14.103
  190    H    LYS  24           H        LYS  24   2.635  -7.365 -13.973
  191    HA   LYS  24           HA       LYS  24   2.195  -6.963 -16.874
  192    HB2  LYS  24           2HB      LYS  24   0.612  -8.784 -14.997
  193    HB3  LYS  24           1HB      LYS  24   0.049  -8.314 -16.595
  194    HG2  LYS  24           2HG      LYS  24   2.583  -9.866 -16.029
  195    HG3  LYS  24           1HG      LYS  24   1.055 -10.561 -16.584
  196    HD2  LYS  24           2HD      LYS  24   1.201  -9.326 -18.688
  197    HD3  LYS  24           1HD      LYS  24   2.636  -8.463 -18.121
  198    HE2  LYS  24           2HE      LYS  24   3.246 -10.261 -19.661
  199    HE3  LYS  24           1HE      LYS  24   3.890 -10.554 -18.049
  200    HZ1  LYS  24           3HZ      LYS  24   2.988 -12.561 -19.006
  201    HZ2  LYS  24           1HZ      LYS  24   1.479 -11.830 -19.211
  202    HZ3  LYS  24           2HZ      LYS  24   2.072 -12.105 -17.657
  203    H    GLU  25           H        GLU  25   1.604  -4.916 -16.977
  204    HA   GLU  25           HA       GLU  25   0.650  -3.308 -14.868
  205    HB2  GLU  25           2HB      GLU  25   0.520  -2.832 -17.884
  206    HB3  GLU  25           1HB      GLU  25   0.183  -1.604 -16.670
  207    HG2  GLU  25           2HG      GLU  25   2.395  -1.219 -17.459
  208    HG3  GLU  25           1HG      GLU  25   2.528  -1.877 -15.834
  209    H    ASP  26           H        ASP  26  -0.948  -5.243 -17.203
  210    HA   ASP  26           HA       ASP  26  -3.507  -4.378 -17.524
  211    HB2  ASP  26           2HB      ASP  26  -2.790  -7.294 -16.978
  212    HB3  ASP  26           1HB      ASP  26  -4.141  -6.700 -17.936
  213    H    GLU  27           H        GLU  27  -2.296  -6.339 -14.823
  214    HA   GLU  27           HA       GLU  27  -4.899  -6.619 -13.587
  215    HB2  GLU  27           2HB      GLU  27  -3.764  -8.040 -11.955
  216    HB3  GLU  27           1HB      GLU  27  -3.274  -8.482 -13.586
  217    HG2  GLU  27           2HG      GLU  27  -1.186  -7.155 -13.271
  218    HG3  GLU  27           1HG      GLU  27  -1.662  -6.859 -11.602
  219    H    LEU  28           H        LEU  28  -2.380  -4.314 -13.404
  220    HA   LEU  28           HA       LEU  28  -2.791  -3.559 -10.652
  221    HB2  LEU  28           2HB      LEU  28  -0.567  -3.354 -11.697
  222    HB3  LEU  28           1HB      LEU  28  -1.212  -2.188 -12.844
  223    HG   LEU  28           HG       LEU  28  -1.777  -0.684 -10.904
  224   HD11  LEU  28          1HD1      LEU  28  -0.213  -2.694  -9.274
  225   HD12  LEU  28          2HD1      LEU  28  -1.919  -2.277  -9.090
  226   HD13  LEU  28          3HD1      LEU  28  -0.678  -1.083  -8.721
  227   HD21  LEU  28          3HD2      LEU  28   1.126  -1.392 -11.254
  228   HD22  LEU  28          1HD2      LEU  28   0.530   0.086 -10.496
  229   HD23  LEU  28          2HD2      LEU  28   0.195  -0.231 -12.197
  230    H    ASP  29           H        ASP  29  -4.066  -2.005  -9.903
  231    HA   ASP  29           HA       ASP  29  -4.641   0.443 -11.249
  232    HB2  ASP  29           2HB      ASP  29  -6.467  -1.144 -12.173
  233    HB3  ASP  29           1HB      ASP  29  -7.075  -1.250 -10.524
  234    H    ASP  30           H        ASP  30  -6.105   1.821  -9.684
  235    HA   ASP  30           HA       ASP  30  -4.989   1.515  -7.036
  236    HB2  ASP  30           2HB      ASP  30  -5.840   3.725  -6.579
  237    HB3  ASP  30           1HB      ASP  30  -5.104   3.733  -8.173
  238    H    GLN  31           H        GLN  31  -8.149   1.320  -8.539
  239    HA   GLN  31           HA       GLN  31  -9.631   0.882  -6.101
  240    HB2  GLN  31           2HB      GLN  31 -10.468   0.406  -8.995
  241    HB3  GLN  31           1HB      GLN  31 -11.546   0.541  -7.606
  242    HG2  GLN  31           2HG      GLN  31 -10.859   2.895  -7.313
  243    HG3  GLN  31           1HG      GLN  31  -9.794   2.755  -8.711
  244   HE21  GLN  31          1HE2      GLN  31 -12.062   4.537  -8.241
  245   HE22  GLN  31          2HE2      GLN  31 -13.149   4.286  -9.561
  246    H    THR  32           H        THR  32  -7.759  -1.070  -8.213
  247    HA   THR  32           HA       THR  32  -9.064  -3.554  -8.007
  248    HB   THR  32           HB       THR  32  -6.189  -2.831  -8.589
  249    HG1  THR  32           HG1      THR  32  -6.913  -3.778 -10.659
  250   HG21  THR  32          3HG2      THR  32  -6.031  -5.014  -7.540
  251   HG22  THR  32          1HG2      THR  32  -5.869  -5.226  -9.285
  252   HG23  THR  32          2HG2      THR  32  -7.397  -5.616  -8.483
  253    HA   PRO  33           HA       PRO  33  -7.980  -4.386  -3.660
  254    HB2  PRO  33           2HB      PRO  33  -9.343  -6.767  -3.479
  255    HB3  PRO  33           1HB      PRO  33 -10.147  -5.185  -3.379
  256    HG2  PRO  33           2HG      PRO  33  -9.977  -7.066  -5.698
  257    HG3  PRO  33           1HG      PRO  33 -11.342  -6.073  -5.156
  258    HD2  PRO  33           2HD      PRO  33  -9.711  -5.382  -7.247
  259    HD3  PRO  33           1HD      PRO  33 -10.587  -4.195  -6.260
  260    H    LEU  34           H        LEU  34  -5.878  -4.866  -3.587
  261    HA   LEU  34           HA       LEU  34  -4.477  -6.604  -5.301
  262    HB2  LEU  34           2HB      LEU  34  -3.520  -5.524  -2.634
  263    HB3  LEU  34           1HB      LEU  34  -2.528  -6.016  -3.998
  264    HG   LEU  34           HG       LEU  34  -4.356  -3.580  -3.921
  265   HD11  LEU  34          1HD1      LEU  34  -1.337  -3.756  -3.833
  266   HD12  LEU  34          2HD1      LEU  34  -2.416  -3.271  -2.516
  267   HD13  LEU  34          3HD1      LEU  34  -2.290  -2.270  -3.959
  268   HD21  LEU  34          3HD2      LEU  34  -4.243  -4.454  -6.208
  269   HD22  LEU  34          1HD2      LEU  34  -2.478  -4.467  -6.140
  270   HD23  LEU  34          2HD2      LEU  34  -3.360  -2.936  -6.078
  271    H    LEU  35           H        LEU  35  -5.429  -6.947  -1.860
  272    HA   LEU  35           HA       LEU  35  -4.331  -9.507  -1.374
  273    HB2  LEU  35           2HB      LEU  35  -6.617  -7.974  -0.120
  274    HB3  LEU  35           1HB      LEU  35  -6.365  -9.647   0.340
  275    HG   LEU  35           HG       LEU  35  -5.370  -8.111   1.966
  276   HD11  LEU  35          1HD1      LEU  35  -4.319 -10.298   1.713
  277   HD12  LEU  35          2HD1      LEU  35  -3.137  -9.072   2.152
  278   HD13  LEU  35          3HD1      LEU  35  -3.224  -9.654   0.486
  279   HD21  LEU  35          3HD2      LEU  35  -4.874  -6.231   0.504
  280   HD22  LEU  35          1HD2      LEU  35  -3.568  -7.144  -0.257
  281   HD23  LEU  35          2HD2      LEU  35  -3.463  -6.697   1.448
  282    H    GLU  36           H        GLU  36  -7.413  -8.500  -2.757
  283    HA   GLU  36           HA       GLU  36  -8.651 -11.059  -2.845
  284    HB2  GLU  36           2HB      GLU  36  -9.742  -8.720  -3.043
  285    HB3  GLU  36           1HB      GLU  36  -9.229  -8.746  -4.723
  286    HG2  GLU  36           2HG      GLU  36 -11.491  -9.414  -4.731
  287    HG3  GLU  36           1HG      GLU  36 -10.568 -10.896  -4.978
  288    H    TRP  37           H        TRP  37  -6.542  -9.260  -5.042
  289    HA   TRP  37           HA       TRP  37  -6.959 -11.177  -7.251
  290    HB2  TRP  37           2HB      TRP  37  -5.437  -8.561  -7.017
  291    HB3  TRP  37           1HB      TRP  37  -5.272  -9.603  -8.428
  292    HD1  TRP  37           HD1      TRP  37  -8.605  -8.658  -6.607
  293    HE1  TRP  37           HE1      TRP  37 -10.135  -7.504  -8.308
  294    HE3  TRP  37           HE3      TRP  37  -5.433  -8.551 -10.626
  295    HZ2  TRP  37           HZ2      TRP  37 -10.038  -6.658 -10.988
  296    HZ3  TRP  37           HZ3      TRP  37  -6.242  -7.546 -12.723
  297    HH2  TRP  37           HH2      TRP  37  -8.491  -6.620 -12.900
  298    H    GLY  38           H        GLY  38  -5.239 -11.393  -4.535
  299    HA2  GLY  38           2HA      GLY  38  -3.563 -12.785  -3.868
  300    HA3  GLY  38           1HA      GLY  38  -3.541 -13.465  -5.488
  301    H    ILE  39           H        ILE  39  -3.073 -10.072  -5.229
  302    HA   ILE  39           HA       ILE  39  -0.384 -10.140  -6.240
  303    HB   ILE  39           HB       ILE  39  -2.151  -7.828  -5.279
  304   HG12  ILE  39          2HG1      ILE  39  -1.502  -8.755  -8.120
  305   HG13  ILE  39          1HG1      ILE  39  -3.040  -8.989  -7.300
  306   HG21  ILE  39          1HG2      ILE  39  -0.583  -6.293  -6.394
  307   HG22  ILE  39          2HG2      ILE  39   0.479  -7.648  -6.782
  308   HG23  ILE  39          3HG2      ILE  39   0.213  -7.190  -5.100
  309   HD11  ILE  39          3HD1      ILE  39  -3.184  -7.187  -8.901
  310   HD12  ILE  39          1HD1      ILE  39  -1.842  -6.343  -8.129
  311   HD13  ILE  39          2HD1      ILE  39  -3.370  -6.544  -7.269
  312    H    LEU  40           H        LEU  40  -2.008  -9.532  -3.180
  313    HA   LEU  40           HA       LEU  40   0.559  -9.679  -1.711
  314    HB2  LEU  40           2HB      LEU  40  -1.951  -8.271  -0.711
  315    HB3  LEU  40           1HB      LEU  40  -0.328  -8.196  -0.034
  316    HG   LEU  40           HG       LEU  40  -1.181  -6.965  -2.686
  317   HD11  LEU  40          1HD1      LEU  40  -2.231  -5.803  -0.864
  318   HD12  LEU  40          2HD1      LEU  40  -0.947  -4.803  -1.538
  319   HD13  LEU  40          3HD1      LEU  40  -0.690  -5.646  -0.006
  320   HD21  LEU  40          3HD2      LEU  40   1.453  -6.738  -1.206
  321   HD22  LEU  40          1HD2      LEU  40   0.996  -5.836  -2.657
  322   HD23  LEU  40          2HD2      LEU  40   1.164  -7.589  -2.730
  323    H    ASN  41           H        ASN  41   0.514 -10.987   0.123
  324    HA   ASN  41           HA       ASN  41  -2.052 -11.926   1.195
  325    HB2  ASN  41           2HB      ASN  41  -1.165 -13.878  -0.081
  326    HB3  ASN  41           1HB      ASN  41   0.372 -13.747   0.767
  327   HD21  ASN  41          1HD2      ASN  41  -2.952 -14.744   1.007
  328   HD22  ASN  41          2HD2      ASN  41  -2.822 -15.562   2.522
  329    H    SER  42           H        SER  42   1.366 -12.507   1.901
  330    HA   SER  42           HA       SER  42   1.483 -10.363   3.874
  331    HB2  SER  42           3HB      SER  42   0.880 -12.513   5.137
  332    HB3  SER  42           2HB      SER  42   2.438 -13.167   4.620
  333    H    MET  43           H        MET  43   4.191 -11.231   4.718
  334    HA   MET  43           HA       MET  43   6.361 -11.281   4.123
  335    HB2  MET  43           2HB      MET  43   5.398 -12.354   1.443
  336    HB3  MET  43           1HB      MET  43   7.014 -12.512   2.100
  337    HG2  MET  43           2HG      MET  43   6.439 -14.269   3.453
  338    HG3  MET  43           1HG      MET  43   4.804 -13.669   3.739
  339    HE1  MET  43           3HE      MET  43   2.752 -14.089   2.145
  340    HE2  MET  43           1HE      MET  43   2.875 -14.835   0.549
  341    HE3  MET  43           2HE      MET  43   3.579 -13.243   0.836
  342    H    ASN  44           H        ASN  44   5.080 -10.553   0.857
  343    HA   ASN  44           HA       ASN  44   6.707  -8.265   0.432
  344    HB2  ASN  44           2HB      ASN  44   5.538  -8.017  -1.655
  345    HB3  ASN  44           1HB      ASN  44   5.761  -9.735  -1.382
  346   HD21  ASN  44          1HD2      ASN  44   3.928  -8.643  -3.210
  347   HD22  ASN  44          2HD2      ASN  44   2.335  -9.052  -2.687
  348    H    ILE  45           H        ILE  45   3.616  -8.738   1.921
  349    HA   ILE  45           HA       ILE  45   2.500  -6.209   2.098
  350    HB   ILE  45           HB       ILE  45   2.524  -8.674   3.792
  351   HG12  ILE  45          2HG1      ILE  45   0.974  -8.471   1.867
  352   HG13  ILE  45          1HG1      ILE  45   0.134  -8.729   3.390
  353   HG21  ILE  45          1HG2      ILE  45   1.310  -6.130   4.870
  354   HG22  ILE  45          2HG2      ILE  45   2.654  -7.045   5.565
  355   HG23  ILE  45          3HG2      ILE  45   1.035  -7.752   5.518
  356   HD11  ILE  45          3HD1      ILE  45  -1.042  -7.141   2.055
  357   HD12  ILE  45          1HD1      ILE  45   0.389  -6.125   1.905
  358   HD13  ILE  45          2HD1      ILE  45  -0.391  -6.322   3.480
  359    H    VAL  46           H        VAL  46   5.239  -7.547   3.852
  360    HA   VAL  46           HA       VAL  46   5.347  -5.521   5.878
  361    HB   VAL  46           HB       VAL  46   7.503  -7.501   5.049
  362   HG11  VAL  46          1HG1      VAL  46   7.087  -6.048   7.685
  363   HG12  VAL  46          2HG1      VAL  46   8.354  -5.700   6.506
  364   HG13  VAL  46          3HG1      VAL  46   8.343  -7.246   7.357
  365   HG21  VAL  46          3HG2      VAL  46   5.302  -7.863   7.118
  366   HG22  VAL  46          1HG2      VAL  46   6.627  -8.993   6.821
  367   HG23  VAL  46          2HG2      VAL  46   5.416  -8.702   5.571
  368    H    LYS  47           H        LYS  47   6.527  -5.755   2.628
  369    HA   LYS  47           HA       LYS  47   8.590  -3.759   2.822
  370    HB2  LYS  47           2HB      LYS  47   7.243  -5.077   0.452
  371    HB3  LYS  47           1HB      LYS  47   8.411  -3.778   0.250
  372    HG2  LYS  47           2HG      LYS  47   9.555  -5.847  -0.080
  373    HG3  LYS  47           1HG      LYS  47  10.101  -5.182   1.462
  374    HD2  LYS  47           2HD      LYS  47   8.671  -6.735   2.685
  375    HD3  LYS  47           1HD      LYS  47   7.956  -7.307   1.180
  376    HE2  LYS  47           2HE      LYS  47   9.597  -8.916   1.994
  377    HE3  LYS  47           1HE      LYS  47  10.163  -8.192   0.486
  378    HZ1  LYS  47           3HZ      LYS  47  11.956  -8.266   2.018
  379    HZ2  LYS  47           1HZ      LYS  47  11.044  -7.528   3.235
  380    HZ3  LYS  47           2HZ      LYS  47  11.490  -6.650   1.862
  381    H    LEU  48           H        LEU  48   5.129  -3.717   2.328
  382    HA   LEU  48           HA       LEU  48   4.812  -1.078   1.358
  383    HB2  LEU  48           2HB      LEU  48   3.016  -2.780   3.123
  384    HB3  LEU  48           1HB      LEU  48   2.569  -1.148   2.660
  385    HG   LEU  48           HG       LEU  48   1.408  -2.673   1.214
  386   HD11  LEU  48          1HD1      LEU  48   3.697  -1.428  -0.332
  387   HD12  LEU  48          2HD1      LEU  48   2.219  -0.611   0.184
  388   HD13  LEU  48          3HD1      LEU  48   2.132  -1.924  -0.985
  389   HD21  LEU  48          3HD2      LEU  48   2.502  -4.288  -0.259
  390   HD22  LEU  48          1HD2      LEU  48   2.825  -4.650   1.432
  391   HD23  LEU  48          2HD2      LEU  48   4.074  -3.891   0.446
  392    H    MET  49           H        MET  49   5.263  -2.391   4.597
  393    HA   MET  49           HA       MET  49   4.696  -0.132   6.163
  394    HB2  MET  49           2HB      MET  49   6.767  -2.276   6.786
  395    HB3  MET  49           1HB      MET  49   5.979  -1.223   7.952
  396    HG2  MET  49           2HG      MET  49   3.859  -2.346   7.594
  397    HG3  MET  49           1HG      MET  49   4.566  -3.333   6.307
  398    HE1  MET  49           3HE      MET  49   3.053  -4.869   8.522
  399    HE2  MET  49           1HE      MET  49   4.210  -6.107   9.006
  400    HE3  MET  49           2HE      MET  49   4.020  -5.695   7.301
  401    H    VAL  50           H        VAL  50   7.849  -1.360   4.981
  402    HA   VAL  50           HA       VAL  50   9.407   0.792   5.995
  403    HB   VAL  50           HB       VAL  50  10.354  -1.460   5.457
  404   HG11  VAL  50          1HG1      VAL  50   9.248  -1.920   3.319
  405   HG12  VAL  50          2HG1      VAL  50  10.999  -2.040   3.145
  406   HG13  VAL  50          3HG1      VAL  50  10.149  -0.612   2.549
  407   HG21  VAL  50          3HG2      VAL  50  11.777   0.825   4.047
  408   HG22  VAL  50          1HG2      VAL  50  12.525  -0.693   4.552
  409   HG23  VAL  50          2HG2      VAL  50  11.899   0.429   5.761
  410    H    TYR  51           H        TYR  51   7.673   0.393   2.933
  411    HA   TYR  51           HA       TYR  51   9.043   2.438   1.471
  412    HB2  TYR  51           2HB      TYR  51   7.483   0.644   0.465
  413    HB3  TYR  51           1HB      TYR  51   6.144   1.624   1.021
  414    HD1  TYR  51           HD1      TYR  51   8.975   1.505  -1.366
  415    HD2  TYR  51           HD2      TYR  51   5.584   3.757  -0.089
  416    HE1  TYR  51           HE1      TYR  51   9.109   2.855  -3.406
  417    HE2  TYR  51           HE2      TYR  51   5.701   5.115  -2.127
  418    HH   TYR  51           HH       TYR  51   7.378   4.284  -4.810
  419    H    ILE  52           H        ILE  52   5.997   2.356   3.229
  420    HA   ILE  52           HA       ILE  52   5.252   5.089   2.881
  421    HB   ILE  52           HB       ILE  52   4.324   2.944   4.846
  422   HG12  ILE  52          2HG1      ILE  52   2.890   3.871   2.322
  423   HG13  ILE  52          1HG1      ILE  52   4.066   2.565   2.284
  424   HG21  ILE  52          1HG2      ILE  52   2.283   4.283   5.174
  425   HG22  ILE  52          2HG2      ILE  52   2.965   5.568   4.175
  426   HG23  ILE  52          3HG2      ILE  52   3.722   5.153   5.710
  427   HD11  ILE  52          3HD1      ILE  52   2.699   1.239   3.751
  428   HD12  ILE  52          1HD1      ILE  52   1.771   1.771   2.350
  429   HD13  ILE  52          2HD1      ILE  52   1.529   2.557   3.913
  430    H    ARG  53           H        ARG  53   7.020   3.295   5.293
  431    HA   ARG  53           HA       ARG  53   7.304   5.322   7.281
  432    HB2  ARG  53           2HB      ARG  53   7.558   2.848   7.632
  433    HB3  ARG  53           1HB      ARG  53   9.065   2.909   6.726
  434    HG2  ARG  53           2HG      ARG  53  10.024   4.414   8.456
  435    HG3  ARG  53           1HG      ARG  53   8.511   4.306   9.363
  436    HD2  ARG  53           2HD      ARG  53   8.858   1.780   9.407
  437    HD3  ARG  53           1HD      ARG  53  10.481   2.080   8.774
  438    HE   ARG  53           HE       ARG  53  10.552   3.636  10.893
  439   HH11  ARG  53          1HH1      ARG  53   9.272   0.371  10.669
  440   HH12  ARG  53          2HH1      ARG  53   9.600  -0.002  12.328
  441   HH21  ARG  53          1HH2      ARG  53  10.909   3.191  13.062
  442   HH22  ARG  53          2HH2      ARG  53  10.539   1.620  13.705
  443    H    ASP  54           H        ASP  54   8.975   4.554   4.319
  444    HA   ASP  54           HA       ASP  54  11.314   6.209   4.819
  445    HB2  ASP  54           2HB      ASP  54  11.383   4.154   3.360
  446    HB3  ASP  54           1HB      ASP  54  10.318   4.956   2.214
  447    H    GLU  55           H        GLU  55   8.466   6.334   2.721
  448    HA   GLU  55           HA       GLU  55   8.972   8.937   1.674
  449    HB2  GLU  55           2HB      GLU  55   6.662   6.998   1.538
  450    HB3  GLU  55           1HB      GLU  55   6.484   8.621   0.884
  451    HG2  GLU  55           2HG      GLU  55   8.553   6.581   0.019
  452    HG3  GLU  55           1HG      GLU  55   7.081   7.003  -0.858
  453    H    MET  56           H        MET  56   6.112   7.883   3.509
  454    HA   MET  56           HA       MET  56   5.577  10.649   4.303
  455    HB2  MET  56           2HB      MET  56   3.990   8.059   4.411
  456    HB3  MET  56           1HB      MET  56   3.396   9.543   5.145
  457    HG2  MET  56           2HG      MET  56   3.129  10.613   3.070
  458    HG3  MET  56           1HG      MET  56   4.200   9.490   2.236
  459    HE1  MET  56           3HE      MET  56   3.334   6.628   2.837
  460    HE2  MET  56           1HE      MET  56   3.516   7.263   1.199
  461    HE3  MET  56           2HE      MET  56   2.064   6.362   1.642
  462    H    GLY  57           H        GLY  57   7.519   8.356   5.556
  463    HA2  GLY  57           2HA      GLY  57   8.667   8.292   7.529
  464    HA3  GLY  57           1HA      GLY  57   7.835   9.762   8.006
  465    H    VAL  58           H        VAL  58   5.720   7.183   7.217
  466    HA   VAL  58           HA       VAL  58   5.194   6.720  10.100
  467    HB   VAL  58           HB       VAL  58   3.514   8.267   9.239
  468   HG11  VAL  58          1HG1      VAL  58   2.844   6.222   7.099
  469   HG12  VAL  58          2HG1      VAL  58   3.625   7.781   6.831
  470   HG13  VAL  58          3HG1      VAL  58   1.957   7.719   7.406
  471   HG21  VAL  58          3HG2      VAL  58   1.442   7.043   9.746
  472   HG22  VAL  58          1HG2      VAL  58   2.729   6.597  10.869
  473   HG23  VAL  58          2HG2      VAL  58   2.287   5.507   9.552
  474    H    SER  59           H        SER  59   5.207   4.637  10.682
  475    HA   SER  59           HA       SER  59   4.942   2.516   8.644
  476    HB2  SER  59           2HB      SER  59   6.975   2.495  10.134
  477    HB3  SER  59           1HB      SER  59   5.917   2.297  11.530
  478    HG   SER  59           HG       SER  59   5.356   0.292  10.820
  479    H    ILE  60           H        ILE  60   3.043   1.432   8.553
  480    HA   ILE  60           HA       ILE  60   0.839   1.952  10.270
  481    HB   ILE  60           HB       ILE  60   1.213  -0.370   8.321
  482   HG12  ILE  60          2HG1      ILE  60  -0.029   2.384   7.953
  483   HG13  ILE  60          1HG1      ILE  60   1.320   1.695   7.063
  484   HG21  ILE  60          1HG2      ILE  60  -1.347   0.663   9.602
  485   HG22  ILE  60          2HG2      ILE  60  -0.530  -0.849  10.003
  486   HG23  ILE  60          3HG2      ILE  60  -1.237  -0.632   8.405
  487   HD11  ILE  60          3HD1      ILE  60  -1.542   0.744   6.926
  488   HD12  ILE  60          1HD1      ILE  60  -0.179   0.119   5.985
  489   HD13  ILE  60          2HD1      ILE  60  -0.730   1.778   5.743
  490    HA   PRO  61           HA       PRO  61   2.112  -0.936  13.570
  491    HB2  PRO  61           2HB      PRO  61  -0.197  -0.773  15.082
  492    HB3  PRO  61           1HB      PRO  61   1.038   0.502  15.072
  493    HG2  PRO  61           2HG      PRO  61  -1.538   0.387  13.536
  494    HG3  PRO  61           1HG      PRO  61  -0.831   1.745  14.445
  495    HD2  PRO  61           2HD      PRO  61  -0.627   1.566  11.753
  496    HD3  PRO  61           1HD      PRO  61   0.671   2.271  12.742
  497    H    SER  62           H        SER  62   1.500  -3.081  14.261
  498    HA   SER  62           HA       SER  62   0.642  -4.707  12.135
  499    HB2  SER  62           2HB      SER  62   0.912  -6.579  13.803
  500    HB3  SER  62           1HB      SER  62   2.301  -5.492  13.699
  501    HG   SER  62           HG       SER  62   0.233  -5.363  15.658
  502    H    THR  63           H        THR  63  -1.145  -3.353  14.782
  503    HA   THR  63           HA       THR  63  -3.445  -4.958  14.786
  504    HB   THR  63           HB       THR  63  -2.980  -3.302  16.522
  505    HG1  THR  63           HG1      THR  63  -5.070  -2.351  16.639
  506   HG21  THR  63          3HG2      THR  63  -3.297  -0.890  16.158
  507   HG22  THR  63          1HG2      THR  63  -3.558  -1.170  14.436
  508   HG23  THR  63          2HG2      THR  63  -1.983  -1.510  15.159
  509    H    HIS  64           H        HIS  64  -2.384  -2.486  12.535
  510    HA   HIS  64           HA       HIS  64  -4.898  -2.639  10.984
  511    HB2  HIS  64           2HB      HIS  64  -2.654  -0.602  10.872
  512    HB3  HIS  64           1HB      HIS  64  -4.061  -0.604   9.815
  513    HD1  HIS  64           HD1      HIS  64  -6.143  -1.212  12.185
  514    HD2  HIS  64           HD2      HIS  64  -3.275   1.802  12.111
  515    HE1  HIS  64           HE1      HIS  64  -6.991   0.567  13.738
  516    HE2  HIS  64           HE2      HIS  64  -5.220   2.357  13.719
  517    H    ILE  65           H        ILE  65  -2.042  -4.290  11.045
  518    HA   ILE  65           HA       ILE  65  -1.671  -4.397   8.136
  519    HB   ILE  65           HB       ILE  65  -0.353  -6.103  10.298
  520   HG12  ILE  65          2HG1      ILE  65   0.304  -3.760  10.567
  521   HG13  ILE  65          1HG1      ILE  65   1.659  -4.682   9.930
  522   HG21  ILE  65          1HG2      ILE  65   1.292  -6.707   8.534
  523   HG22  ILE  65          2HG2      ILE  65   0.336  -5.819   7.345
  524   HG23  ILE  65          3HG2      ILE  65  -0.338  -7.248   8.132
  525   HD11  ILE  65          3HD1      ILE  65   1.197  -3.797   7.702
  526   HD12  ILE  65          1HD1      ILE  65   1.486  -2.524   8.893
  527   HD13  ILE  65          2HD1      ILE  65  -0.162  -2.879   8.365
  528    H    THR  66           H        THR  66  -3.753  -5.076   7.572
  529    HA   THR  66           HA       THR  66  -3.906  -7.924   7.325
  530    HB   THR  66           HB       THR  66  -5.022  -7.714   9.491
  531    HG1  THR  66           HG1      THR  66  -6.447  -9.148   8.884
  532   HG21  THR  66          3HG2      THR  66  -6.980  -5.836   8.132
  533   HG22  THR  66          1HG2      THR  66  -5.751  -5.367   9.317
  534   HG23  THR  66          2HG2      THR  66  -7.086  -6.428   9.791
  535    H    GLY  67           H        GLY  67  -6.146  -8.422   6.098
  536    HA2  GLY  67           2HA      GLY  67  -5.672  -7.337   3.535
  537    HA3  GLY  67           1HA      GLY  67  -6.951  -8.446   3.973
  538    H    LYS  68           H        LYS  68  -8.059  -6.402   5.951
  539    HA   LYS  68           HA       LYS  68  -9.878  -5.173   4.082
  540    HB2  LYS  68           2HB      LYS  68 -11.100  -4.359   6.015
  541    HB3  LYS  68           1HB      LYS  68 -10.634  -6.027   6.296
  542    HG2  LYS  68           2HG      LYS  68  -8.781  -5.251   7.760
  543    HG3  LYS  68           1HG      LYS  68  -9.280  -3.586   7.484
  544    HD2  LYS  68           2HD      LYS  68 -10.251  -4.050   9.562
  545    HD3  LYS  68           1HD      LYS  68 -11.591  -4.356   8.460
  546    HE2  LYS  68           2HE      LYS  68  -9.777  -6.510   9.613
  547    HE3  LYS  68           1HE      LYS  68 -11.349  -6.070  10.275
  548    HZ1  LYS  68           3HZ      LYS  68 -12.374  -6.761   8.210
  549    HZ2  LYS  68           1HZ      LYS  68 -11.476  -8.029   8.882
  550    HZ3  LYS  68           2HZ      LYS  68 -10.863  -7.169   7.562
  551    H    TYR  69           H        TYR  69  -7.158  -4.053   6.023
  552    HA   TYR  69           HA       TYR  69  -7.522  -1.243   5.375
  553    HB2  TYR  69           2HB      TYR  69  -5.268  -2.760   6.748
  554    HB3  TYR  69           1HB      TYR  69  -5.245  -1.019   6.485
  555    HD1  TYR  69           HD1      TYR  69  -7.023   0.413   7.589
  556    HD2  TYR  69           HD2      TYR  69  -6.494  -3.682   8.639
  557    HE1  TYR  69           HE1      TYR  69  -8.246   0.796   9.670
  558    HE2  TYR  69           HE2      TYR  69  -7.725  -3.303  10.734
  559    HH   TYR  69           HH       TYR  69  -9.493  -0.402  11.307
  560    H    PHE  70           H        PHE  70  -5.503  -3.939   4.371
  561    HA   PHE  70           HA       PHE  70  -3.947  -2.311   2.518
  562    HB2  PHE  70           2HB      PHE  70  -3.697  -5.132   3.569
  563    HB3  PHE  70           1HB      PHE  70  -2.816  -4.657   2.118
  564    HD1  PHE  70           HD2      PHE  70  -3.415  -3.430   5.629
  565    HD2  PHE  70           HD1      PHE  70  -0.665  -3.771   2.373
  566    HE1  PHE  70           HE2      PHE  70  -1.661  -2.382   6.986
  567    HE2  PHE  70           HE1      PHE  70   1.074  -2.723   3.745
  568    HZ   PHE  70           HZ       PHE  70   0.584  -2.026   6.042
  569    H    LYS  71           H        LYS  71  -6.883  -3.232   2.253
  570    HA   LYS  71           HA       LYS  71  -7.434  -5.114   0.407
  571    HB2  LYS  71           2HB      LYS  71  -8.852  -3.172   1.752
  572    HB3  LYS  71           1HB      LYS  71  -8.967  -2.554   0.115
  573    HG2  LYS  71           2HG      LYS  71  -9.777  -5.025  -0.412
  574    HG3  LYS  71           1HG      LYS  71 -10.118  -5.046   1.318
  575    HD2  LYS  71           2HD      LYS  71 -11.319  -3.263  -0.815
  576    HD3  LYS  71           1HD      LYS  71 -12.149  -4.365   0.279
  577    HE2  LYS  71           2HE      LYS  71 -10.837  -1.730   1.026
  578    HE3  LYS  71           1HE      LYS  71 -12.567  -2.049   0.936
  579    HZ1  LYS  71           3HZ      LYS  71 -12.338  -3.622   2.756
  580    HZ2  LYS  71           1HZ      LYS  71 -11.769  -2.095   3.206
  581    HZ3  LYS  71           2HZ      LYS  71 -10.673  -3.324   2.829
  582    H    ASP  72           H        ASP  72  -6.776  -1.693  -0.260
  583    HA   ASP  72           HA       ASP  72  -5.683  -2.091  -2.870
  584    HB2  ASP  72           2HB      ASP  72  -7.433  -0.975  -4.180
  585    HB3  ASP  72           1HB      ASP  72  -8.091  -2.414  -3.408
  586    H    LEU  73           H        LEU  73  -5.968   0.407  -3.933
  587    HA   LEU  73           HA       LEU  73  -4.077   1.825  -2.358
  588    HB2  LEU  73           2HB      LEU  73  -4.210   1.810  -4.857
  589    HB3  LEU  73           1HB      LEU  73  -5.626   2.830  -4.766
  590    HG   LEU  73           HG       LEU  73  -3.031   3.811  -3.544
  591   HD11  LEU  73          1HD1      LEU  73  -2.355   4.770  -5.688
  592   HD12  LEU  73          2HD1      LEU  73  -3.710   3.988  -6.495
  593   HD13  LEU  73          3HD1      LEU  73  -2.416   3.008  -5.791
  594   HD21  LEU  73          3HD2      LEU  73  -5.338   5.259  -4.902
  595   HD22  LEU  73          1HD2      LEU  73  -3.900   6.030  -4.223
  596   HD23  LEU  73          2HD2      LEU  73  -5.030   5.189  -3.167
  597    H    ASN  74           H        ASN  74  -7.514   2.193  -2.917
  598    HA   ASN  74           HA       ASN  74  -7.730   4.783  -1.627
  599    HB2  ASN  74           2HB      ASN  74  -9.942   2.824  -2.396
  600    HB3  ASN  74           1HB      ASN  74 -10.159   4.523  -1.984
  601   HD21  ASN  74          1HD2      ASN  74  -9.059   2.276  -4.394
  602   HD22  ASN  74          2HD2      ASN  74  -8.905   3.411  -5.691
  603    H    ALA  75           H        ALA  75  -8.133   1.411  -0.646
  604    HA   ALA  75           HA       ALA  75  -9.273   1.913   1.924
  605    HB1  ALA  75           3HB      ALA  75  -9.396  -0.277   0.847
  606    HB2  ALA  75           1HB      ALA  75  -8.644  -0.397   2.439
  607    HB3  ALA  75           2HB      ALA  75  -7.646  -0.456   0.980
  608    H    ILE  76           H        ILE  76  -5.911   1.180   0.922
  609    HA   ILE  76           HA       ILE  76  -4.671   1.752   3.392
  610    HB   ILE  76           HB       ILE  76  -3.551   1.740   0.560
  611   HG12  ILE  76          2HG1      ILE  76  -3.337  -0.178   2.906
  612   HG13  ILE  76          1HG1      ILE  76  -4.117  -0.472   1.359
  613   HG21  ILE  76          1HG2      ILE  76  -2.194   3.348   1.855
  614   HG22  ILE  76          2HG2      ILE  76  -1.264   1.900   1.473
  615   HG23  ILE  76          3HG2      ILE  76  -1.919   2.124   3.096
  616   HD11  ILE  76          3HD1      ILE  76  -2.083  -1.684   1.451
  617   HD12  ILE  76          1HD1      ILE  76  -1.164  -0.243   1.893
  618   HD13  ILE  76          2HD1      ILE  76  -1.890  -0.374   0.285
  619    H    SER  77           H        SER  77  -5.676   3.803   0.714
  620    HA   SER  77           HA       SER  77  -4.276   6.156   1.295
  621    HB2  SER  77           2HB      SER  77  -5.575   5.992  -0.759
  622    HB3  SER  77           1HB      SER  77  -7.080   5.800   0.141
  623    HG   SER  77           HG       SER  77  -6.774   7.968   0.893
  624    H    ARG  78           H        ARG  78  -7.555   5.251   2.376
  625    HA   ARG  78           HA       ARG  78  -7.893   7.511   4.065
  626    HB2  ARG  78           2HB      ARG  78  -9.302   4.819   3.964
  627    HB3  ARG  78           1HB      ARG  78  -9.818   6.134   5.020
  628    HG2  ARG  78           2HG      ARG  78  -9.772   6.153   1.987
  629    HG3  ARG  78           1HG      ARG  78 -11.194   6.143   3.035
  630    HD2  ARG  78           2HD      ARG  78 -10.611   8.378   3.880
  631    HD3  ARG  78           1HD      ARG  78  -9.144   8.387   2.890
  632    HE   ARG  78           HE       ARG  78 -11.796   8.147   1.637
  633   HH11  ARG  78          1HH1      ARG  78  -8.833  10.011   2.045
  634   HH12  ARG  78          2HH1      ARG  78  -9.203  11.081   0.730
  635   HH21  ARG  78          1HH2      ARG  78 -12.231   9.497  -0.083
  636   HH22  ARG  78          2HH2      ARG  78 -11.142  10.789  -0.486
  637    H    THR  79           H        THR  79  -6.493   4.341   4.624
  638    HA   THR  79           HA       THR  79  -6.390   4.606   7.484
  639    HB   THR  79           HB       THR  79  -4.960   2.614   5.688
  640    HG1  THR  79           HG1      THR  79  -7.141   2.297   5.490
  641   HG21  THR  79          3HG2      THR  79  -5.471   2.518   8.692
  642   HG22  THR  79          1HG2      THR  79  -3.894   2.792   7.939
  643   HG23  THR  79          2HG2      THR  79  -4.722   1.241   7.735
  644    H    VAL  80           H        VAL  80  -4.176   5.337   4.852
  645    HA   VAL  80           HA       VAL  80  -1.892   5.556   6.636
  646    HB   VAL  80           HB       VAL  80  -1.666   4.717   4.240
  647   HG11  VAL  80          1HG1      VAL  80  -3.069   6.339   3.045
  648   HG12  VAL  80          2HG1      VAL  80  -1.430   6.312   2.392
  649   HG13  VAL  80          3HG1      VAL  80  -1.934   7.632   3.449
  650   HG21  VAL  80          3HG2      VAL  80   0.508   5.795   3.853
  651   HG22  VAL  80          1HG2      VAL  80   0.278   5.375   5.551
  652   HG23  VAL  80          2HG2      VAL  80   0.093   7.048   5.025
  653    H    GLU  81           H        GLU  81  -4.148   7.651   4.906
  654    HA   GLU  81           HA       GLU  81  -2.765  10.118   5.283
  655    HB2  GLU  81           2HB      GLU  81  -5.713   9.571   4.743
  656    HB3  GLU  81           1HB      GLU  81  -4.985  11.172   4.711
  657    HG2  GLU  81           2HG      GLU  81  -3.628  10.578   2.790
  658    HG3  GLU  81           1HG      GLU  81  -4.165   8.902   2.880
  659    H    GLN  82           H        GLN  82  -5.239   8.363   7.130
  660    HA   GLN  82           HA       GLN  82  -5.661  10.371   9.085
  661    HB2  GLN  82           2HB      GLN  82  -6.794   8.745  10.424
  662    HB3  GLN  82           1HB      GLN  82  -7.219   8.435   8.750
  663    HG2  GLN  82           2HG      GLN  82  -5.718   6.518   8.680
  664    HG3  GLN  82           1HG      GLN  82  -5.166   6.849  10.321
  665   HE21  GLN  82          1HE2      GLN  82  -6.605   6.423  12.070
  666   HE22  GLN  82          2HE2      GLN  82  -7.972   5.385  11.873
  667    H    LEU  83           H        LEU  83  -3.181   7.806   8.756
  668    HA   LEU  83           HA       LEU  83  -2.454   7.727  11.516
  669    HB2  LEU  83           2HB      LEU  83  -0.979   6.884   9.005
  670    HB3  LEU  83           1HB      LEU  83  -0.295   6.669  10.609
  671    HG   LEU  83           HG       LEU  83  -2.896   5.396   9.676
  672   HD11  LEU  83          1HD1      LEU  83  -0.144   4.150   9.977
  673   HD12  LEU  83          2HD1      LEU  83  -0.976   4.471   8.454
  674   HD13  LEU  83          3HD1      LEU  83  -1.637   3.292   9.582
  675   HD21  LEU  83          3HD2      LEU  83  -1.275   4.980  12.210
  676   HD22  LEU  83          1HD2      LEU  83  -2.684   4.031  11.726
  677   HD23  LEU  83          2HD2      LEU  83  -2.863   5.744  12.092
  678    H    LYS  84           H        LYS  84  -1.188   9.591   8.767
  679    HA   LYS  84           HA       LYS  84   0.951  10.858  10.170
  680    HB2  LYS  84           2HB      LYS  84  -0.559  11.904   7.726
  681    HB3  LYS  84           1HB      LYS  84   1.013  12.457   8.284
  682    HG2  LYS  84           2HG      LYS  84   1.970  10.941   6.912
  683    HG3  LYS  84           1HG      LYS  84   1.335   9.673   7.955
  684    HD2  LYS  84           2HD      LYS  84   0.619   9.033   5.829
  685    HD3  LYS  84           1HD      LYS  84  -0.804   9.821   6.502
  686    HE2  LYS  84           2HE      LYS  84   1.154  11.021   4.527
  687    HE3  LYS  84           1HE      LYS  84  -0.467  10.435   4.165
  688    HZ1  LYS  84           3HZ      LYS  84   0.222  12.759   5.876
  689    HZ2  LYS  84           1HZ      LYS  84  -1.348  12.184   5.616
  690    HZ3  LYS  84           2HZ      LYS  84  -0.452  12.811   4.328
  691    H    ALA  85           H        ALA  85  -2.460  11.614   9.779
  692    HA   ALA  85           HA       ALA  85  -2.438  14.165  11.093
  693    HB1  ALA  85           3HB      ALA  85  -4.220  13.464   9.514
  694    HB2  ALA  85           1HB      ALA  85  -4.874  13.948  11.082
  695    HB3  ALA  85           2HB      ALA  85  -4.742  12.234  10.671
  696    H    GLU  86           H        GLU  86  -2.827  10.818  12.159
  697    HA   GLU  86           HA       GLU  86  -3.793  11.446  14.800
  698    HB2  GLU  86           2HB      GLU  86  -2.673   8.815  13.744
  699    HB3  GLU  86           1HB      GLU  86  -3.535   9.034  15.261
  700    HG2  GLU  86           2HG      GLU  86  -4.631   9.163  12.460
  701    HG3  GLU  86           1HG      GLU  86  -5.067   8.058  13.743
  702    H    SER  87           H        SER  87  -0.706  10.708  13.311
  703    HA   SER  87           HA       SER  87   0.801  10.487  15.743
  704    HB2  SER  87           2HB      SER  87   1.681  11.023  12.874
  705    HB3  SER  87           1HB      SER  87   2.768  10.632  14.211
  706    HG   SER  87           HG       SER  87   0.606   8.960  13.490
  707    H    ALA  88           H        ALA  88  -0.300  13.153  13.749
  708    HA   ALA  88           HA       ALA  88   1.436  15.197  14.652
  709    HB1  ALA  88           3HB      ALA  88  -1.428  15.445  13.663
  710    HB2  ALA  88           1HB      ALA  88   0.017  15.418  12.650
  711    HB3  ALA  88           2HB      ALA  88  -0.248  16.757  13.769
  712    H    LEU  89           H        LEU  89   0.349  17.223  15.824
  713    HA   LEU  89           HA       LEU  89  -0.004  16.405  18.555
  714    HB2  LEU  89           2HB      LEU  89  -0.078  18.886  19.005
  715    HB3  LEU  89           1HB      LEU  89   1.350  18.293  18.186
  716    HG   LEU  89           HG       LEU  89   0.218  19.113  15.989
  717   HD11  LEU  89          1HD1      LEU  89  -1.298  21.034  16.209
  718   HD12  LEU  89          2HD1      LEU  89  -1.418  20.744  17.948
  719   HD13  LEU  89          3HD1      LEU  89  -2.030  19.546  16.804
  720   HD21  LEU  89          3HD2      LEU  89   1.141  21.358  16.274
  721   HD22  LEU  89          1HD2      LEU  89   2.205  20.129  16.953
  722   HD23  LEU  89          2HD2      LEU  89   1.207  21.119  18.022
  723    H    GLU  90           H        GLU  90  -2.216  16.485  16.140
  724    HA   GLU  90           HA       GLU  90  -4.534  17.519  17.456
  725    HB2  GLU  90           2HB      GLU  90  -4.235  15.644  15.071
  726    HB3  GLU  90           1HB      GLU  90  -5.738  16.413  15.563
  727    HG2  GLU  90           2HG      GLU  90  -3.243  17.864  14.640
  728    HG3  GLU  90           1HG      GLU  90  -4.677  17.559  13.659
  729   H281  4EM 101          2H28      PYA 142   1.022 -10.076   8.241
  730   H283  4EM 101          3H28      PYA 142   2.201 -10.640   9.428
  731   H303  4EM 101          3H30      PYA 142  -1.937 -11.603   9.979
  732   H301  4EM 101          1H30      PYA 142  -1.028 -12.382   8.680
  733   H302  4EM 101          2H30      PYA 142  -1.455 -10.669   8.567
  734   H312  4EM 101          2H31      PYA 142   0.845  -9.455  11.170
  735   H313  4EM 101          3H31      PYA 142  -0.342  -8.989   9.956
  736   H311  4EM 101          1H31      PYA 142  -0.863  -9.860  11.402
  737    H32  4EM 101           H32      PYA 142   1.339 -11.747  11.599
  738    H33  4EM 101           H33      PYA 142  -0.385 -13.050  12.511
  739    H36  4EM 101           H36      PYA 142  -0.396 -13.662   8.996
  740   H373  4EM 101          3H37      PYA 142   0.830 -15.369   7.849
  741   H372  4EM 101          2H37      PYA 142   1.658 -15.764   9.352
  742   H382  4EM 101          2H38      PYA 142  -0.471 -16.611  10.266
  743   H383  4EM 101          3H38      PYA 142   0.098 -17.504   8.863
  744    H41  4EM 101           H41      PYA 142  -1.088 -14.985   7.184
  745   H423  4EM 101          3H42      PYA 142  -3.824 -14.846   7.439
  746   H422  4EM 101          2H42      PYA 142  -3.562 -16.374   6.609
  747   H433  4EM 101          3H43      PYA 142  -4.089 -14.783   4.940
  748   H432  4EM 101          2H43      PYA 142  -2.362 -15.080   4.809
  749    H44  4EM 101           H44      PYA 142  -3.675 -12.768   5.221
  750    H49  4EM 101           H49      PYA 142   0.111 -10.729   6.385
  751    H51  4EM 101           H51      PYA 142  -0.916  -8.360   5.947
  752    H50  4EM 101           H50      PYA 142  -3.411  -8.668   5.254
  753    H48  4EM 101           H48      PYA 142  -3.892 -11.189   5.357
  Start of MODEL   20
    1    H1   MET   1           1H       MET   1   5.594  16.931  -3.263
    2    H2   MET   1           2H       MET   1   4.773  18.277  -3.851
    3    H3   MET   1           3H       MET   1   5.977  17.548  -4.787
    4    HA   MET   1           HA       MET   1   3.752  17.037  -5.545
    5    HB2  MET   1           2HB      MET   1   4.111  14.584  -5.707
    6    HB3  MET   1           1HB      MET   1   5.573  15.496  -6.037
    7    HG2  MET   1           2HG      MET   1   6.274  13.644  -4.762
    8    HG3  MET   1           1HG      MET   1   6.263  14.984  -3.615
    9    HE1  MET   1           3HE      MET   1   5.203  11.742  -1.542
   10    HE2  MET   1           1HE      MET   1   6.414  13.014  -1.692
   11    HE3  MET   1           2HE      MET   1   6.288  11.760  -2.931
   12    H    ASP   2           H        ASP   2   1.813  15.733  -5.153
   13    HA   ASP   2           HA       ASP   2   0.835  16.126  -2.400
   14    HB2  ASP   2           2HB      ASP   2  -0.669  15.571  -5.006
   15    HB3  ASP   2           1HB      ASP   2  -1.448  15.746  -3.433
   16    H    GLY   3           H        GLY   3  -1.031  14.455  -1.865
   17    HA2  GLY   3           2HA      GLY   3   0.113  11.943  -1.280
   18    HA3  GLY   3           1HA      GLY   3  -1.584  12.367  -1.133
   19    H    GLU   4           H        GLU   4  -2.091  13.014  -3.831
   20    HA   GLU   4           HA       GLU   4  -2.826  10.633  -5.029
   21    HB2  GLU   4           2HB      GLU   4  -2.196  13.281  -6.363
   22    HB3  GLU   4           1HB      GLU   4  -3.054  11.953  -7.142
   23    HG2  GLU   4           2HG      GLU   4  -3.990  13.421  -4.670
   24    HG3  GLU   4           1HG      GLU   4  -4.563  13.708  -6.303
   25    H    GLU   5           H        GLU   5   0.164  12.448  -5.463
   26    HA   GLU   5           HA       GLU   5   1.320  11.016  -7.595
   27    HB2  GLU   5           2HB      GLU   5   2.243  13.143  -7.001
   28    HB3  GLU   5           1HB      GLU   5   2.486  12.662  -5.326
   29    HG2  GLU   5           2HG      GLU   5   4.605  12.843  -6.545
   30    HG3  GLU   5           1HG      GLU   5   4.333  11.210  -5.960
   31    H    VAL   6           H        VAL   6   1.770  10.662  -4.068
   32    HA   VAL   6           HA       VAL   6   3.732   8.627  -4.353
   33    HB   VAL   6           HB       VAL   6   3.670  10.117  -2.368
   34   HG11  VAL   6          1HG1      VAL   6   1.270   8.494  -1.445
   35   HG12  VAL   6          2HG1      VAL   6   1.267  10.207  -1.869
   36   HG13  VAL   6          3HG1      VAL   6   2.168   9.653  -0.459
   37   HG21  VAL   6          3HG2      VAL   6   3.559   7.158  -1.727
   38   HG22  VAL   6          1HG2      VAL   6   4.295   8.399  -0.709
   39   HG23  VAL   6          2HG2      VAL   6   4.969   8.050  -2.302
   40    H    LYS   7           H        LYS   7   0.237   8.567  -4.010
   41    HA   LYS   7           HA       LYS   7  -0.370   5.969  -3.268
   42    HB2  LYS   7           2HB      LYS   7  -1.666   7.537  -5.537
   43    HB3  LYS   7           1HB      LYS   7  -2.367   6.113  -4.769
   44    HG2  LYS   7           2HG      LYS   7  -2.474   7.397  -2.618
   45    HG3  LYS   7           1HG      LYS   7  -1.926   8.819  -3.505
   46    HD2  LYS   7           2HD      LYS   7  -4.566   7.383  -3.678
   47    HD3  LYS   7           1HD      LYS   7  -4.242   9.111  -3.525
   48    HE2  LYS   7           2HE      LYS   7  -3.445   9.149  -5.883
   49    HE3  LYS   7           1HE      LYS   7  -3.845   7.438  -6.036
   50    HZ1  LYS   7           3HZ      LYS   7  -5.550   8.888  -6.933
   51    HZ2  LYS   7           1HZ      LYS   7  -5.778   9.593  -5.417
   52    HZ3  LYS   7           2HZ      LYS   7  -6.146   7.964  -5.654
   53    H    GLU   8           H        GLU   8   0.287   7.121  -6.571
   54    HA   GLU   8           HA       GLU   8   0.131   4.705  -7.914
   55    HB2  GLU   8           2HB      GLU   8  -0.013   6.901  -9.042
   56    HB3  GLU   8           1HB      GLU   8   1.668   7.245  -8.626
   57    HG2  GLU   8           2HG      GLU   8   2.398   5.356  -9.958
   58    HG3  GLU   8           1HG      GLU   8   0.734   4.955 -10.322
   59    H    LYS   9           H        LYS   9   2.872   6.341  -6.334
   60    HA   LYS   9           HA       LYS   9   4.898   4.573  -7.280
   61    HB2  LYS   9           2HB      LYS   9   4.942   6.279  -4.767
   62    HB3  LYS   9           1HB      LYS   9   6.338   5.550  -5.555
   63    HG2  LYS   9           2HG      LYS   9   5.705   6.957  -7.617
   64    HG3  LYS   9           1HG      LYS   9   4.625   7.844  -6.536
   65    HD2  LYS   9           2HD      LYS   9   7.637   7.555  -6.269
   66    HD3  LYS   9           1HD      LYS   9   6.757   9.010  -6.728
   67    HE2  LYS   9           2HE      LYS   9   5.790   9.183  -4.496
   68    HE3  LYS   9           1HE      LYS   9   6.514   7.644  -4.023
   69    HZ1  LYS   9           3HZ      LYS   9   8.699   8.641  -4.394
   70    HZ2  LYS   9           1HZ      LYS   9   7.819   9.427  -3.183
   71    HZ3  LYS   9           2HZ      LYS   9   7.967  10.134  -4.714
   72    H    ILE  10           H        ILE  10   2.748   4.480  -4.470
   73    HA   ILE  10           HA       ILE  10   4.007   2.385  -3.021
   74    HB   ILE  10           HB       ILE  10   1.027   3.015  -3.148
   75   HG12  ILE  10          2HG1      ILE  10   2.200   5.044  -2.476
   76   HG13  ILE  10          1HG1      ILE  10   1.388   4.380  -1.072
   77   HG21  ILE  10          1HG2      ILE  10   2.595   1.547  -1.014
   78   HG22  ILE  10          2HG2      ILE  10   1.422   0.838  -2.123
   79   HG23  ILE  10          3HG2      ILE  10   0.890   1.989  -0.895
   80   HD11  ILE  10          3HD1      ILE  10   3.508   3.501  -0.247
   81   HD12  ILE  10          1HD1      ILE  10   3.601   5.239  -0.538
   82   HD13  ILE  10          2HD1      ILE  10   4.330   4.118  -1.685
   83    H    ARG  11           H        ARG  11   1.770   2.432  -5.735
   84    HA   ARG  11           HA       ARG  11   1.239  -0.416  -5.755
   85    HB2  ARG  11           2HB      ARG  11   0.653   1.731  -7.820
   86    HB3  ARG  11           1HB      ARG  11   0.060   0.079  -7.889
   87    HG2  ARG  11           2HG      ARG  11  -0.603   2.079  -5.720
   88    HG3  ARG  11           1HG      ARG  11  -1.635   1.688  -7.095
   89    HD2  ARG  11           2HD      ARG  11  -2.523   0.445  -5.294
   90    HD3  ARG  11           1HD      ARG  11  -1.610  -0.736  -6.224
   91    HE   ARG  11           HE       ARG  11   0.209  -0.404  -4.512
   92   HH11  ARG  11          1HH1      ARG  11  -3.139   0.129  -3.644
   93   HH12  ARG  11          2HH1      ARG  11  -2.872  -0.216  -1.970
   94   HH21  ARG  11          1HH2      ARG  11   0.561  -0.855  -2.357
   95   HH22  ARG  11          2HH2      ARG  11  -0.755  -0.777  -1.246
   96    H    ARG  12           H        ARG  12   3.030   1.805  -7.843
   97    HA   ARG  12           HA       ARG  12   3.979  -0.027  -9.746
   98    HB2  ARG  12           2HB      ARG  12   4.712   2.761  -8.898
   99    HB3  ARG  12           1HB      ARG  12   5.906   1.894  -9.850
  100    HG2  ARG  12           2HG      ARG  12   4.408   3.387 -11.194
  101    HG3  ARG  12           1HG      ARG  12   4.398   1.706 -11.721
  102    HD2  ARG  12           2HD      ARG  12   2.246   1.326 -10.759
  103    HD3  ARG  12           1HD      ARG  12   2.297   2.843  -9.866
  104    HE   ARG  12           HE       ARG  12   2.342   3.848 -12.264
  105   HH11  ARG  12          1HH1      ARG  12   0.457   1.091 -11.259
  106   HH12  ARG  12          2HH1      ARG  12  -0.814   1.400 -12.397
  107   HH21  ARG  12          1HH2      ARG  12   0.623   4.325 -13.644
  108   HH22  ARG  12          2HH2      ARG  12  -0.720   3.233 -13.753
  109    H    TYR  13           H        TYR  13   5.338   1.085  -6.693
  110    HA   TYR  13           HA       TYR  13   7.837  -0.156  -6.707
  111    HB2  TYR  13           2HB      TYR  13   7.275   1.455  -4.997
  112    HB3  TYR  13           1HB      TYR  13   5.939   0.475  -4.401
  113    HD1  TYR  13           HD1      TYR  13   9.677   0.181  -4.951
  114    HD2  TYR  13           HD2      TYR  13   6.355  -0.748  -2.420
  115    HE1  TYR  13           HE1      TYR  13  11.203  -0.817  -3.319
  116    HE2  TYR  13           HE2      TYR  13   7.893  -1.739  -0.781
  117    HH   TYR  13           HH       TYR  13  10.226  -2.785  -0.840
  118    H    ILE  14           H        ILE  14   4.680  -1.484  -5.709
  119    HA   ILE  14           HA       ILE  14   5.549  -4.014  -4.801
  120    HB   ILE  14           HB       ILE  14   2.839  -3.313  -6.016
  121   HG12  ILE  14          2HG1      ILE  14   3.636  -3.345  -3.077
  122   HG13  ILE  14          1HG1      ILE  14   3.500  -1.884  -4.043
  123   HG21  ILE  14          1HG2      ILE  14   3.623  -5.645  -4.215
  124   HG22  ILE  14          2HG2      ILE  14   3.186  -5.753  -5.920
  125   HG23  ILE  14          3HG2      ILE  14   1.978  -5.264  -4.734
  126   HD11  ILE  14          3HD1      ILE  14   1.552  -2.213  -2.656
  127   HD12  ILE  14          1HD1      ILE  14   1.260  -3.787  -3.391
  128   HD13  ILE  14          2HD1      ILE  14   1.113  -2.318  -4.361
  129    H    MET  15           H        MET  15   4.344  -2.938  -7.983
  130    HA   MET  15           HA       MET  15   4.411  -5.549  -9.153
  131    HB2  MET  15           2HB      MET  15   4.379  -2.893 -10.659
  132    HB3  MET  15           1HB      MET  15   3.801  -4.458 -11.225
  133    HG2  MET  15           2HG      MET  15   2.564  -2.697  -9.104
  134    HG3  MET  15           1HG      MET  15   1.884  -3.130 -10.672
  135    HE1  MET  15           3HE      MET  15   2.426  -6.267 -10.845
  136    HE2  MET  15           1HE      MET  15   0.878  -5.511 -11.231
  137    HE3  MET  15           2HE      MET  15   0.938  -6.895 -10.134
  138    H    GLU  16           H        GLU  16   6.571  -2.717  -9.566
  139    HA   GLU  16           HA       GLU  16   8.254  -3.955 -11.500
  140    HB2  GLU  16           2HB      GLU  16   8.780  -1.498  -9.778
  141    HB3  GLU  16           1HB      GLU  16   9.694  -1.953 -11.213
  142    HG2  GLU  16           2HG      GLU  16   7.757  -1.599 -12.626
  143    HG3  GLU  16           1HG      GLU  16   6.743  -1.275 -11.216
  144    H    ASP  17           H        ASP  17   8.418  -3.673  -7.976
  145    HA   ASP  17           HA       ASP  17  11.126  -4.887  -7.970
  146    HB2  ASP  17           2HB      ASP  17  10.938  -2.783  -6.703
  147    HB3  ASP  17           1HB      ASP  17   9.622  -3.449  -5.741
  148    H    LEU  18           H        LEU  18   8.028  -5.186  -6.176
  149    HA   LEU  18           HA       LEU  18   8.929  -7.557  -4.825
  150    HB2  LEU  18           2HB      LEU  18   6.268  -6.109  -4.838
  151    HB3  LEU  18           1HB      LEU  18   6.519  -7.588  -3.939
  152    HG   LEU  18           HG       LEU  18   6.784  -5.852  -2.350
  153   HD11  LEU  18          1HD1      LEU  18   9.586  -6.669  -3.178
  154   HD12  LEU  18          2HD1      LEU  18   8.485  -7.592  -2.147
  155   HD13  LEU  18          3HD1      LEU  18   9.101  -6.038  -1.606
  156   HD21  LEU  18          3HD2      LEU  18   8.694  -4.387  -4.198
  157   HD22  LEU  18          1HD2      LEU  18   8.221  -3.888  -2.571
  158   HD23  LEU  18          2HD2      LEU  18   7.025  -3.925  -3.863
  159    H    ILE  19           H        ILE  19   6.723  -7.026  -7.568
  160    HA   ILE  19           HA       ILE  19   6.370  -9.878  -7.982
  161    HB   ILE  19           HB       ILE  19   5.595  -7.457  -9.650
  162   HG12  ILE  19          2HG1      ILE  19   3.270  -8.371  -9.402
  163   HG13  ILE  19          1HG1      ILE  19   3.915  -9.685  -8.445
  164   HG21  ILE  19          1HG2      ILE  19   6.390  -9.105 -11.280
  165   HG22  ILE  19          2HG2      ILE  19   4.638  -8.937 -11.390
  166   HG23  ILE  19          3HG2      ILE  19   5.340 -10.337 -10.574
  167   HD11  ILE  19          3HD1      ILE  19   2.838  -8.011  -7.080
  168   HD12  ILE  19          1HD1      ILE  19   3.953  -6.779  -7.681
  169   HD13  ILE  19          2HD1      ILE  19   4.558  -8.124  -6.702
  170    H    GLY  20           H        GLY  20   8.150  -7.214  -9.516
  171    HA2  GLY  20           2HA      GLY  20  10.598  -7.573  -9.735
  172    HA3  GLY  20           1HA      GLY  20  10.222  -9.139 -10.443
  173    HA   PRO  21           HA       PRO  21  10.936  -5.988 -13.806
  174    HB2  PRO  21           2HB      PRO  21  12.508  -7.554 -15.426
  175    HB3  PRO  21           1HB      PRO  21  13.153  -6.719 -13.999
  176    HG2  PRO  21           2HG      PRO  21  12.309  -9.587 -14.263
  177    HG3  PRO  21           1HG      PRO  21  13.774  -8.906 -13.513
  178    HD2  PRO  21           2HD      PRO  21  11.615  -9.654 -12.034
  179    HD3  PRO  21           1HD      PRO  21  12.666  -8.298 -11.561
  180    H    SER  22           H        SER  22   9.443  -9.106 -13.750
  181    HA   SER  22           HA       SER  22   8.066  -8.636 -16.333
  182    HB2  SER  22           2HB      SER  22   8.158 -11.131 -14.577
  183    HB3  SER  22           1HB      SER  22   7.345 -11.007 -16.135
  184    HG   SER  22           HG       SER  22  10.005 -10.249 -16.115
  185    H    ALA  23           H        ALA  23   7.383  -6.808 -14.628
  186    HA   ALA  23           HA       ALA  23   5.268  -7.399 -12.793
  187    HB1  ALA  23           3HB      ALA  23   6.209  -4.783 -14.006
  188    HB2  ALA  23           1HB      ALA  23   6.745  -5.491 -12.478
  189    HB3  ALA  23           2HB      ALA  23   5.081  -4.933 -12.653
  190    H    LYS  24           H        LYS  24   3.081  -6.437 -12.974
  191    HA   LYS  24           HA       LYS  24   1.997  -6.317 -15.739
  192    HB2  LYS  24           2HB      LYS  24   0.656  -7.638 -13.343
  193    HB3  LYS  24           1HB      LYS  24  -0.023  -7.503 -14.966
  194    HG2  LYS  24           2HG      LYS  24   1.750  -8.967 -15.847
  195    HG3  LYS  24           1HG      LYS  24   2.468  -9.079 -14.234
  196    HD2  LYS  24           2HD      LYS  24   0.284 -10.071 -13.419
  197    HD3  LYS  24           1HD      LYS  24  -0.260 -10.113 -15.098
  198    HE2  LYS  24           2HE      LYS  24   1.535 -11.646 -15.689
  199    HE3  LYS  24           1HE      LYS  24   2.223 -11.518 -14.068
  200    HZ1  LYS  24           3HZ      LYS  24   0.932 -13.547 -14.377
  201    HZ2  LYS  24           1HZ      LYS  24  -0.451 -12.623 -14.695
  202    HZ3  LYS  24           2HZ      LYS  24   0.276 -12.564 -13.172
  203    H    GLU  25           H        GLU  25   1.836  -4.054 -15.732
  204    HA   GLU  25           HA       GLU  25   0.410  -2.538 -13.768
  205    HB2  GLU  25           2HB      GLU  25  -0.076  -1.034 -16.030
  206    HB3  GLU  25           1HB      GLU  25   1.385  -0.952 -15.084
  207    HG2  GLU  25           2HG      GLU  25   1.849  -0.985 -17.486
  208    HG3  GLU  25           1HG      GLU  25   2.563  -2.359 -16.655
  209    H    ASP  26           H        ASP  26  -0.609  -4.779 -16.136
  210    HA   ASP  26           HA       ASP  26  -3.033  -3.969 -17.092
  211    HB2  ASP  26           2HB      ASP  26  -2.456  -6.815 -16.143
  212    HB3  ASP  26           1HB      ASP  26  -3.607  -6.343 -17.379
  213    H    GLU  27           H        GLU  27  -2.535  -6.048 -14.259
  214    HA   GLU  27           HA       GLU  27  -5.342  -5.883 -13.487
  215    HB2  GLU  27           2HB      GLU  27  -4.742  -7.641 -11.852
  216    HB3  GLU  27           1HB      GLU  27  -4.324  -8.060 -13.508
  217    HG2  GLU  27           2HG      GLU  27  -1.945  -7.336 -12.994
  218    HG3  GLU  27           1HG      GLU  27  -2.430  -7.204 -11.303
  219    H    LEU  28           H        LEU  28  -2.486  -4.275 -12.690
  220    HA   LEU  28           HA       LEU  28  -3.183  -3.515 -10.027
  221    HB2  LEU  28           2HB      LEU  28  -0.848  -3.471 -11.051
  222    HB3  LEU  28           1HB      LEU  28  -1.336  -2.067 -11.975
  223    HG   LEU  28           HG       LEU  28   0.030  -1.538  -9.928
  224   HD11  LEU  28          1HD1      LEU  28  -2.742  -0.298  -9.839
  225   HD12  LEU  28          2HD1      LEU  28  -1.414   0.226 -10.875
  226   HD13  LEU  28          3HD1      LEU  28  -1.274   0.371  -9.128
  227   HD21  LEU  28          3HD2      LEU  28  -2.397  -2.483  -8.355
  228   HD22  LEU  28          1HD2      LEU  28  -0.948  -1.728  -7.689
  229   HD23  LEU  28          2HD2      LEU  28  -0.841  -3.314  -8.446
  230    H    ASP  29           H        ASP  29  -4.817  -2.210  -9.560
  231    HA   ASP  29           HA       ASP  29  -5.343   0.210 -11.117
  232    HB2  ASP  29           2HB      ASP  29  -6.939  -1.674 -11.888
  233    HB3  ASP  29           1HB      ASP  29  -7.577  -1.680 -10.242
  234    H    ASP  30           H        ASP  30  -6.993   1.557  -9.765
  235    HA   ASP  30           HA       ASP  30  -6.083   1.825  -7.086
  236    HB2  ASP  30           2HB      ASP  30  -6.651   3.825  -8.343
  237    HB3  ASP  30           1HB      ASP  30  -8.270   3.218  -8.671
  238    H    GLN  31           H        GLN  31  -9.098   0.708  -8.587
  239    HA   GLN  31           HA       GLN  31 -10.230   0.056  -5.933
  240    HB2  GLN  31           2HB      GLN  31 -11.583   0.452  -8.632
  241    HB3  GLN  31           1HB      GLN  31 -12.424  -0.024  -7.156
  242    HG2  GLN  31           2HG      GLN  31 -11.666   2.080  -6.066
  243    HG3  GLN  31           1HG      GLN  31 -10.912   2.575  -7.581
  244   HE21  GLN  31          1HE2      GLN  31 -12.168   4.428  -7.667
  245   HE22  GLN  31          2HE2      GLN  31 -13.845   4.391  -8.086
  246    H    THR  32           H        THR  32  -8.323  -1.601  -7.770
  247    HA   THR  32           HA       THR  32  -9.781  -4.130  -7.828
  248    HB   THR  32           HB       THR  32  -6.899  -3.406  -8.452
  249    HG1  THR  32           HG1      THR  32  -9.253  -3.946  -9.918
  250   HG21  THR  32          3HG2      THR  32  -6.881  -5.726  -7.587
  251   HG22  THR  32          1HG2      THR  32  -6.631  -5.721  -9.333
  252   HG23  THR  32          2HG2      THR  32  -8.207  -6.163  -8.668
  253    HA   PRO  33           HA       PRO  33  -8.666  -4.884  -3.479
  254    HB2  PRO  33           2HB      PRO  33  -9.770  -7.387  -3.258
  255    HB3  PRO  33           1HB      PRO  33 -10.750  -5.911  -3.308
  256    HG2  PRO  33           2HG      PRO  33 -10.163  -7.841  -5.521
  257    HG3  PRO  33           1HG      PRO  33 -11.707  -7.077  -5.072
  258    HD2  PRO  33           2HD      PRO  33 -10.161  -6.158  -7.114
  259    HD3  PRO  33           1HD      PRO  33 -11.190  -5.086  -6.139
  260    H    LEU  34           H        LEU  34  -6.486  -5.110  -3.370
  261    HA   LEU  34           HA       LEU  34  -4.944  -6.941  -4.889
  262    HB2  LEU  34           2HB      LEU  34  -4.108  -5.298  -2.478
  263    HB3  LEU  34           1HB      LEU  34  -3.050  -5.966  -3.713
  264    HG   LEU  34           HG       LEU  34  -5.144  -3.813  -4.233
  265   HD11  LEU  34          1HD1      LEU  34  -2.150  -3.504  -3.935
  266   HD12  LEU  34          2HD1      LEU  34  -3.382  -2.944  -2.799
  267   HD13  LEU  34          3HD1      LEU  34  -3.289  -2.239  -4.409
  268   HD21  LEU  34          3HD2      LEU  34  -2.972  -4.915  -6.058
  269   HD22  LEU  34          1HD2      LEU  34  -4.010  -3.531  -6.423
  270   HD23  LEU  34          2HD2      LEU  34  -4.712  -5.136  -6.248
  271    H    LEU  35           H        LEU  35  -6.054  -6.928  -1.512
  272    HA   LEU  35           HA       LEU  35  -4.557  -9.214  -0.632
  273    HB2  LEU  35           2HB      LEU  35  -7.031  -7.853   0.472
  274    HB3  LEU  35           1HB      LEU  35  -6.445  -9.345   1.187
  275    HG   LEU  35           HG       LEU  35  -5.672  -7.430   2.474
  276   HD11  LEU  35          1HD1      LEU  35  -4.193  -9.382   2.398
  277   HD12  LEU  35          2HD1      LEU  35  -3.280  -7.889   2.573
  278   HD13  LEU  35          3HD1      LEU  35  -3.339  -8.702   1.008
  279   HD21  LEU  35          3HD2      LEU  35  -5.698  -5.724   0.756
  280   HD22  LEU  35          1HD2      LEU  35  -4.312  -6.466  -0.047
  281   HD23  LEU  35          2HD2      LEU  35  -4.138  -5.770   1.563
  282    H    GLU  36           H        GLU  36  -7.828  -8.793  -1.884
  283    HA   GLU  36           HA       GLU  36  -8.705 -11.466  -1.669
  284    HB2  GLU  36           2HB      GLU  36 -10.139  -9.428  -1.970
  285    HB3  GLU  36           1HB      GLU  36  -9.602  -9.317  -3.632
  286    HG2  GLU  36           2HG      GLU  36 -10.973 -11.824  -2.689
  287    HG3  GLU  36           1HG      GLU  36 -11.932 -10.386  -3.014
  288    H    TRP  37           H        TRP  37  -6.677  -9.819  -4.006
  289    HA   TRP  37           HA       TRP  37  -6.754 -12.073  -5.919
  290    HB2  TRP  37           2HB      TRP  37  -5.488  -9.310  -5.990
  291    HB3  TRP  37           1HB      TRP  37  -5.142 -10.524  -7.216
  292    HD1  TRP  37           HD1      TRP  37  -8.651  -9.621  -5.767
  293    HE1  TRP  37           HE1      TRP  37 -10.150  -8.880  -7.706
  294    HE3  TRP  37           HE3      TRP  37  -5.216  -9.809  -9.544
  295    HZ2  TRP  37           HZ2      TRP  37  -9.924  -8.434 -10.481
  296    HZ3  TRP  37           HZ3      TRP  37  -5.944  -9.209 -11.817
  297    HH2  TRP  37           HH2      TRP  37  -8.246  -8.536 -12.277
  298    H    GLY  38           H        GLY  38  -5.194 -11.474  -3.089
  299    HA2  GLY  38           2HA      GLY  38  -3.460 -12.500  -2.011
  300    HA3  GLY  38           1HA      GLY  38  -3.238 -13.524  -3.420
  301    H    ILE  39           H        ILE  39  -3.094 -10.196  -4.119
  302    HA   ILE  39           HA       ILE  39  -0.453 -10.279  -5.152
  303    HB   ILE  39           HB       ILE  39  -2.388  -7.964  -4.643
  304   HG12  ILE  39          2HG1      ILE  39  -1.670  -9.390  -7.245
  305   HG13  ILE  39          1HG1      ILE  39  -3.145  -9.653  -6.329
  306   HG21  ILE  39          1HG2      ILE  39  -0.112  -7.031  -4.690
  307   HG22  ILE  39          2HG2      ILE  39  -1.035  -6.531  -6.105
  308   HG23  ILE  39          3HG2      ILE  39   0.182  -7.802  -6.253
  309   HD11  ILE  39          3HD1      ILE  39  -3.569  -8.268  -8.258
  310   HD12  ILE  39          1HD1      ILE  39  -2.345  -7.109  -7.746
  311   HD13  ILE  39          2HD1      ILE  39  -3.814  -7.321  -6.790
  312    H    LEU  40           H        LEU  40  -1.872  -9.175  -2.134
  313    HA   LEU  40           HA       LEU  40   0.765  -8.289  -1.130
  314    HB2  LEU  40           2HB      LEU  40  -1.986  -7.634  -0.014
  315    HB3  LEU  40           1HB      LEU  40  -0.448  -6.958   0.505
  316    HG   LEU  40           HG       LEU  40  -1.818  -6.486  -2.168
  317   HD11  LEU  40          1HD1      LEU  40  -1.893  -4.126  -1.436
  318   HD12  LEU  40          2HD1      LEU  40  -1.294  -4.617   0.153
  319   HD13  LEU  40          3HD1      LEU  40  -2.853  -5.211  -0.437
  320   HD21  LEU  40          3HD2      LEU  40   0.570  -6.627  -2.572
  321   HD22  LEU  40          1HD2      LEU  40   0.898  -5.488  -1.261
  322   HD23  LEU  40          2HD2      LEU  40   0.041  -4.954  -2.710
  323    H    ASN  41           H        ASN  41   1.717  -9.914  -0.181
  324    HA   ASN  41           HA       ASN  41   0.488 -11.176   2.194
  325    HB2  ASN  41           2HB      ASN  41   2.054 -12.568  -0.035
  326    HB3  ASN  41           1HB      ASN  41   1.857 -13.276   1.564
  327   HD21  ASN  41          1HD2      ASN  41  -0.830 -12.523   2.045
  328   HD22  ASN  41          2HD2      ASN  41  -1.830 -13.407   0.957
  329    H    SER  42           H        SER  42   2.420 -12.078   3.624
  330    HA   SER  42           HA       SER  42   3.980  -9.745   4.179
  331    HB2  SER  42           3HB      SER  42   3.702 -12.427   5.518
  332    HB3  SER  42           2HB      SER  42   4.992 -11.333   6.029
  333    H    MET  43           H        MET  43   4.737 -11.696   1.762
  334    HA   MET  43           HA       MET  43   7.662 -11.647   2.171
  335    HB2  MET  43           2HB      MET  43   7.682 -12.801  -0.079
  336    HB3  MET  43           1HB      MET  43   6.905 -13.702   1.206
  337    HG2  MET  43           2HG      MET  43   4.891 -12.144  -0.185
  338    HG3  MET  43           1HG      MET  43   5.843 -13.056  -1.354
  339    HE1  MET  43           3HE      MET  43   3.820 -13.367   2.047
  340    HE2  MET  43           1HE      MET  43   5.257 -14.345   2.384
  341    HE3  MET  43           2HE      MET  43   3.683 -15.122   2.206
  342    H    ASN  44           H        ASN  44   5.276  -9.562   1.145
  343    HA   ASN  44           HA       ASN  44   7.150  -7.902  -0.386
  344    HB2  ASN  44           2HB      ASN  44   5.494  -7.528  -2.214
  345    HB3  ASN  44           1HB      ASN  44   6.059  -9.185  -2.130
  346   HD21  ASN  44          1HD2      ASN  44   4.344 -10.016  -3.256
  347   HD22  ASN  44          2HD2      ASN  44   2.727 -10.055  -2.658
  348    H    ILE  45           H        ILE  45   4.177  -8.183   1.438
  349    HA   ILE  45           HA       ILE  45   3.274  -5.493   1.228
  350    HB   ILE  45           HB       ILE  45   1.907  -7.587   1.835
  351   HG12  ILE  45          2HG1      ILE  45   1.508  -5.128   3.586
  352   HG13  ILE  45          1HG1      ILE  45   0.894  -5.327   1.946
  353   HG21  ILE  45          1HG2      ILE  45   1.704  -8.268   4.157
  354   HG22  ILE  45          2HG2      ILE  45   2.866  -7.031   4.664
  355   HG23  ILE  45          3HG2      ILE  45   3.399  -8.382   3.668
  356   HD11  ILE  45          3HD1      ILE  45  -0.830  -5.707   3.650
  357   HD12  ILE  45          1HD1      ILE  45   0.125  -7.041   4.310
  358   HD13  ILE  45          2HD1      ILE  45  -0.529  -7.152   2.674
  359    H    VAL  46           H        VAL  46   5.566  -7.103   3.248
  360    HA   VAL  46           HA       VAL  46   5.684  -5.293   5.454
  361    HB   VAL  46           HB       VAL  46   7.787  -7.269   4.467
  362   HG11  VAL  46          1HG1      VAL  46   7.428  -6.013   7.213
  363   HG12  VAL  46          2HG1      VAL  46   8.735  -5.671   6.077
  364   HG13  VAL  46          3HG1      VAL  46   8.602  -7.269   6.811
  365   HG21  VAL  46          3HG2      VAL  46   5.544  -7.702   6.478
  366   HG22  VAL  46          1HG2      VAL  46   6.802  -8.872   6.069
  367   HG23  VAL  46          2HG2      VAL  46   5.618  -8.384   4.852
  368    H    LYS  47           H        LYS  47   7.082  -5.390   2.290
  369    HA   LYS  47           HA       LYS  47   9.185  -3.490   2.699
  370    HB2  LYS  47           2HB      LYS  47   7.873  -4.588   0.197
  371    HB3  LYS  47           1HB      LYS  47   9.120  -3.347   0.129
  372    HG2  LYS  47           2HG      LYS  47  10.132  -5.462  -0.296
  373    HG3  LYS  47           1HG      LYS  47  10.682  -4.903   1.282
  374    HD2  LYS  47           2HD      LYS  47   9.351  -6.512   2.437
  375    HD3  LYS  47           1HD      LYS  47   8.360  -6.838   1.010
  376    HE2  LYS  47           2HE      LYS  47  10.014  -8.654   1.566
  377    HE3  LYS  47           1HE      LYS  47  10.151  -8.011  -0.068
  378    HZ1  LYS  47           3HZ      LYS  47  11.866  -7.186   2.198
  379    HZ2  LYS  47           1HZ      LYS  47  12.031  -6.736   0.577
  380    HZ3  LYS  47           2HZ      LYS  47  12.284  -8.342   1.040
  381    H    LEU  48           H        LEU  48   5.769  -3.314   1.946
  382    HA   LEU  48           HA       LEU  48   5.725  -0.530   1.274
  383    HB2  LEU  48           2HB      LEU  48   3.505  -2.393   2.213
  384    HB3  LEU  48           1HB      LEU  48   3.232  -0.692   1.873
  385    HG   LEU  48           HG       LEU  48   2.516  -1.898  -0.062
  386   HD11  LEU  48          1HD1      LEU  48   5.242  -0.709  -0.715
  387   HD12  LEU  48          2HD1      LEU  48   3.736   0.196  -0.542
  388   HD13  LEU  48          3HD1      LEU  48   3.913  -0.971  -1.849
  389   HD21  LEU  48          3HD2      LEU  48   5.209  -3.301  -0.149
  390   HD22  LEU  48          1HD2      LEU  48   3.917  -3.461  -1.342
  391   HD23  LEU  48          2HD2      LEU  48   3.669  -4.031   0.305
  392    H    MET  49           H        MET  49   5.466  -2.373   4.287
  393    HA   MET  49           HA       MET  49   4.563  -0.364   6.042
  394    HB2  MET  49           2HB      MET  49   6.515  -2.622   6.676
  395    HB3  MET  49           1HB      MET  49   5.590  -1.712   7.862
  396    HG2  MET  49           2HG      MET  49   3.519  -2.682   7.056
  397    HG3  MET  49           1HG      MET  49   4.377  -3.492   5.737
  398    HE1  MET  49           3HE      MET  49   3.584  -6.613   7.937
  399    HE2  MET  49           1HE      MET  49   3.670  -5.990   6.285
  400    HE3  MET  49           2HE      MET  49   2.549  -5.277   7.447
  401    H    VAL  50           H        VAL  50   7.879  -1.332   5.169
  402    HA   VAL  50           HA       VAL  50   9.156   0.773   6.660
  403    HB   VAL  50           HB       VAL  50  10.316  -1.383   6.243
  404   HG11  VAL  50          1HG1      VAL  50  10.479  -0.524   3.324
  405   HG12  VAL  50          2HG1      VAL  50   9.575  -1.899   3.962
  406   HG13  VAL  50          3HG1      VAL  50  11.336  -1.896   4.037
  407   HG21  VAL  50          3HG2      VAL  50  11.805   0.998   5.078
  408   HG22  VAL  50          1HG2      VAL  50  12.554  -0.477   5.695
  409   HG23  VAL  50          2HG2      VAL  50  11.678   0.593   6.789
  410    H    TYR  51           H        TYR  51   8.014   0.395   3.346
  411    HA   TYR  51           HA       TYR  51   9.463   2.436   2.033
  412    HB2  TYR  51           2HB      TYR  51   7.937   0.689   0.910
  413    HB3  TYR  51           1HB      TYR  51   6.578   1.683   1.382
  414    HD1  TYR  51           HD2      TYR  51   6.188   3.907   0.277
  415    HD2  TYR  51           HD1      TYR  51   9.458   1.417  -0.897
  416    HE1  TYR  51           HE2      TYR  51   6.458   5.236  -1.762
  417    HE2  TYR  51           HE1      TYR  51   9.728   2.749  -2.946
  418    HH   TYR  51           HH       TYR  51   8.268   5.770  -3.376
  419    H    ILE  52           H        ILE  52   6.269   2.461   3.528
  420    HA   ILE  52           HA       ILE  52   5.634   5.181   2.945
  421    HB   ILE  52           HB       ILE  52   4.356   3.260   4.957
  422   HG12  ILE  52          2HG1      ILE  52   3.374   3.838   2.129
  423   HG13  ILE  52          1HG1      ILE  52   4.520   2.543   2.447
  424   HG21  ILE  52          1HG2      ILE  52   3.705   5.598   5.362
  425   HG22  ILE  52          2HG2      ILE  52   2.339   4.655   4.767
  426   HG23  ILE  52          3HG2      ILE  52   3.193   5.755   3.684
  427   HD11  ILE  52          3HD1      ILE  52   1.741   2.757   3.585
  428   HD12  ILE  52          1HD1      ILE  52   2.903   1.462   3.896
  429   HD13  ILE  52          2HD1      ILE  52   2.276   1.710   2.269
  430    H    ARG  53           H        ARG  53   7.182   3.553   5.671
  431    HA   ARG  53           HA       ARG  53   7.219   5.896   7.364
  432    HB2  ARG  53           2HB      ARG  53   7.282   3.535   8.250
  433    HB3  ARG  53           1HB      ARG  53   8.938   3.403   7.664
  434    HG2  ARG  53           2HG      ARG  53   9.624   5.254   9.153
  435    HG3  ARG  53           1HG      ARG  53   7.959   5.431   9.710
  436    HD2  ARG  53           2HD      ARG  53   9.292   4.218  11.358
  437    HD3  ARG  53           1HD      ARG  53   8.050   3.166  10.681
  438    HE   ARG  53           HE       ARG  53   9.742   2.064   9.377
  439   HH11  ARG  53          1HH1      ARG  53  11.042   4.169  11.859
  440   HH12  ARG  53          2HH1      ARG  53  12.575   3.364  11.903
  441   HH21  ARG  53          1HH2      ARG  53  11.730   0.998   9.478
  442   HH22  ARG  53          2HH2      ARG  53  12.962   1.567  10.553
  443    H    ASP  54           H        ASP  54   9.271   4.655   4.842
  444    HA   ASP  54           HA       ASP  54  11.547   6.382   5.432
  445    HB2  ASP  54           2HB      ASP  54  11.717   4.067   4.356
  446    HB3  ASP  54           1HB      ASP  54  10.980   4.751   2.911
  447    H    GLU  55           H        GLU  55   8.690   6.374   3.492
  448    HA   GLU  55           HA       GLU  55   9.458   8.494   1.660
  449    HB2  GLU  55           2HB      GLU  55   8.171   6.511   0.895
  450    HB3  GLU  55           1HB      GLU  55   6.882   6.906   2.025
  451    HG2  GLU  55           2HG      GLU  55   6.184   7.538  -0.159
  452    HG3  GLU  55           1HG      GLU  55   6.474   9.010   0.757
  453    H    MET  56           H        MET  56   6.802   7.942   3.969
  454    HA   MET  56           HA       MET  56   6.313  10.872   4.174
  455    HB2  MET  56           2HB      MET  56   4.420   8.483   4.251
  456    HB3  MET  56           1HB      MET  56   3.922  10.086   4.776
  457    HG2  MET  56           2HG      MET  56   4.172  10.992   2.593
  458    HG3  MET  56           1HG      MET  56   5.033   9.569   2.013
  459    HE1  MET  56           3HE      MET  56   2.323   6.937   1.446
  460    HE2  MET  56           1HE      MET  56   3.563   7.054   2.697
  461    HE3  MET  56           2HE      MET  56   3.947   7.488   1.029
  462    H    GLY  57           H        GLY  57   7.557   8.321   5.943
  463    HA2  GLY  57           2HA      GLY  57   8.230   8.215   8.151
  464    HA3  GLY  57           1HA      GLY  57   7.459   9.771   8.440
  465    H    VAL  58           H        VAL  58   5.658   7.111   7.053
  466    HA   VAL  58           HA       VAL  58   3.979   6.962   9.495
  467    HB   VAL  58           HB       VAL  58   3.226   6.397   6.597
  468   HG11  VAL  58          1HG1      VAL  58   1.864   5.063   8.108
  469   HG12  VAL  58          2HG1      VAL  58   0.880   6.350   7.410
  470   HG13  VAL  58          3HG1      VAL  58   1.470   6.494   9.067
  471   HG21  VAL  58          3HG2      VAL  58   1.926   8.488   6.676
  472   HG22  VAL  58          1HG2      VAL  58   3.653   8.780   6.904
  473   HG23  VAL  58          2HG2      VAL  58   2.559   8.818   8.290
  474    H    SER  59           H        SER  59   4.252   5.098  10.596
  475    HA   SER  59           HA       SER  59   5.116   2.620   9.273
  476    HB2  SER  59           2HB      SER  59   5.293   1.837  11.710
  477    HB3  SER  59           1HB      SER  59   6.358   3.168  11.255
  478    HG   SER  59           HG       SER  59   3.833   3.488  12.544
  479    H    ILE  60           H        ILE  60   3.781   0.892   9.014
  480    HA   ILE  60           HA       ILE  60   1.010   0.950   9.946
  481    HB   ILE  60           HB       ILE  60   2.480  -1.139   8.275
  482   HG12  ILE  60          2HG1      ILE  60   2.056   1.164   7.179
  483   HG13  ILE  60          1HG1      ILE  60   1.433  -0.242   6.321
  484   HG21  ILE  60          1HG2      ILE  60   0.654  -2.181   9.520
  485   HG22  ILE  60          2HG2      ILE  60   0.213  -2.072   7.819
  486   HG23  ILE  60          3HG2      ILE  60  -0.479  -0.937   8.979
  487   HD11  ILE  60          3HD1      ILE  60  -0.151   1.617   6.301
  488   HD12  ILE  60          1HD1      ILE  60  -0.212   1.605   8.061
  489   HD13  ILE  60          2HD1      ILE  60  -0.823   0.223   7.147
  490    HA   PRO  61           HA       PRO  61   2.386  -1.625  13.508
  491    HB2  PRO  61           2HB      PRO  61   0.030  -1.510  14.901
  492    HB3  PRO  61           1HB      PRO  61   1.169  -0.148  14.860
  493    HG2  PRO  61           2HG      PRO  61  -1.321  -0.550  13.243
  494    HG3  PRO  61           1HG      PRO  61  -0.760   0.903  14.101
  495    HD2  PRO  61           2HD      PRO  61  -0.420   0.566  11.421
  496    HD3  PRO  61           1HD      PRO  61   0.729   1.485  12.414
  497    H    SER  62           H        SER  62   1.607  -3.685  14.422
  498    HA   SER  62           HA       SER  62   0.966  -5.539  12.371
  499    HB2  SER  62           2HB      SER  62   1.097  -7.212  14.279
  500    HB3  SER  62           1HB      SER  62   2.516  -6.176  14.096
  501    HG   SER  62           HG       SER  62   2.110  -5.998  16.195
  502    H    THR  63           H        THR  63  -0.997  -3.933  14.806
  503    HA   THR  63           HA       THR  63  -3.300  -5.639  14.616
  504    HB   THR  63           HB       THR  63  -2.960  -4.241  16.606
  505    HG1  THR  63           HG1      THR  63  -5.097  -3.428  16.719
  506   HG21  THR  63          3HG2      THR  63  -3.293  -1.805  16.576
  507   HG22  THR  63          1HG2      THR  63  -3.465  -1.833  14.820
  508   HG23  THR  63          2HG2      THR  63  -1.919  -2.246  15.562
  509    H    HIS  64           H        HIS  64  -2.010  -3.152  12.587
  510    HA   HIS  64           HA       HIS  64  -4.568  -2.824  11.128
  511    HB2  HIS  64           2HB      HIS  64  -2.039  -1.137  11.066
  512    HB3  HIS  64           1HB      HIS  64  -3.420  -0.886  10.000
  513    HD1  HIS  64           HD1      HIS  64  -4.893  -1.734  13.144
  514    HD2  HIS  64           HD2      HIS  64  -3.055   1.674  11.632
  515    HE1  HIS  64           HE1      HIS  64  -5.571   0.134  14.676
  516    HE2  HIS  64           HE2      HIS  64  -4.629   2.202  13.605
  517    H    ILE  65           H        ILE  65  -2.132  -4.976  11.064
  518    HA   ILE  65           HA       ILE  65  -2.006  -5.226   8.167
  519    HB   ILE  65           HB       ILE  65  -1.386  -7.565  10.048
  520   HG12  ILE  65          2HG1      ILE  65  -0.074  -5.698  10.923
  521   HG13  ILE  65          1HG1      ILE  65   0.997  -6.794  10.059
  522   HG21  ILE  65          1HG2      ILE  65  -1.502  -8.054   7.632
  523   HG22  ILE  65          2HG2      ILE  65   0.148  -8.223   8.230
  524   HG23  ILE  65          3HG2      ILE  65  -0.307  -6.794   7.301
  525   HD11  ILE  65          3HD1      ILE  65  -0.089  -4.180   9.039
  526   HD12  ILE  65          1HD1      ILE  65   0.963  -5.273   8.136
  527   HD13  ILE  65          2HD1      ILE  65   1.549  -4.497   9.609
  528    H    THR  66           H        THR  66  -4.070  -5.216   7.545
  529    HA   THR  66           HA       THR  66  -5.447  -7.724   7.709
  530    HB   THR  66           HB       THR  66  -6.552  -6.715   9.600
  531    HG1  THR  66           HG1      THR  66  -8.260  -7.516   8.605
  532   HG21  THR  66          3HG2      THR  66  -7.562  -4.484   9.595
  533   HG22  THR  66          1HG2      THR  66  -6.986  -4.220   7.946
  534   HG23  THR  66          2HG2      THR  66  -5.829  -4.389   9.266
  535    H    GLY  67           H        GLY  67  -7.369  -7.690   6.201
  536    HA2  GLY  67           2HA      GLY  67  -6.703  -6.992   3.604
  537    HA3  GLY  67           1HA      GLY  67  -8.316  -7.378   4.166
  538    H    LYS  68           H        LYS  68  -9.051  -5.359   5.757
  539    HA   LYS  68           HA       LYS  68 -10.139  -3.629   3.870
  540    HB2  LYS  68           2HB      LYS  68 -11.060  -2.372   5.779
  541    HB3  LYS  68           1HB      LYS  68 -11.197  -4.108   6.012
  542    HG2  LYS  68           2HG      LYS  68  -9.164  -4.031   7.484
  543    HG3  LYS  68           1HG      LYS  68  -9.171  -2.271   7.334
  544    HD2  LYS  68           2HD      LYS  68 -11.423  -2.200   8.367
  545    HD3  LYS  68           1HD      LYS  68 -11.413  -3.961   8.500
  546    HE2  LYS  68           2HE      LYS  68  -9.349  -3.749   9.952
  547    HE3  LYS  68           1HE      LYS  68  -9.601  -2.004   9.954
  548    HZ1  LYS  68           3HZ      LYS  68 -10.537  -3.064  11.902
  549    HZ2  LYS  68           1HZ      LYS  68 -11.527  -4.027  10.930
  550    HZ3  LYS  68           2HZ      LYS  68 -11.750  -2.355  10.966
  551    H    TYR  69           H        TYR  69  -7.141  -3.123   5.676
  552    HA   TYR  69           HA       TYR  69  -7.076  -0.256   5.130
  553    HB2  TYR  69           2HB      TYR  69  -5.158  -2.118   6.572
  554    HB3  TYR  69           1HB      TYR  69  -4.752  -0.431   6.238
  555    HD1  TYR  69           HD2      TYR  69  -7.234   1.022   6.702
  556    HD2  TYR  69           HD1      TYR  69  -5.617  -2.248   8.918
  557    HE1  TYR  69           HE2      TYR  69  -8.490   1.738   8.662
  558    HE2  TYR  69           HE1      TYR  69  -6.888  -1.526  10.879
  559    HH   TYR  69           HH       TYR  69  -9.341   0.890  10.689
  560    H    PHE  70           H        PHE  70  -5.365  -3.150   4.028
  561    HA   PHE  70           HA       PHE  70  -3.798  -1.593   2.076
  562    HB2  PHE  70           2HB      PHE  70  -3.633  -4.461   3.037
  563    HB3  PHE  70           1HB      PHE  70  -2.750  -3.911   1.622
  564    HD1  PHE  70           HD2      PHE  70  -3.032  -3.545   5.308
  565    HD2  PHE  70           HD1      PHE  70  -0.763  -2.568   1.810
  566    HE1  PHE  70           HE2      PHE  70  -1.162  -2.805   6.715
  567    HE2  PHE  70           HE1      PHE  70   1.105  -1.829   3.225
  568    HZ   PHE  70           HZ       PHE  70   0.907  -1.949   5.681
  569    H    LYS  71           H        LYS  71  -6.767  -2.709   2.153
  570    HA   LYS  71           HA       LYS  71  -7.309  -4.708   0.449
  571    HB2  LYS  71           2HB      LYS  71  -8.785  -3.259   2.054
  572    HB3  LYS  71           1HB      LYS  71  -9.108  -2.266   0.638
  573    HG2  LYS  71           2HG      LYS  71 -10.075  -4.196  -0.504
  574    HG3  LYS  71           1HG      LYS  71  -9.653  -5.224   0.874
  575    HD2  LYS  71           2HD      LYS  71 -12.064  -4.565   0.907
  576    HD3  LYS  71           1HD      LYS  71 -11.198  -3.989   2.330
  577    HE2  LYS  71           2HE      LYS  71 -12.713  -2.254   1.471
  578    HE3  LYS  71           1HE      LYS  71 -11.035  -1.731   1.300
  579    HZ1  LYS  71           3HZ      LYS  71 -11.125  -2.411  -1.021
  580    HZ2  LYS  71           1HZ      LYS  71 -12.296  -1.242  -0.675
  581    HZ3  LYS  71           2HZ      LYS  71 -12.751  -2.855  -0.844
  582    H    ASP  72           H        ASP  72  -7.163  -1.318  -0.349
  583    HA   ASP  72           HA       ASP  72  -6.949  -1.833  -3.237
  584    HB2  ASP  72           2HB      ASP  72  -8.823   0.156  -1.835
  585    HB3  ASP  72           1HB      ASP  72  -8.419   0.268  -3.537
  586    H    LEU  73           H        LEU  73  -6.408   0.456  -4.254
  587    HA   LEU  73           HA       LEU  73  -4.214   1.666  -2.809
  588    HB2  LEU  73           2HB      LEU  73  -4.127   1.510  -5.261
  589    HB3  LEU  73           1HB      LEU  73  -5.573   2.505  -5.390
  590    HG   LEU  73           HG       LEU  73  -4.365   4.442  -4.446
  591   HD11  LEU  73          1HD1      LEU  73  -2.835   3.313  -2.925
  592   HD12  LEU  73          2HD1      LEU  73  -1.915   4.326  -4.030
  593   HD13  LEU  73          3HD1      LEU  73  -1.966   2.584  -4.279
  594   HD21  LEU  73          3HD2      LEU  73  -4.329   4.177  -6.883
  595   HD22  LEU  73          1HD2      LEU  73  -2.877   3.177  -6.777
  596   HD23  LEU  73          2HD2      LEU  73  -2.815   4.880  -6.321
  597    H    ASN  74           H        ASN  74  -7.536   2.531  -3.696
  598    HA   ASN  74           HA       ASN  74  -7.615   5.090  -2.474
  599    HB2  ASN  74           2HB      ASN  74 -10.099   4.859  -2.609
  600    HB3  ASN  74           1HB      ASN  74  -9.290   4.499  -4.119
  601   HD21  ASN  74          1HD2      ASN  74  -9.372   2.435  -4.949
  602   HD22  ASN  74          2HD2      ASN  74 -10.401   1.199  -4.307
  603    H    ALA  75           H        ALA  75  -8.085   1.863  -1.228
  604    HA   ALA  75           HA       ALA  75  -9.123   2.499   1.327
  605    HB1  ALA  75           3HB      ALA  75  -9.186   0.228   0.399
  606    HB2  ALA  75           1HB      ALA  75  -8.394   0.244   1.978
  607    HB3  ALA  75           2HB      ALA  75  -7.429   0.127   0.501
  608    H    ILE  76           H        ILE  76  -5.780   1.895   0.227
  609    HA   ILE  76           HA       ILE  76  -4.461   2.554   2.677
  610    HB   ILE  76           HB       ILE  76  -3.410   2.431  -0.188
  611   HG12  ILE  76          2HG1      ILE  76  -3.145   0.510   2.158
  612   HG13  ILE  76          1HG1      ILE  76  -4.241   0.292   0.803
  613   HG21  ILE  76          1HG2      ILE  76  -1.108   2.428   0.741
  614   HG22  ILE  76          2HG2      ILE  76  -1.753   2.681   2.363
  615   HG23  ILE  76          3HG2      ILE  76  -1.937   3.936   1.139
  616   HD11  ILE  76          3HD1      ILE  76  -2.326  -1.128   0.638
  617   HD12  ILE  76          1HD1      ILE  76  -1.240   0.262   0.685
  618   HD13  ILE  76          2HD1      ILE  76  -2.344   0.037  -0.683
  619    H    SER  77           H        SER  77  -5.598   4.473  -0.030
  620    HA   SER  77           HA       SER  77  -4.115   6.830   0.510
  621    HB2  SER  77           2HB      SER  77  -5.290   6.391  -1.651
  622    HB3  SER  77           1HB      SER  77  -6.849   6.546  -0.837
  623    HG   SER  77           HG       SER  77  -4.946   8.604  -0.685
  624    H    ARG  78           H        ARG  78  -7.180   5.556   1.742
  625    HA   ARG  78           HA       ARG  78  -7.777   7.856   3.398
  626    HB2  ARG  78           2HB      ARG  78  -8.912   5.032   3.473
  627    HB3  ARG  78           1HB      ARG  78  -9.529   6.387   4.412
  628    HG2  ARG  78           2HG      ARG  78  -9.529   6.192   1.385
  629    HG3  ARG  78           1HG      ARG  78 -10.923   5.951   2.438
  630    HD2  ARG  78           2HD      ARG  78 -10.783   8.291   3.188
  631    HD3  ARG  78           1HD      ARG  78  -9.354   8.540   2.179
  632    HE   ARG  78           HE       ARG  78 -11.314   7.646   0.470
  633   HH11  ARG  78          1HH1      ARG  78 -11.036  10.398   2.621
  634   HH12  ARG  78          2HH1      ARG  78 -12.045  11.406   1.638
  635   HH21  ARG  78          1HH2      ARG  78 -12.572   8.957  -0.819
  636   HH22  ARG  78          2HH2      ARG  78 -12.926  10.584  -0.334
  637    H    THR  79           H        THR  79  -6.285   4.688   3.841
  638    HA   THR  79           HA       THR  79  -6.175   4.634   6.660
  639    HB   THR  79           HB       THR  79  -4.387   3.181   4.653
  640    HG1  THR  79           HG1      THR  79  -6.053   1.896   4.380
  641   HG21  THR  79          3HG2      THR  79  -4.957   2.535   7.580
  642   HG22  THR  79          1HG2      THR  79  -3.414   3.103   6.937
  643   HG23  THR  79          2HG2      THR  79  -4.037   1.521   6.470
  644    H    VAL  80           H        VAL  80  -3.705   5.511   4.265
  645    HA   VAL  80           HA       VAL  80  -1.599   6.044   6.051
  646    HB   VAL  80           HB       VAL  80  -1.423   5.607   3.530
  647   HG11  VAL  80          1HG1      VAL  80  -2.052   8.565   3.257
  648   HG12  VAL  80          2HG1      VAL  80  -3.078   7.234   2.715
  649   HG13  VAL  80          3HG1      VAL  80  -1.501   7.492   1.965
  650   HG21  VAL  80          3HG2      VAL  80   0.151   7.962   4.618
  651   HG22  VAL  80          1HG2      VAL  80   0.605   6.972   3.228
  652   HG23  VAL  80          2HG2      VAL  80   0.539   6.255   4.840
  653    H    GLU  81           H        GLU  81  -4.220   8.025   4.798
  654    HA   GLU  81           HA       GLU  81  -3.428  10.572   5.701
  655    HB2  GLU  81           2HB      GLU  81  -6.066   9.283   5.010
  656    HB3  GLU  81           1HB      GLU  81  -6.076  10.877   5.743
  657    HG2  GLU  81           2HG      GLU  81  -4.547  10.226   3.212
  658    HG3  GLU  81           1HG      GLU  81  -6.204  10.824   3.223
  659    H    GLN  82           H        GLN  82  -5.582   8.149   7.236
  660    HA   GLN  82           HA       GLN  82  -6.082   9.727   9.547
  661    HB2  GLN  82           2HB      GLN  82  -7.244   7.857  10.474
  662    HB3  GLN  82           1HB      GLN  82  -7.568   7.856   8.746
  663    HG2  GLN  82           2HG      GLN  82  -5.919   6.060   8.421
  664    HG3  GLN  82           1HG      GLN  82  -5.556   6.070  10.147
  665   HE21  GLN  82          1HE2      GLN  82  -6.115   3.934  10.368
  666   HE22  GLN  82          2HE2      GLN  82  -7.749   3.385  10.316
  667    H    LEU  83           H        LEU  83  -3.645   7.316   8.766
  668    HA   LEU  83           HA       LEU  83  -2.672   6.830  11.384
  669    HB2  LEU  83           2HB      LEU  83  -1.273   6.600   8.700
  670    HB3  LEU  83           1HB      LEU  83  -0.605   6.006  10.216
  671    HG   LEU  83           HG       LEU  83  -3.185   5.002   8.961
  672   HD11  LEU  83          1HD1      LEU  83  -1.243   4.407   7.609
  673   HD12  LEU  83          2HD1      LEU  83  -1.930   2.989   8.399
  674   HD13  LEU  83          3HD1      LEU  83  -0.448   3.716   9.027
  675   HD21  LEU  83          3HD2      LEU  83  -3.047   3.196  10.641
  676   HD22  LEU  83          1HD2      LEU  83  -3.223   4.778  11.400
  677   HD23  LEU  83          2HD2      LEU  83  -1.648   3.982  11.374
  678    H    LYS  84           H        LYS  84  -1.823   9.284   8.940
  679    HA   LYS  84           HA       LYS  84   0.359  10.430  10.400
  680    HB2  LYS  84           2HB      LYS  84  -1.463  11.691   8.301
  681    HB3  LYS  84           1HB      LYS  84  -0.003  12.449   8.934
  682    HG2  LYS  84           2HG      LYS  84   1.337  10.571   8.063
  683    HG3  LYS  84           1HG      LYS  84  -0.123   9.840   7.410
  684    HD2  LYS  84           2HD      LYS  84   0.872  12.589   6.574
  685    HD3  LYS  84           1HD      LYS  84   1.331  11.104   5.744
  686    HE2  LYS  84           2HE      LYS  84  -0.463  12.025   4.472
  687    HE3  LYS  84           1HE      LYS  84  -1.169  10.686   5.378
  688    HZ1  LYS  84           3HZ      LYS  84  -2.143  12.203   6.904
  689    HZ2  LYS  84           1HZ      LYS  84  -2.513  12.752   5.351
  690    HZ3  LYS  84           2HZ      LYS  84  -1.309  13.511   6.260
  691    H    ALA  85           H        ALA  85  -3.116  10.938  10.412
  692    HA   ALA  85           HA       ALA  85  -3.192  13.210  12.127
  693    HB1  ALA  85           3HB      ALA  85  -5.600  12.711  12.296
  694    HB2  ALA  85           1HB      ALA  85  -5.336  11.132  11.551
  695    HB3  ALA  85           2HB      ALA  85  -5.053  12.605  10.622
  696    H    GLU  86           H        GLU  86  -3.187   9.712  12.695
  697    HA   GLU  86           HA       GLU  86  -3.893   9.910  15.514
  698    HB2  GLU  86           2HB      GLU  86  -3.188   7.494  13.788
  699    HB3  GLU  86           1HB      GLU  86  -3.756   7.405  15.452
  700    HG2  GLU  86           2HG      GLU  86  -5.912   8.315  14.841
  701    HG3  GLU  86           1HG      GLU  86  -5.356   8.646  13.202
  702    H    SER  87           H        SER  87  -1.010   9.390  13.579
  703    HA   SER  87           HA       SER  87   0.609   8.386  15.786
  704    HB2  SER  87           2HB      SER  87   0.944   7.491  13.486
  705    HB3  SER  87           1HB      SER  87   1.411   9.095  12.923
  706    HG   SER  87           HG       SER  87   3.345   8.655  13.580
  707    H    ALA  88           H        ALA  88   0.487  11.319  13.729
  708    HA   ALA  88           HA       ALA  88   2.560  12.684  15.213
  709    HB1  ALA  88           3HB      ALA  88   0.604  13.769  13.151
  710    HB2  ALA  88           1HB      ALA  88   2.215  13.132  12.820
  711    HB3  ALA  88           2HB      ALA  88   2.033  14.608  13.767
  712    H    LEU  89           H        LEU  89   2.156  14.797  16.208
  713    HA   LEU  89           HA       LEU  89   0.027  14.689  18.168
  714    HB2  LEU  89           2HB      LEU  89   1.113  16.482  19.277
  715    HB3  LEU  89           1HB      LEU  89   2.371  15.393  18.730
  716    HG   LEU  89           HG       LEU  89   1.664  18.013  17.315
  717   HD11  LEU  89          1HD1      LEU  89   3.690  18.946  18.346
  718   HD12  LEU  89          2HD1      LEU  89   3.898  17.465  19.284
  719   HD13  LEU  89          3HD1      LEU  89   2.488  18.490  19.551
  720   HD21  LEU  89          3HD2      LEU  89   3.832  17.757  16.165
  721   HD22  LEU  89          1HD2      LEU  89   2.770  16.389  15.824
  722   HD23  LEU  89          2HD2      LEU  89   4.092  16.210  16.978
  723    H    GLU  90           H        GLU  90  -0.071  15.647  15.078
  724    HA   GLU  90           HA       GLU  90  -0.913  18.230  14.823
  725    HB2  GLU  90           2HB      GLU  90  -0.193  16.565  13.058
  726    HB3  GLU  90           1HB      GLU  90  -1.767  15.783  13.210
  727    HG2  GLU  90           2HG      GLU  90  -1.696  17.209  11.281
  728    HG3  GLU  90           1HG      GLU  90  -2.848  17.832  12.454
  729   H281  4EM 101          2H28      PYA 142   0.909 -11.292   7.759
  730   H283  4EM 101          3H28      PYA 142   0.970 -10.802   9.451
  731   H303  4EM 101          3H30      PYA 142   1.251 -14.925   8.398
  732   H301  4EM 101          1H30      PYA 142   2.617 -13.827   8.120
  733   H302  4EM 101          2H30      PYA 142   1.147 -13.676   7.147
  734   H312  4EM 101          2H31      PYA 142  -0.834 -14.131   9.415
  735   H313  4EM 101          3H31      PYA 142  -1.033 -12.424   9.805
  736   H311  4EM 101          1H31      PYA 142  -0.946 -12.933   8.112
  737    H32  4EM 101           H32      PYA 142   1.144 -14.265  10.851
  738    H33  4EM 101           H33      PYA 142   3.214 -12.365  10.417
  739    H36  4EM 101           H36      PYA 142  -0.731 -13.376  11.901
  740   H373  4EM 101          3H37      PYA 142  -0.669 -12.007  14.106
  741   H372  4EM 101          2H37      PYA 142  -0.658 -10.656  12.979
  742   H382  4EM 101          2H38      PYA 142  -2.958 -11.048  13.707
  743   H383  4EM 101          3H38      PYA 142  -2.843 -12.758  13.295
  744    H41  4EM 101           H41      PYA 142  -1.430 -10.390  11.218
  745   H423  4EM 101          3H42      PYA 142  -1.392 -10.296   8.980
  746   H422  4EM 101          2H42      PYA 142  -2.771  -9.297   9.400
  747   H433  4EM 101          3H43      PYA 142  -4.325 -10.964   8.713
  748   H432  4EM 101          2H43      PYA 142  -3.086 -12.230   8.729
  749    H44  4EM 101           H44      PYA 142  -2.524 -11.667   6.771
  750    H49  4EM 101           H49      PYA 142  -0.862  -8.633   5.641
  751    H51  4EM 101           H51      PYA 142  -0.261  -9.596   3.282
  752    H50  4EM 101           H50      PYA 142  -2.070 -11.349   2.666
  753    H48  4EM 101           H48      PYA 142  -3.862 -11.257   4.508