*HEADER    BLOOD CLOTTING                          28-MAY-99   1COU              
*TITLE     ANTICOAGULANT PROTEIN FROM THE NEMATODE ANCYLOSTOMA CANINUM           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: NEMATODE ANTICOAGULANT PROTEIN C2;                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: NAPC2;                                                      
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 BIOLOGICAL_UNIT: MONOMER                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ANCYLOSTOMA CANINUM;                            
*SOURCE   3 ORGANISM_COMMON: DOG HOOKWORM;                                       
*SOURCE   4 EXPRESSION_SYSTEM: PICHIA PASTORIS;                                  
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: FUNGI;                                     
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: GS115;                                     
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PYAM7SP8                                   
*KEYWDS    ANTICOAGULANT, PROTEASE INHIBITOR                                     
*EXPDTA    NMR, 18 STRUCTURES                                                    
*AUTHOR    B.M.DUGGAN, H.J.DYSON, P.E.WRIGHT                                     
*REVDAT   1   13-OCT-99 1COU    0
  
   3 THR  HA            3 THR  HN          5.00   #      2:10   Preassigned
   3 THR  HB            3 THR  HN          5.00   #      3:10   Preassigned
   0 AMB  10-1:5        2 ALA  HN          6.00   #      5:10   Single Ambig
   2 ALA  HA            2 ALA  HN          6.00   #      7:10   Preassigned
   1 LYS  HA            2 ALA  HN          4.00   #      8:10   Preassigned
   1 LYS  QB            2 ALA  HN          6.00   #      9:10   Preassigned
   2 ALA  MB            3 THR  HN          5.00   #     11:10   Preassigned
   3 THR  MG2           3 THR  HN          6.00   #     12:10   Preassigned
   4 MET  HN            3 THR  HN          5.00   #     15:10   Preassigned
   5 GLN  HN            4 MET  HN          6.00   #     17:10   Preassigned
   3 THR  HN            4 MET  HN          5.00   #     18:10   Preassigned
   4 MET  HA            4 MET  HN          5.00   #     23:10   Preassigned
   3 THR  HA            4 MET  HN          4.00   #     24:10   Preassigned
   3 THR  HB            4 MET  HN          6.00   #     25:10   Preassigned
   4 MET  HG+           4 MET  HN          6.00   #     26:10   Preassigned
   4 MET  HB-           4 MET  HN          5.00   #     28:10   Preassigned
   3 THR  MG2           4 MET  HN          6.00   #     29:10   Preassigned
   6 CYS  HN            5 GLN  HN          6.00   #     30:10   Preassigned
   4 MET  HN            5 GLN  HN          6.00   #     33:10   Preassigned
   4 MET  HA            5 GLN  HN          3.00   #     34:10   Preassigned
   5 GLN  QG            5 GLN  HN          4.00   #     36:10   Preassigned
   5 GLN  HB+           5 GLN  HN          4.00   #     37:10   Preassigned
   5 GLN  HB-           5 GLN  HN          4.00   #     38:10   Preassigned
   5 GLN  HN            6 CYS  HN          6.00   #     40:10   Preassigned
   6 CYS  HA            6 CYS  HN          5.00   #     41:10   Preassigned
   5 GLN  HA            6 CYS  HN          4.00   #     42:10   Preassigned
   6 CYS  HB+           6 CYS  HN          5.00   #     43:10   Preassigned
   6 CYS  HB-           6 CYS  HN          5.00   #     44:10   Preassigned
   5 GLN  QG            6 CYS  HN          6.00   #     45:10   Preassigned
   5 GLN  HB+           6 CYS  HN          5.00   #     46:10   Preassigned
   5 GLN  HB-           6 CYS  HN          5.00   #     47:10   Preassigned
   8 GLU  HN            7 GLY  HN          6.00   #     49:10   Preassigned
   6 CYS  HA            7 GLY  HN          5.00   #     50:10   Preassigned
   7 GLY  HA+           7 GLY  HN          5.00   #     51:10   Preassigned
   7 GLY  HA-           7 GLY  HN          5.00   #     52:10   Preassigned
   6 CYS  HB+           7 GLY  HN          6.00   #     53:10   Preassigned
   6 CYS  HB-           7 GLY  HN          6.00   #     54:10   Preassigned
  10 GLU  HB+           7 GLY  HN          6.00   #     55:10   Preassigned
  10 GLU  HB-           7 GLY  HN          6.00   #     56:10   Preassigned
   9 ASN  HN            8 GLU  HN          6.00   #     57:10   Preassigned
  10 GLU  HN            8 GLU  HN          6.00   #     58:10   Preassigned
   7 GLY  HA+           8 GLU  HN          4.00   #     59:10   Preassigned
   8 GLU  HA            8 GLU  HN          5.00   #     60:10   Preassigned
   9 ASN  HA            8 GLU  HN          6.00   #     61:10   Preassigned
   7 GLY  HA-           8 GLU  HN          4.00   #     62:10   Preassigned
   6 CYS  HB+           8 GLU  HN          6.00   #     63:10   Preassigned
   8 GLU  QG            8 GLU  HN          5.00   #     64:10   Preassigned
   8 GLU  QB            8 GLU  HN          3.00   #     65:10   Preassigned
  10 GLU  HN            9 ASN  HN          5.00   #     68:10   Preassigned
   8 GLU  HA            9 ASN  HN          4.00   #     69:10   Preassigned
   9 ASN  HA            9 ASN  HN          5.00   #     70:10   Preassigned
   8 GLU  QG            9 ASN  HN          6.00   #     72:10   Preassigned
   8 GLU  QB            9 ASN  HN          5.00   #     73:10   Preassigned
  11 LYS  HN           10 GLU  HN          6.00   #     75:10   Preassigned
   9 ASN  HN           10 GLU  HN          5.00   #     76:10   Preassigned
   7 GLY  HN           10 GLU  HN          6.00   #     77:10   Preassigned
   8 GLU  HN           10 GLU  HN          6.00   #     78:10   Preassigned
  10 GLU  HA           10 GLU  HN          5.00   #     80:10   Preassigned
  52 CYS  HA           10 GLU  HN          6.00   #     82:10   Preassigned
   8 GLU  HA           10 GLU  HN          5.00   #     84:10   Preassigned
   9 ASN  HA           10 GLU  HN          5.00   #     85:10   Preassigned
   6 CYS  HB+          10 GLU  HN          6.00   #     86:10   Preassigned
  50 CYS  HB+          10 GLU  HN          6.00   #     87:10   Preassigned
   0 AMB  10-1:88      10 GLU  HN          5.00   #     88:10   Single Ambig
   8 GLU  QG           10 GLU  HN          6.00   #     89:10   Preassigned
  10 GLU  HG+          10 GLU  HN          5.00   #     90:10   Preassigned
  10 GLU  HG-          10 GLU  HN          5.00   #     91:10   Preassigned
  10 GLU  HB+          10 GLU  HN          5.00   #     92:10   Preassigned
  10 GLU  HB-          10 GLU  HN          5.00   #     93:10   Preassigned
   9 ASN  HB-          10 GLU  HN          6.00   #     94:10   Preassigned
  51 VAL  HN           11 LYS  HN          6.00   #     96:10   Preassigned
  10 GLU  HA           11 LYS  HN          5.00   #     98:10   Preassigned
  11 LYS  HA           11 LYS  HN          6.00   #    100:10   Preassigned
  10 GLU  HG+          11 LYS  HN          6.00   #    102:10   Preassigned
  10 GLU  HB+          11 LYS  HN          6.00   #    103:10   Preassigned
   0 AMB  10-1:104     11 LYS  HN          5.00   #    104:10   Single Ambig
  11 LYS  QG           11 LYS  HN          5.00   #    105:10   Preassigned
  12 TYR  HD           12 TYR  HN          6.00   #    108:10   Preassigned
  11 LYS  HA           12 TYR  HN          4.00   #    109:10   Preassigned
  12 TYR  HB+          12 TYR  HN          5.00   #    110:10   Preassigned
  12 TYR  HB-          12 TYR  HN          4.00   #    111:10   Preassigned
  11 LYS  QB           12 TYR  HN          5.00   #    112:10   Preassigned
  15 CYS  HN           16 GLY  HN          5.00   #    114:10   Preassigned
   0 AMB  10-1:117     16 GLY  HN          4.00   #    117:10   Single Ambig
  13 ASP  HB+          16 GLY  HN          6.00   #    120:10   Preassigned
  18 LYS  HN           19 GLU  HN          6.00   #    122:10   Preassigned
  20 CYS  HN           19 GLU  HN          6.00   #    124:10   Preassigned
  17 SER  HA           19 GLU  HN          6.00   #    125:10   Preassigned
  19 GLU  HA           19 GLU  HN          5.00   #    126:10   Preassigned
  19 GLU  QG           19 GLU  HN          5.00   #    127:10   Preassigned
  19 GLU  HB+          19 GLU  HN          5.00   #    128:10   Preassigned
  19 GLU  HB-          19 GLU  HN          5.00   #    129:10   Preassigned
  19 GLU  HN           20 CYS  HN          6.00   #    130:10   Preassigned
  21 ASP  HN           20 CYS  HN          5.00   #    132:10   Preassigned
  20 CYS  HA           20 CYS  HN          6.00   #    133:10   Preassigned
  19 GLU  HA           20 CYS  HN          6.00   #    134:10   Preassigned
  20 CYS  HB+          20 CYS  HN          6.00   #    135:10   Preassigned
  20 CYS  HB-          20 CYS  HN          5.00   #    136:10   Preassigned
  19 GLU  HB-          20 CYS  HN          6.00   #    137:10   Preassigned
  20 CYS  HN           21 ASP  HN          5.00   #    139:10   Preassigned
  20 CYS  HA           21 ASP  HN          6.00   #    141:10   Preassigned
  21 ASP  HA           21 ASP  HN          5.00   #    142:10   Preassigned
  19 GLU  HA           21 ASP  HN          6.00   #    143:10   Preassigned
  20 CYS  HB-          21 ASP  HN          6.00   #    145:10   Preassigned
  21 ASP  HB-          21 ASP  HN          5.00   #    146:10   Preassigned
  21 ASP  HB+          21 ASP  HN          5.00   #    147:10   Preassigned
  19 GLU  HB-          21 ASP  HN          6.00   #    148:10   Preassigned
  58 ARG  HG+          21 ASP  HN          6.00   #    149:10   Preassigned
  21 ASP  HA           22 LYS  HN          4.00   #    154:10   Preassigned
  22 LYS  HA           22 LYS  HN          5.00   #    155:10   Preassigned
  21 ASP  HB-          22 LYS  HN          5.00   #    157:10   Preassigned
  21 ASP  HB+          22 LYS  HN          5.00   #    158:10   Preassigned
  22 LYS  QB           22 LYS  HN          5.00   #    159:10   Preassigned
   0 AMB  10-1:160     22 LYS  HN          4.00   #    160:10   Single Ambig
  24 CYS  HN           23 LYS  HN          5.00   #    163:10   Preassigned
  23 LYS  HA           23 LYS  HN          6.00   #    165:10   Preassigned
  22 LYS  HA           23 LYS  HN          4.00   #    166:10   Preassigned
  23 LYS  QB           23 LYS  HN          5.00   #    167:10   Preassigned
  22 LYS  QB           23 LYS  HN          5.00   #    168:10   Preassigned
  23 LYS  QD           23 LYS  HN          4.00   #    169:10   Preassigned
  58 ARG  HN           24 CYS  HN          6.00   #    170:10   Preassigned
  23 LYS  HA           24 CYS  HN          5.00   #    174:10   Preassigned
  24 CYS  HA           24 CYS  HN          6.00   #    175:10   Preassigned
  24 CYS  HB3          24 CYS  HN          5.00   #    177:10   Preassigned
  24 CYS  HB2          24 CYS  HN          5.00   #    178:10   Preassigned
  23 LYS  QB           24 CYS  HN          5.00   #    179:10   Preassigned
  58 ARG  HG+          24 CYS  HN          6.00   #    180:10   Preassigned
  23 LYS  QD           24 CYS  HN          5.00   #    181:10   Preassigned
  26 TYR  HD           26 TYR  HN          5.00   #    188:10   Preassigned
  26 TYR  HA           26 TYR  HN          4.00   #    189:10   Preassigned
  25 LYS  HA           26 TYR  HN          4.00   #    190:10   Preassigned
  26 TYR  HB+          26 TYR  HN          5.00   #    191:10   Preassigned
  26 TYR  HB-          26 TYR  HN          5.00   #    192:10   Preassigned
  25 LYS  QD           26 TYR  HN          5.00   #    193:10   Preassigned
  25 LYS  QG           26 TYR  HN          6.00   #    194:10   Preassigned
  28 GLY  HN           27 ASP  HN          5.00   #    196:10   Preassigned
  26 TYR  HD           27 ASP  HN          6.00   #    198:10   Preassigned
  25 LYS  HA           27 ASP  HN          6.00   #    200:10   Preassigned
  26 TYR  HB+          27 ASP  HN          5.00   #    201:10   Preassigned
  27 ASP  QB           27 ASP  HN          4.00   #    202:10   Preassigned
  25 LYS  QD           27 ASP  HN          6.00   #    203:10   Preassigned
  27 ASP  HN           28 GLY  HN          5.00   #    204:10   Preassigned
  29 VAL  HN           28 GLY  HN          5.00   #    206:10   Preassigned
  27 ASP  HA           28 GLY  HN          5.00   #    207:10   Preassigned
  28 GLY  HA+          28 GLY  HN          4.00   #    208:10   Preassigned
  28 GLY  HA-          28 GLY  HN          4.00   #    209:10   Preassigned
  27 ASP  QB           28 GLY  HN          5.00   #    210:10   Preassigned
  30 GLU  HN           29 VAL  HN          5.00   #    213:10   Preassigned
  28 GLY  HN           29 VAL  HN          5.00   #    214:10   Preassigned
  27 ASP  HA           29 VAL  HN          6.00   #    216:10   Preassigned
  29 VAL  HA           29 VAL  HN          4.00   #    218:10   Preassigned
  28 GLY  HA+          29 VAL  HN          5.00   #    219:10   Preassigned
  28 GLY  HA-          29 VAL  HN          5.00   #    220:10   Preassigned
  27 ASP  QB           29 VAL  HN          5.00   #    221:10   Preassigned
   0 AMB  10-1:223     29 VAL  HN          4.00   #    223:10   Single Ambig
  29 VAL  QG           29 VAL  HN          4.00   #    225:10   Preassigned
  31 GLU  HN           30 GLU  HN          5.00   #    227:10   Preassigned
  29 VAL  HN           30 GLU  HN          5.00   #    228:10   Preassigned
  30 GLU  HA           30 GLU  HN          4.00   #    229:10   Preassigned
  29 VAL  HA           30 GLU  HN          4.00   #    230:10   Preassigned
  30 GLU  QG           30 GLU  HN          5.00   #    231:10   Preassigned
  30 GLU  HB+          30 GLU  HN          4.00   #    232:10   Preassigned
  30 GLU  HB-          30 GLU  HN          4.00   #    233:10   Preassigned
  29 VAL  QG           30 GLU  HN          5.00   #    234:10   Preassigned
  30 GLU  HN           31 GLU  HN          5.00   #    235:10   Preassigned
  29 VAL  HA           31 GLU  HN          6.00   #    237:10   Preassigned
   0 AMB  10-1:239     32 GLU  HN          6.00   #    239:10   Single Ambig
  29 VAL  QG           32 GLU  HN          6.00   #    242:10   Preassigned
   2 ALA  MB            2 ALA  HN          5.00   #    243:10   Preassigned
  33 ASP  HA           33 ASP  HN          4.00   #    245:10   Preassigned
   0 AMB  10-1:246     33 ASP  HN          3.00   #    246:10   Single Ambig
  33 ASP  HB+          33 ASP  HN          4.00   #    247:10   Preassigned
  33 ASP  HB-          33 ASP  HN          4.00   #    248:10   Preassigned
  32 GLU  QG           33 ASP  HN          5.00   #    249:10   Preassigned
   0 AMB  10-1:250     33 ASP  HN          4.00   #    250:10   Single Ambig
   0 AMB  10-1:251     33 ASP  HN          5.00   #    251:10   Single Ambig
  34 ASP  HA           34 ASP  HN          3.00   #    255:10   Preassigned
   0 AMB  10-1:256     34 ASP  HN          5.00   #    256:10   Single Ambig
  34 ASP  HB+          34 ASP  HN          4.00   #    257:10   Preassigned
  34 ASP  HB-          34 ASP  HN          4.00   #    258:10   Preassigned
  35 GLU  QG           34 ASP  HN          6.00   #    259:10   Preassigned
   0 AMB  10-1:260     34 ASP  HN          6.00   #    260:10   Single Ambig
   0 AMB  10-1:261     34 ASP  HN          6.00   #    261:10   Single Ambig
  34 ASP  HN           35 GLU  HN          4.00   #    263:10   Preassigned
   0 AMB  10-1:267     35 GLU  HN          4.00   #    267:10   Single Ambig
  35 GLU  HA           35 GLU  HN          4.00   #    269:10   Preassigned
   0 AMB  10-1:270     35 GLU  HN          5.00   #    270:10   Single Ambig
  35 GLU  QG           35 GLU  HN          5.00   #    271:10   Preassigned
  35 GLU  HB+          35 GLU  HN          5.00   #    272:10   Preassigned
  35 GLU  HB-          35 GLU  HN          4.00   #    273:10   Preassigned
  41 CYS  HN           38 ASN  HN          6.00   #    275:10   Preassigned
  39 VAL  HN           38 ASN  HN          5.00   #    276:10   Preassigned
  38 ASN  HA           38 ASN  HN          5.00   #    277:10   Preassigned
  37 PRO  HA           38 ASN  HN          4.00   #    278:10   Preassigned
  38 ASN  HB-          38 ASN  HN          5.00   #    280:10   Preassigned
  37 PRO  HB+          38 ASN  HN          6.00   #    281:10   Preassigned
  37 PRO  HB-          38 ASN  HN          6.00   #    283:10   Preassigned
  37 PRO  QG           38 ASN  HN          5.00   #    284:10   Preassigned
  39 VAL  QG           38 ASN  HN          6.00   #    285:10   Preassigned
  41 CYS  HA           41 CYS  HN          5.00   #    287:10   Preassigned
  40 PRO  HA           41 CYS  HN          4.00   #    288:10   Preassigned
  41 CYS  HB-          41 CYS  HN          5.00   #    289:10   Preassigned
  41 CYS  HB+          41 CYS  HN          5.00   #    290:10   Preassigned
  40 PRO  HB+          41 CYS  HN          6.00   #    291:10   Preassigned
  40 PRO  HG-          41 CYS  HN          6.00   #    293:10   Preassigned
  43 VAL  HN           42 LEU  HN          6.00   #    295:10   Preassigned
  41 CYS  HA           42 LEU  HN          4.00   #    296:10   Preassigned
  45 VAL  HN           44 ARG  HN          6.00   #    305:10   Preassigned
  44 ARG  HA           44 ARG  HN          5.00   #    306:10   Preassigned
  43 VAL  HA           44 ARG  HN          4.00   #    307:10   Preassigned
  43 VAL  HB           44 ARG  HN          6.00   #    309:10   Preassigned
  44 ARG  HB+          44 ARG  HN          5.00   #    310:10   Preassigned
  44 ARG  HB-          44 ARG  HN          6.00   #    311:10   Preassigned
  44 ARG  QG           44 ARG  HN          5.00   #    312:10   Preassigned
   0 AMB  10-1:313     44 ARG  HN          5.00   #    313:10   Single Ambig
  44 ARG  HN           45 VAL  HN          5.00   #    315:10   Preassigned
  44 ARG  HA           45 VAL  HN          5.00   #    317:10   Preassigned
  45 VAL  HA           45 VAL  HN          5.00   #    318:10   Preassigned
   0 AMB  10-1:319     45 VAL  HN          4.00   #    319:10   Single Ambig
  44 ARG  HB-          45 VAL  HN          5.00   #    320:10   Preassigned
  44 ARG  QG           45 VAL  HN          6.00   #    321:10   Preassigned
   0 AMB  10-1:322     45 VAL  HN          4.00   #    322:10   Single Ambig
  16 GLY  HN           46 CYS  HN          6.00   #    324:10   Preassigned
  45 VAL  HN           46 CYS  HN          6.00   #    325:10   Preassigned
  46 CYS  HA           46 CYS  HN          5.00   #    326:10   Preassigned
  45 VAL  HA           46 CYS  HN          4.00   #    327:10   Preassigned
  46 CYS  HB+          46 CYS  HN          5.00   #    328:10   Preassigned
  46 CYS  HB-          46 CYS  HN          4.00   #    329:10   Preassigned
  45 VAL  HB           46 CYS  HN          6.00   #    330:10   Preassigned
  45 VAL  QG           46 CYS  HN          4.00   #    331:10   Preassigned
   0 AMB  10-1:334     49 ASP  HN          4.00   #    334:10   Single Ambig
  14 SER  HB-          49 ASP  HN          6.00   #    335:10   Preassigned
  49 ASP  HB+          49 ASP  HN          5.00   #    336:10   Preassigned
  49 ASP  HB-          49 ASP  HN          6.00   #    337:10   Preassigned
  48 GLN  HB-          49 ASP  HN          5.00   #    338:10   Preassigned
  50 CYS  HA           50 CYS  HN          6.00   #    340:10   Preassigned
  49 ASP  HA           50 CYS  HN          4.00   #    341:10   Preassigned
  50 CYS  HB+          50 CYS  HN          5.00   #    342:10   Preassigned
  50 CYS  HB-          50 CYS  HN          5.00   #    343:10   Preassigned
  49 ASP  HB+          50 CYS  HN          6.00   #    344:10   Preassigned
  49 ASP  HB-          50 CYS  HN          6.00   #    345:10   Preassigned
  50 CYS  HA           51 VAL  HN          5.00   #    349:10   Preassigned
  51 VAL  HA           51 VAL  HN          5.00   #    350:10   Preassigned
   0 AMB  10-1:351     51 VAL  HN          5.00   #    351:10   Single Ambig
  50 CYS  HB+          51 VAL  HN          6.00   #    352:10   Preassigned
  51 VAL  MGX          51 VAL  HN          5.00   #    354:10   Preassigned
  51 VAL  MGY          51 VAL  HN          6.00   #    355:10   Preassigned
  52 CYS  HA           52 CYS  HN          6.00   #    357:10   Preassigned
  51 VAL  HA           52 CYS  HN          6.00   #    358:10   Preassigned
  52 CYS  HB+          52 CYS  HN          6.00   #    359:10   Preassigned
  51 VAL  HB           52 CYS  HN          5.00   #    360:10   Preassigned
  52 CYS  HB-          52 CYS  HN          6.00   #    361:10   Preassigned
  51 VAL  MGX          52 CYS  HN          6.00   #    362:10   Preassigned
  51 VAL  MGY          52 CYS  HN          6.00   #    363:10   Preassigned
  11 LYS  HN           53 GLU  HN          6.00   #    364:10   Preassigned
  54 GLU  HN           53 GLU  HN          6.00   #    365:10   Preassigned
  56 PHE  HD           53 GLU  HN          6.00   #    366:10   Preassigned
  10 GLU  HA           53 GLU  HN          5.00   #    367:10   Preassigned
  52 CYS  HA           53 GLU  HN          5.00   #    369:10   Preassigned
  52 CYS  HB+          53 GLU  HN          5.00   #    370:10   Preassigned
  64 CYS  HB2          53 GLU  HN          5.00   #    371:10   Preassigned
  52 CYS  HB-          53 GLU  HN          5.00   #    372:10   Preassigned
  64 CYS  HB3          53 GLU  HN          6.00   #    373:10   Preassigned
  53 GLU  QG           53 GLU  HN          4.00   #    374:10   Preassigned
  53 GLU  QB           53 GLU  HN          5.00   #    375:10   Preassigned
   0 AMB  10-1:376     53 GLU  HN          6.00   #    376:10   Single Ambig
  55 GLY  HN           54 GLU  HN          5.00   #    378:10   Preassigned
  53 GLU  HN           54 GLU  HN          6.00   #    379:10   Preassigned
  54 GLU  HA           54 GLU  HN          5.00   #    383:10   Preassigned
  53 GLU  HA           54 GLU  HN          4.00   #    384:10   Preassigned
  54 GLU  QG           54 GLU  HN          5.00   #    386:10   Preassigned
  54 GLU  HB+          54 GLU  HN          3.00   #    387:10   Preassigned
  54 GLU  HB-          54 GLU  HN          4.00   #    388:10   Preassigned
  53 GLU  QB           54 GLU  HN          5.00   #    389:10   Preassigned
  54 GLU  HN           55 GLY  HN          6.00   #    391:10   Preassigned
  56 PHE  HN           55 GLY  HN          5.00   #    393:10   Preassigned
  56 PHE  HD           55 GLY  HN          6.00   #    394:10   Preassigned
  55 GLY  HA+          55 GLY  HN          4.00   #    395:10   Preassigned
  55 GLY  HA-          55 GLY  HN          5.00   #    396:10   Preassigned
  54 GLU  QG           55 GLY  HN          6.00   #    397:10   Preassigned
  54 GLU  HB-          55 GLY  HN          6.00   #    398:10   Preassigned
  54 GLU  HB+          55 GLY  HN          5.00   #    399:10   Preassigned
  57 TYR  HN           56 PHE  HN          6.00   #    400:10   Preassigned
  55 GLY  HN           56 PHE  HN          5.00   #    401:10   Preassigned
  56 PHE  HE           56 PHE  HN          6.00   #    403:10   Preassigned
  56 PHE  HD           56 PHE  HN          5.00   #    405:10   Preassigned
  56 PHE  HA           56 PHE  HN          5.00   #    406:10   Preassigned
  66 SER  HA           56 PHE  HN          6.00   #    407:10   Preassigned
  55 GLY  HA+          56 PHE  HN          4.00   #    408:10   Preassigned
  55 GLY  HA-          56 PHE  HN          5.00   #    409:10   Preassigned
  52 CYS  HB+          56 PHE  HN          6.00   #    410:10   Preassigned
  56 PHE  HB+          56 PHE  HN          5.00   #    411:10   Preassigned
  56 PHE  HB-          56 PHE  HN          5.00   #    412:10   Preassigned
  54 GLU  QG           56 PHE  HN          6.00   #    414:10   Preassigned
  54 GLU  HB+          56 PHE  HN          6.00   #    415:10   Preassigned
  65 VAL  HN           57 TYR  HN          6.00   #    418:10   Preassigned
  57 TYR  HD           57 TYR  HN          5.00   #    422:10   Preassigned
  56 PHE  HD           57 TYR  HN          6.00   #    423:10   Preassigned
  56 PHE  HA           57 TYR  HN          5.00   #    424:10   Preassigned
  57 TYR  HA           57 TYR  HN          6.00   #    425:10   Preassigned
  56 PHE  HB+          57 TYR  HN          6.00   #    427:10   Preassigned
   0 AMB  10-1:428     57 TYR  HN          5.00   #    428:10   Single Ambig
  57 TYR  HB-          57 TYR  HN          5.00   #    429:10   Preassigned
  65 VAL  MGX          57 TYR  HN          6.00   #    430:10   Preassigned
  23 LYS  HA           58 ARG  HN          6.00   #    434:10   Preassigned
  58 ARG  HA           58 ARG  HN          6.00   #    435:10   Preassigned
  57 TYR  HA           58 ARG  HN          5.00   #    436:10   Preassigned
   0 AMB  10-1:437     58 ARG  HN          6.00   #    437:10   Single Ambig
   0 AMB  10-1:438     58 ARG  HN          6.00   #    438:10   Single Ambig
  57 TYR  HB-          58 ARG  HN          6.00   #    439:10   Preassigned
  58 ARG  HB+          58 ARG  HN          6.00   #    440:10   Preassigned
  58 ARG  HB-          58 ARG  HN          6.00   #    441:10   Preassigned
  58 ARG  HG+          58 ARG  HN          5.00   #    442:10   Preassigned
  58 ARG  HG-          58 ARG  HN          6.00   #    443:10   Preassigned
  61 ASP  HN           60 LYS  HN          6.00   #    445:10   Preassigned
  59 ASN  HA           60 LYS  HN          6.00   #    446:10   Preassigned
  59 ASN  HB+          60 LYS  HN          5.00   #    447:10   Preassigned
  60 LYS  HA           60 LYS  HN          5.00   #    448:10   Preassigned
  59 ASN  HB-          60 LYS  HN          5.00   #    449:10   Preassigned
  60 LYS  HB+          60 LYS  HN          5.00   #    450:10   Preassigned
  60 LYS  HB-          60 LYS  HN          5.00   #    451:10   Preassigned
  60 LYS  QG           60 LYS  HN          5.00   #    453:10   Preassigned
  60 LYS  HN           61 ASP  HN          5.00   #    455:10   Preassigned
  62 ASP  HN           61 ASP  HN          4.00   #    456:10   Preassigned
  63 LYS  HN           61 ASP  HN          5.00   #    457:10   Preassigned
  59 ASN  HD2+         61 ASP  HN          6.00   #    458:10   Preassigned
  59 ASN  HD2-         61 ASP  HN          6.00   #    460:10   Preassigned
  61 ASP  HA           61 ASP  HN          4.00   #    461:10   Preassigned
  59 ASN  HB+          61 ASP  HN          5.00   #    464:10   Preassigned
  60 LYS  HA           61 ASP  HN          5.00   #    465:10   Preassigned
  61 ASP  HB+          61 ASP  HN          4.00   #    467:10   Preassigned
  62 ASP  HB-          61 ASP  HN          6.00   #    469:10   Preassigned
  61 ASP  HB-          61 ASP  HN          4.00   #    470:10   Preassigned
  60 LYS  HB+          61 ASP  HN          5.00   #    471:10   Preassigned
  60 LYS  HB-          61 ASP  HN          5.00   #    472:10   Preassigned
  63 LYS  QD           61 ASP  HN          6.00   #    473:10   Preassigned
  60 LYS  QG           61 ASP  HN          5.00   #    474:10   Preassigned
  63 LYS  HN           62 ASP  HN          5.00   #    477:10   Preassigned
  61 ASP  HN           62 ASP  HN          5.00   #    478:10   Preassigned
  61 ASP  HA           62 ASP  HN          5.00   #    479:10   Preassigned
  62 ASP  HA           62 ASP  HN          4.00   #    481:10   Preassigned
  60 LYS  HA           62 ASP  HN          6.00   #    482:10   Preassigned
  62 ASP  HB+          62 ASP  HN          6.00   #    483:10   Preassigned
  61 ASP  HB+          62 ASP  HN          5.00   #    484:10   Preassigned
  62 ASP  HB-          62 ASP  HN          5.00   #    486:10   Preassigned
  61 ASP  HB-          62 ASP  HN          6.00   #    487:10   Preassigned
  58 ARG  HG+          62 ASP  HN          6.00   #    488:10   Preassigned
  63 LYS  QD           62 ASP  HN          6.00   #    489:10   Preassigned
   0 AMB  10-1:490     62 ASP  HN          6.00   #    490:10   Single Ambig
  63 LYS  HN           64 CYS  HN          6.00   #    493:10   Preassigned
  64 CYS  HA           64 CYS  HN          6.00   #    494:10   Preassigned
  63 LYS  HA           64 CYS  HN          5.00   #    495:10   Preassigned
  64 CYS  HB2          64 CYS  HN          5.00   #    496:10   Preassigned
   0 AMB  10-1:497     64 CYS  HN          6.00   #    497:10   Single Ambig
  64 CYS  HB3          64 CYS  HN          6.00   #    498:10   Preassigned
  63 LYS  QB           64 CYS  HN          5.00   #    499:10   Preassigned
  63 LYS  QD           64 CYS  HN          5.00   #    500:10   Preassigned
  63 LYS  HG-          64 CYS  HN          6.00   #    502:10   Preassigned
  57 TYR  HN           65 VAL  HN          6.00   #    505:10   Preassigned
   0 AMB  10-1:506     65 VAL  HN          6.00   #    506:10   Single Ambig
  64 CYS  HA           65 VAL  HN          5.00   #    508:10   Preassigned
   0 AMB  10-1:509     65 VAL  HN          6.00   #    509:10   Single Ambig
   0 AMB  10-1:510     65 VAL  HN          6.00   #    510:10   Single Ambig
   0 AMB  10-1:511     65 VAL  HN          6.00   #    511:10   Single Ambig
  65 VAL  MGX          65 VAL  HN          5.00   #    512:10   Preassigned
  65 VAL  MGY          65 VAL  HN          6.00   #    513:10   Preassigned
  69 ASP  HN           66 SER  HN          6.00   #    516:10   Preassigned
  56 PHE  HE           66 SER  HN          6.00   #    517:10   Preassigned
  56 PHE  HD           66 SER  HN          6.00   #    518:10   Preassigned
  65 VAL  HA           66 SER  HN          5.00   #    519:10   Preassigned
  66 SER  HA           66 SER  HN          5.00   #    521:10   Preassigned
  66 SER  QB           66 SER  HN          5.00   #    522:10   Preassigned
  69 ASP  HB+          66 SER  HN          5.00   #    523:10   Preassigned
  69 ASP  HB-          66 SER  HN          6.00   #    524:10   Preassigned
  65 VAL  HB           66 SER  HN          5.00   #    525:10   Preassigned
  65 VAL  MGX          66 SER  HN          6.00   #    526:10   Preassigned
  65 VAL  MGY          66 SER  HN          5.00   #    527:10   Preassigned
  68 GLU  HN           67 ALA  HN          5.00   #    530:10   Preassigned
  57 TYR  HD           67 ALA  HN          6.00   #    533:10   Preassigned
  57 TYR  HE           67 ALA  HN          5.00   #    534:10   Preassigned
  66 SER  HA           67 ALA  HN          4.00   #    537:10   Preassigned
  66 SER  QB           67 ALA  HN          5.00   #    538:10   Preassigned
  67 ALA  HA           67 ALA  HN          5.00   #    539:10   Preassigned
  67 ALA  MB           67 ALA  HN          4.00   #    542:10   Preassigned
  67 ALA  HN           68 GLU  HN          5.00   #    543:10   Preassigned
  70 CYS  HN           68 GLU  HN          6.00   #    545:10   Preassigned
  69 ASP  HN           68 GLU  HN          5.00   #    546:10   Preassigned
  66 SER  HA           68 GLU  HN          5.00   #    551:10   Preassigned
  68 GLU  HA           68 GLU  HN          4.00   #    552:10   Preassigned
  66 SER  QB           68 GLU  HN          6.00   #    553:10   Preassigned
  67 ALA  HA           68 GLU  HN          6.00   #    554:10   Preassigned
  69 ASP  HB+          68 GLU  HN          6.00   #    555:10   Preassigned
  69 ASP  HB-          68 GLU  HN          6.00   #    556:10   Preassigned
  68 GLU  HG+          68 GLU  HN          5.00   #    557:10   Preassigned
  68 GLU  HG-          68 GLU  HN          6.00   #    558:10   Preassigned
  68 GLU  HB+          68 GLU  HN          4.00   #    559:10   Preassigned
  68 GLU  HB-          68 GLU  HN          4.00   #    560:10   Preassigned
  67 ALA  MB           68 GLU  HN          4.00   #    561:10   Preassigned
  66 SER  HN           69 ASP  HN          6.00   #    562:10   Preassigned
  68 GLU  HN           69 ASP  HN          5.00   #    564:10   Preassigned
  70 CYS  HN           69 ASP  HN          5.00   #    565:10   Preassigned
  71 GLU  HN           69 ASP  HN          6.00   #    567:10   Preassigned
  66 SER  HA           69 ASP  HN          6.00   #    571:10   Preassigned
  68 GLU  HA           69 ASP  HN          5.00   #    572:10   Preassigned
  70 CYS  HB+          69 ASP  HN          6.00   #    575:10   Preassigned
  69 ASP  HB+          69 ASP  HN          5.00   #    576:10   Preassigned
  70 CYS  HB-          69 ASP  HN          6.00   #    577:10   Preassigned
  69 ASP  HB-          69 ASP  HN          5.00   #    578:10   Preassigned
  65 VAL  HB           69 ASP  HN          5.00   #    579:10   Preassigned
  68 GLU  HG+          69 ASP  HN          6.00   #    580:10   Preassigned
  68 GLU  HB-          69 ASP  HN          5.00   #    582:10   Preassigned
  65 VAL  MGX          69 ASP  HN          6.00   #    584:10   Preassigned
  65 VAL  MGY          69 ASP  HN          6.00   #    585:10   Preassigned
  68 GLU  HN           70 CYS  HN          5.00   #    586:10   Preassigned
  69 ASP  HN           70 CYS  HN          5.00   #    588:10   Preassigned
  71 GLU  HN           70 CYS  HN          5.00   #    589:10   Preassigned
  69 ASP  HA           70 CYS  HN          5.00   #    590:10   Preassigned
  70 CYS  HA           70 CYS  HN          4.00   #    591:10   Preassigned
  71 GLU  HA           70 CYS  HN          6.00   #    592:10   Preassigned
  68 GLU  HA           70 CYS  HN          6.00   #    593:10   Preassigned
  67 ALA  HA           70 CYS  HN          6.00   #    594:10   Preassigned
  70 CYS  HB+          70 CYS  HN          5.00   #    595:10   Preassigned
   0 AMB  10-1:596     70 CYS  HN          5.00   #    596:10   Single Ambig
  70 CYS  HB-          70 CYS  HN          5.00   #    597:10   Preassigned
  69 ASP  HB-          70 CYS  HN          5.00   #    598:10   Preassigned
  57 TYR  HB+          70 CYS  HN          6.00   #    599:10   Preassigned
  68 GLU  HG+          70 CYS  HN          6.00   #    600:10   Preassigned
  71 GLU  HB-          70 CYS  HN          6.00   #    601:10   Preassigned
  65 VAL  MGX          70 CYS  HN          6.00   #    603:10   Preassigned
  65 VAL  MGY          70 CYS  HN          6.00   #    604:10   Preassigned
  70 CYS  HN           71 GLU  HN          5.00   #    605:10   Preassigned
   0 AMB  10-1:606     71 GLU  HN          6.00   #    606:10   Single Ambig
  69 ASP  HA           71 GLU  HN          6.00   #    608:10   Preassigned
  70 CYS  HA           71 GLU  HN          5.00   #    609:10   Preassigned
  71 GLU  HA           71 GLU  HN          4.00   #    610:10   Preassigned
  68 GLU  HA           71 GLU  HN          6.00   #    611:10   Preassigned
  70 CYS  HB+          71 GLU  HN          5.00   #    612:10   Preassigned
  70 CYS  HB-          71 GLU  HN          5.00   #    613:10   Preassigned
  69 ASP  HB-          71 GLU  HN          6.00   #    614:10   Preassigned
  71 GLU  QG           71 GLU  HN          4.00   #    616:10   Preassigned
  71 GLU  HB+          71 GLU  HN          5.00   #    617:10   Preassigned
  71 GLU  HB-          71 GLU  HN          4.00   #    618:10   Preassigned
  72 LEU  HB+          71 GLU  HN          6.00   #    619:10   Preassigned
  73 ASP  HN           72 LEU  HN          5.00   #    623:10   Preassigned
  69 ASP  HA           72 LEU  HN          6.00   #    625:10   Preassigned
  70 CYS  HA           72 LEU  HN          6.00   #    627:10   Preassigned
  72 LEU  HA           72 LEU  HN          4.00   #    628:10   Preassigned
   0 AMB  10-1:630     72 LEU  HN          6.00   #    630:10   Single Ambig
   0 AMB  10-1:631     72 LEU  HN          6.00   #    631:10   Single Ambig
  71 GLU  QG           72 LEU  HN          6.00   #    632:10   Preassigned
  71 GLU  HB+          72 LEU  HN          6.00   #    633:10   Preassigned
  71 GLU  HB-          72 LEU  HN          6.00   #    634:10   Preassigned
  72 LEU  HB+          72 LEU  HN          4.00   #    635:10   Preassigned
  72 LEU  HG           72 LEU  HN          4.00   #    636:10   Preassigned
  72 LEU  HB-          72 LEU  HN          5.00   #    637:10   Preassigned
  72 LEU  MDX          72 LEU  HN          5.00   #    638:10   Preassigned
  72 LEU  MDY          72 LEU  HN          4.00   #    639:10   Preassigned
  72 LEU  HN           73 ASP  HN          5.00   #    642:10   Preassigned
  26 TYR  HE           73 ASP  HN          6.00   #    644:10   Preassigned
  73 ASP  HA           73 ASP  HN          4.00   #    646:10   Preassigned
  70 CYS  HA           73 ASP  HN          6.00   #    647:10   Preassigned
  72 LEU  HA           73 ASP  HN          5.00   #    648:10   Preassigned
  73 ASP  HB3          73 ASP  HN          4.00   #    649:10   Preassigned
  73 ASP  HB2          73 ASP  HN          4.00   #    650:10   Preassigned
   0 AMB  10-1:653     73 ASP  HN          6.00   #    653:10   Single Ambig
  72 LEU  HB+          73 ASP  HN          5.00   #    654:10   Preassigned
  72 LEU  HG           73 ASP  HN          6.00   #    655:10   Preassigned
  72 LEU  HB-          73 ASP  HN          5.00   #    656:10   Preassigned
  72 LEU  MDY          73 ASP  HN          6.00   #    657:10   Preassigned
  75 MET  HN           74 ASN  HN          5.00   #    659:10   Preassigned
  72 LEU  HN           74 ASN  HN          6.00   #    661:10   Preassigned
  73 ASP  HA           74 ASN  HN          5.00   #    665:10   Preassigned
  72 LEU  HA           74 ASN  HN          6.00   #    667:10   Preassigned
  74 ASN  HB+          74 ASN  HN          4.00   #    668:10   Preassigned
  73 ASP  HB2          74 ASN  HN          5.00   #    669:10   Preassigned
  74 ASN  HB-          74 ASN  HN          5.00   #    670:10   Preassigned
  75 MET  HB-          74 ASN  HN          6.00   #    672:10   Preassigned
  75 MET  ME           74 ASN  HN          6.00   #    673:10   Preassigned
  76 ASP  HN           75 MET  HN          4.00   #    676:10   Preassigned
  71 GLU  HN           73 ASP  HN          6.00   #    677:10   Preassigned
  74 ASN  HN           75 MET  HN          4.00   #    679:10   Preassigned
  75 MET  HA           75 MET  HN          5.00   #    680:10   Preassigned
  74 ASN  HB+          75 MET  HN          5.00   #    682:10   Preassigned
  75 MET  QG           75 MET  HN          5.00   #    683:10   Preassigned
  75 MET  HB+          75 MET  HN          5.00   #    684:10   Preassigned
  75 MET  HB-          75 MET  HN          4.00   #    685:10   Preassigned
  75 MET  HN           76 ASP  HN          4.00   #    687:10   Preassigned
  77 PHE  HN           76 ASP  HN          4.00   #    688:10   Preassigned
  76 ASP  HA           76 ASP  HN          4.00   #    691:10   Preassigned
  75 MET  HA           76 ASP  HN          4.00   #    692:10   Preassigned
  76 ASP  HB+          76 ASP  HN          4.00   #    694:10   Preassigned
  74 ASN  HB+          76 ASP  HN          6.00   #    695:10   Preassigned
  76 ASP  HB-          76 ASP  HN          4.00   #    696:10   Preassigned
  75 MET  QG           76 ASP  HN          6.00   #    697:10   Preassigned
  75 MET  HB+          76 ASP  HN          5.00   #    698:10   Preassigned
  75 MET  HB-          76 ASP  HN          5.00   #    699:10   Preassigned
  76 ASP  HN           77 PHE  HN          4.00   #    700:10   Preassigned
  78 ILE  HN           77 PHE  HN          5.00   #    701:10   Preassigned
  77 PHE  HD           77 PHE  HN          6.00   #    705:10   Preassigned
  74 ASN  HA           76 ASP  HN          5.00   #    706:10   Preassigned
  76 ASP  HA           77 PHE  HN          4.00   #    707:10   Preassigned
  77 PHE  HA           77 PHE  HN          4.00   #    708:10   Preassigned
  75 MET  HA           77 PHE  HN          6.00   #    709:10   Preassigned
  77 PHE  QB           77 PHE  HN          4.00   #    710:10   Preassigned
  76 ASP  HB+          77 PHE  HN          5.00   #    711:10   Preassigned
   0 AMB  10-1:712     77 PHE  HN          5.00   #    712:10   Single Ambig
  79 TYR  HN           78 ILE  HN          5.00   #    716:10   Preassigned
  77 PHE  HD           78 ILE  HN          6.00   #    721:10   Preassigned
  77 PHE  QB           78 ILE  HN          5.00   #    722:10   Preassigned
  78 ILE  HG1+         78 ILE  HN          5.00   #    723:10   Preassigned
  78 ILE  HG1-         78 ILE  HN          5.00   #    724:10   Preassigned
  78 ILE  MG2          78 ILE  HN          6.00   #    725:10   Preassigned
  78 ILE  HN           79 TYR  HN          5.00   #    730:10   Preassigned
  79 TYR  HD           79 TYR  HN          6.00   #    731:10   Preassigned
  79 TYR  HA           79 TYR  HN          5.00   #    733:10   Preassigned
  79 TYR  HB3          79 TYR  HN          5.00   #    736:10   Preassigned
  79 TYR  HB2          79 TYR  HN          5.00   #    737:10   Preassigned
  78 ILE  HB           79 TYR  HN          6.00   #    738:10   Preassigned
  78 ILE  MG2          79 TYR  HN          6.00   #    742:10   Preassigned
  29 VAL  HN           28 GLY  HN          6.00   #    745:10   Preassigned
  80 PRO  HA           81 GLY  HN          4.00   #    750:10   Preassigned
  81 GLY  HA-          81 GLY  HN          4.00   #    751:10   Preassigned
  80 PRO  HB+          81 GLY  HN          6.00   #    754:10   Preassigned
  80 PRO  HB-          81 GLY  HN          6.00   #    755:10   Preassigned
  82 THR  HA           82 THR  HN          5.00   #    760:10   Preassigned
  82 THR  HB           82 THR  HN          5.00   #    761:10   Preassigned
  81 GLY  HA+          82 THR  HN          4.00   #    762:10   Preassigned
  82 THR  MG2          82 THR  HN          6.00   #    764:10   Preassigned
   0 AMB  10-1:770     84 ASN  HN          4.00   #    770:10   Single Ambig
  84 ASN  HB-          84 ASN  HN          6.00   #    773:10   Preassigned
  74 ASN  HB+          74 ASN  HD21        6.00   #    786:10   Preassigned
  74 ASN  HB-          74 ASN  HD21        6.00   #    787:10   Preassigned
  74 ASN  HB-          74 ASN  HD22        6.00   #    791:10   Preassigned
  21 ASP  HN           38 ASN  HD21        6.00   #    795:10   Preassigned
  38 ASN  HB-          38 ASN  HD21        5.00   #    797:10   Preassigned
  61 ASP  HN           59 ASN  HD2+        6.00   #    804:10   Preassigned
  59 ASN  HB-          59 ASN  HD2+        6.00   #    807:10   Preassigned
  61 ASP  HN           59 ASN  HD2-        6.00   #    810:10   Preassigned
  59 ASN  HB-          59 ASN  HD2-        6.00   #    813:10   Preassigned
  63 LYS  QD           59 ASN  HD2-        6.00   #    814:10   Preassigned
  65 VAL  MGY          59 ASN  HD2-        6.00   #    816:10   Preassigned
  48 GLN  QG           48 GLN  HE21        5.00   #    820:10   Preassigned
  48 GLN  HB-          48 GLN  HE21        6.00   #    821:10   Preassigned
  48 GLN  QG           48 GLN  HE22        5.00   #    827:10   Preassigned
   9 ASN  HB+           9 ASN  HD2+        6.00   #    830:10   Preassigned
   9 ASN  HB-           9 ASN  HD2+        6.00   #    831:10   Preassigned
   9 ASN  HB+           9 ASN  HD2-        6.00   #    837:10   Preassigned
   5 GLN  QG            5 GLN  HE21        6.00   #    842:10   Preassigned
   2 ALA  HA            3 THR  HN          4.00   #    853:10   Preassigned
   4 MET  HB-           5 GLN  HN          5.00   #    856:10   Preassigned
   5 GLN  HA            5 GLN  HN          5.00   #    857:10   Preassigned
  22 LYS  QG           22 LYS  HN          6.00   #    858:10   Preassigned
  23 LYS  QG           23 LYS  HN          5.00   #    859:10   Preassigned
  57 TYR  HB-          24 CYS  HN          6.00   #    860:10   Preassigned
  26 TYR  HB-          27 ASP  HN          5.00   #    861:10   Preassigned
  34 ASP  HN           33 ASP  HN          4.00   #    862:10   Preassigned
  35 GLU  HN           34 ASP  HN          3.00   #    863:10   Preassigned
  33 ASP  HN           34 ASP  HN          4.00   #    864:10   Preassigned
  48 GLN  HN           49 ASP  HN          5.00   #    866:10   Preassigned
  49 ASP  HN           50 CYS  HN          6.00   #    867:10   Preassigned
  64 CYS  HA           57 TYR  HN          6.00   #    868:10   Preassigned
  56 PHE  HA           65 VAL  HN          6.00   #    869:10   Preassigned
  69 ASP  HA           69 ASP  HN          5.00   #    870:10   Preassigned
  72 LEU  HN           71 GLU  HN          5.00   #    871:10   Preassigned
  71 GLU  HN           72 LEU  HN          5.00   #    872:10   Preassigned
  69 ASP  HA           73 ASP  HN          6.00   #    874:10   Preassigned
  74 ASN  HA           74 ASN  HN          5.00   #    875:10   Preassigned
  74 ASN  HA           75 MET  HN          4.00   #    876:10   Preassigned
  73 ASP  HA           75 MET  HN          6.00   #    877:10   Preassigned
  76 ASP  HB-          75 MET  HN          5.00   #    878:10   Preassigned
  74 ASN  HB-          75 MET  HN          5.00   #    879:10   Preassigned
  77 PHE  HN           78 ILE  HN          5.00   #    880:10   Preassigned
  77 PHE  QB           76 ASP  HN          6.00   #    881:10   Preassigned
  78 ILE  HA           78 ILE  HN          5.00   #    883:10   Preassigned
  77 PHE  HA           78 ILE  HN          4.00   #    884:10   Preassigned
  78 ILE  HB           78 ILE  HN          4.00   #    886:10   Preassigned
  78 ILE  HA           79 TYR  HN          4.00   #    887:10   Preassigned
   0 AMB  10-1:890     78 ILE  HN          5.00   #    890:10   Single Ambig
  83 ARG  HN           82 THR  HN          6.00   #    891:10   Preassigned
  82 THR  HN           83 ARG  HN          6.00   #    892:10   Preassigned
  81 GLY  HN           82 THR  HN          6.00   #    894:10   Preassigned
  83 ARG  HA           83 ARG  HN          4.00   #    898:10   Preassigned
  82 THR  HB           83 ARG  HN          6.00   #    899:10   Preassigned
  83 ARG  QG           83 ARG  HN          6.00   #    901:10   Preassigned
  83 ARG  HB-          83 ARG  HN          5.00   #    902:10   Preassigned
  83 ARG  HB+          83 ARG  HN          5.00   #    903:10   Preassigned
   1 LYS  QG            2 ALA  HN          6.00   #    909:10   Preassigned
  13 ASP  HN           12 TYR  HN          6.00   #    910:10   Preassigned
  50 CYS  HB-          11 LYS  HN          6.00   #    961:10   Preassigned
  11 LYS  QB           11 LYS  HN          6.00   #    964:10   Preassigned
  58 ARG  HN           59 ASN  HN          6.00   #    985:10   Preassigned
  63 LYS  HN           59 ASN  HN          6.00   #    990:10   Preassigned
  58 ARG  HA           59 ASN  HN          5.00   #    997:10   Preassigned
  59 ASN  HA           59 ASN  HN          6.00   #    998:10   Preassigned
  64 CYS  HA           59 ASN  HN          6.00   #    999:10   Preassigned
  59 ASN  HB+          59 ASN  HN          6.00   #   1001:10   Preassigned
  59 ASN  HB-          59 ASN  HN          5.00   #   1004:10   Preassigned
  69 ASP  HB-          59 ASN  HN          6.00   #   1005:10   Preassigned
  58 ARG  HB-          59 ASN  HN          6.00   #   1010:10   Preassigned
  58 ARG  HG+          59 ASN  HN          6.00   #   1011:10   Preassigned
  65 VAL  MGX          59 ASN  HN          6.00   #   1015:10   Preassigned
  17 SER  HA           18 LYS  HN          6.00   #   1020:10   Preassigned
  18 LYS  HA           18 LYS  HN          6.00   #   1021:10   Preassigned
  18 LYS  HB+          18 LYS  HN          6.00   #   1026:10   Preassigned
  14 SER  HN           15 CYS  HN          5.00   #   1152:10   Preassigned
  16 GLY  HN           15 CYS  HN          5.00   #   1153:10   Preassigned
  15 CYS  HA           15 CYS  HN          4.00   #   1155:10   Preassigned
  14 SER  HB+          15 CYS  HN          6.00   #   1158:10   Preassigned
  14 SER  HB-          15 CYS  HN          6.00   #   1159:10   Preassigned
  15 CYS  HB+          15 CYS  HN          5.00   #   1160:10   Preassigned
  15 CYS  HB-          15 CYS  HN          5.00   #   1163:10   Preassigned
  13 ASP  HB+          15 CYS  HN          6.00   #   1164:10   Preassigned
  20 CYS  HB-          23 LYS  HN          6.00   #   1221:10   Preassigned
   0 AMB  10-1:1230    49 ASP  HN          6.00   #   1230:10   Single Ambig
  38 ASN  HB+          38 ASN  HN          5.00   #   1246:10   Preassigned
  18 LYS  HB+          19 GLU  HN          6.00   #   1252:10   Preassigned
  53 GLU  HA           55 GLY  HN          6.00   #   1265:10   Preassigned
  50 CYS  HN            6 CYS  HN          6.00   #   1302:10   Preassigned
   7 GLY  HN            6 CYS  HN          5.00   #   1318:10   Preassigned
  28 GLY  HN           30 GLU  HN          6.00   #   1344:10   Preassigned
  84 ASN  HA           84 ASN  HN          6.00   #   1358:10   Preassigned
  12 TYR  HN           13 ASP  HN          5.00   #   1391:10   Preassigned
  12 TYR  HD           13 ASP  HN          6.00   #   1392:10   Preassigned
  50 CYS  HA           13 ASP  HN          6.00   #   1394:10   Preassigned
  12 TYR  HA           13 ASP  HN          4.00   #   1396:10   Preassigned
  12 TYR  HB+          13 ASP  HN          6.00   #   1398:10   Preassigned
  12 TYR  HB-          13 ASP  HN          6.00   #   1399:10   Preassigned
  13 ASP  HB+          13 ASP  HN          5.00   #   1400:10   Preassigned
  13 ASP  HB-          13 ASP  HN          6.00   #   1401:10   Preassigned
  14 SER  HN           13 ASP  HN          6.00   #   1408:10   Preassigned
  23 LYS  HN           24 CYS  HN          6.00   #   1409:10   Preassigned
  57 TYR  HA           24 CYS  HN          6.00   #   1413:10   Preassigned
   0 AMB  10-1:1415    24 CYS  HN          6.00   #   1415:10   Single Ambig
  16 GLY  HN           48 GLN  HN          4.00   #   1431:10   Preassigned
  49 ASP  HN           48 GLN  HN          6.00   #   1432:10   Preassigned
  48 GLN  HA           48 GLN  HN          4.00   #   1433:10   Preassigned
  14 SER  HA           48 GLN  HN          6.00   #   1434:10   Preassigned
  14 SER  HB-          48 GLN  HN          5.00   #   1435:10   Preassigned
  47 HIS  QB           48 GLN  HN          4.00   #   1436:10   Preassigned
  46 CYS  HB+          48 GLN  HN          6.00   #   1437:10   Preassigned
  48 GLN  QG           48 GLN  HN          4.00   #   1438:10   Preassigned
  48 GLN  HB-          48 GLN  HN          4.00   #   1439:10   Preassigned
  30 GLU  HN           32 GLU  HN          6.00   #   1441:10   Preassigned
  32 GLU  HA           32 GLU  HN          3.00   #   1443:10   Preassigned
  32 GLU  QG           32 GLU  HN          4.00   #   1447:10   Preassigned
  32 GLU  HB+          32 GLU  HN          4.00   #   1448:10   Preassigned
  32 GLU  HB-          32 GLU  HN          4.00   #   1449:10   Preassigned
   4 MET  HG+           5 GLN  HN          6.00   #   1474:10   Preassigned
  31 GLU  HA           31 GLU  HN          3.00   #   1494:10   Preassigned
  33 ASP  HB-          31 GLU  HN          6.00   #   1499:10   Preassigned
  31 GLU  QG           31 GLU  HN          4.00   #   1501:10   Preassigned
  31 GLU  HB+          31 GLU  HN          4.00   #   1503:10   Preassigned
  31 GLU  HB-          31 GLU  HN          4.00   #   1504:10   Preassigned
  29 VAL  QG           31 GLU  HN          6.00   #   1508:10   Preassigned
  50 CYS  HB-           8 GLU  HN          6.00   #   1530:10   Preassigned
  68 GLU  HB-          70 CYS  HN          6.00   #   1548:10   Preassigned
  17 SER  HN           16 GLY  HN          5.00   #   1552:10   Preassigned
  48 GLN  HA           16 GLY  HN          6.00   #   1553:10   Preassigned
  16 GLY  HA+          16 GLY  HN          5.00   #   1554:10   Preassigned
  16 GLY  HA-          16 GLY  HN          5.00   #   1555:10   Preassigned
  46 CYS  HB+          16 GLY  HN          6.00   #   1557:10   Preassigned
  15 CYS  HB-          16 GLY  HN          6.00   #   1559:10   Preassigned
   0 AMB  10-1:1579    26 TYR  HN          6.00   #   1579:10   Single Ambig
   0 AMB  10-1:1604    35 GLU  HN          5.00   #   1604:10   Single Ambig
  28 GLY  HA+          27 ASP  HN          6.00   #   1617:10   Preassigned
   0 AMB  10-1:1622    27 ASP  HN          6.00   #   1622:10   Single Ambig
  25 LYS  HB-          27 ASP  HN          6.00   #   1623:10   Preassigned
  36 GLU  HB-          36 GLU  HN          4.00   #   1629:10   Preassigned
  36 GLU  HB+          36 GLU  HN          4.00   #   1630:10   Preassigned
  36 GLU  QG           36 GLU  HN          4.00   #   1631:10   Preassigned
  35 GLU  HA           36 GLU  HN          4.00   #   1633:10   Preassigned
  36 GLU  HA           36 GLU  HN          4.00   #   1634:10   Preassigned
  37 PRO  HD+          36 GLU  HN          6.00   #   1643:10   Preassigned
  37 PRO  HD-          36 GLU  HN          6.00   #   1644:10   Preassigned
  34 ASP  HB+          36 GLU  HN          6.00   #   1651:10   Preassigned
  34 ASP  HB-          36 GLU  HN          6.00   #   1652:10   Preassigned
  59 ASN  HN           63 LYS  HN          6.00   #   1658:10   Preassigned
  64 CYS  HN           63 LYS  HN          6.00   #   1659:10   Preassigned
  62 ASP  HN           63 LYS  HN          5.00   #   1660:10   Preassigned
  61 ASP  HN           63 LYS  HN          6.00   #   1662:10   Preassigned
  59 ASN  HD2+         63 LYS  HN          6.00   #   1663:10   Preassigned
  58 ARG  HA           63 LYS  HN          6.00   #   1664:10   Preassigned
  63 LYS  HA           63 LYS  HN          5.00   #   1666:10   Preassigned
   0 AMB  10-1:1667     0 AMB  10-3:1667   5.00   #   1667:10   Double Ambig
  62 ASP  HB-          63 LYS  HN          6.00   #   1670:10   Preassigned
  61 ASP  HB-          63 LYS  HN          5.00   #   1671:10   Preassigned
  63 LYS  QB           63 LYS  HN          5.00   #   1672:10   Preassigned
  63 LYS  QD           63 LYS  HN          5.00   #   1673:10   Preassigned
  63 LYS  HG+          63 LYS  HN          6.00   #   1674:10   Preassigned
  63 LYS  HG-          63 LYS  HN          6.00   #   1675:10   Preassigned
   0 AMB  10-1:1683    35 GLU  HN          6.00   #   1683:10   Single Ambig
   0 AMB  10-1:1685    35 GLU  HN          6.00   #   1685:10   Single Ambig
   0 AMB  10-1:1686    35 GLU  HN          6.00   #   1686:10   Single Ambig
   0 AMB  10-1:1687     0 AMB  10-3:1687   6.00   #   1687:10   Double Ambig
  58 ARG  HB-          63 LYS  HN          5.00   #   1688:10   Preassigned
  16 GLY  HN           17 SER  HN          6.00   #   1693:10   Preassigned
  17 SER  HA           17 SER  HN          6.00   #   1696:10   Preassigned
   0 AMB  10-1:1697    17 SER  HN          6.00   #   1697:10   Single Ambig
  16 GLY  HA+          17 SER  HN          5.00   #   1699:10   Preassigned
  17 SER  HB+          17 SER  HN          6.00   #   1702:10   Preassigned
  17 SER  HB-          17 SER  HN          6.00   #   1703:10   Preassigned
   0 AMB  10-1:1704    17 SER  HN          5.00   #   1704:10   Single Ambig
   0 AMB  10-1:1707    17 SER  HN          6.00   #   1707:10   Single Ambig
  43 VAL  QG           17 SER  HN          6.00   #   1709:10   Preassigned
  51 VAL  MGY          17 SER  HN          6.00   #   1711:10   Preassigned
   0 AMB  10-1:1723    28 GLY  HN          5.00   #   1723:10   Single Ambig
   0 AMB  10-1:1735    43 VAL  HN          4.00   #   1735:10   Single Ambig
  43 VAL  HA           43 VAL  HN          5.00   #   1739:10   Preassigned
  44 ARG  HA           43 VAL  HN          6.00   #   1740:10   Preassigned
  42 LEU  HA           43 VAL  HN          4.00   #   1741:10   Preassigned
  38 ASN  HA           43 VAL  HN          5.00   #   1742:10   Preassigned
  41 CYS  HA           43 VAL  HN          6.00   #   1743:10   Preassigned
  43 VAL  HB           43 VAL  HN          4.00   #   1747:10   Preassigned
  42 LEU  HB+          43 VAL  HN          4.00   #   1748:10   Preassigned
  42 LEU  HB-          43 VAL  HN          5.00   #   1749:10   Preassigned
  43 VAL  QG           43 VAL  HN          4.00   #   1750:10   Preassigned
  38 ASN  HN           39 VAL  HN          5.00   #   1781:10   Preassigned
  38 ASN  HA           39 VAL  HN          4.00   #   1788:10   Preassigned
  39 VAL  HA           39 VAL  HN          5.00   #   1789:10   Preassigned
  40 PRO  HD+          39 VAL  HN          6.00   #   1791:10   Preassigned
  40 PRO  HD-          39 VAL  HN          6.00   #   1792:10   Preassigned
  38 ASN  HB+          39 VAL  HN          6.00   #   1793:10   Preassigned
  38 ASN  HB-          39 VAL  HN          6.00   #   1794:10   Preassigned
  39 VAL  HB           39 VAL  HN          5.00   #   1796:10   Preassigned
   0 AMB  10-1:1797    39 VAL  HN          6.00   #   1797:10   Single Ambig
  39 VAL  QG           39 VAL  HN          4.00   #   1800:10   Preassigned
  81 GLY  HA-          82 THR  HN          4.00   #   1828:10   Preassigned
   0 AMB  10-1:1856    73 ASP  HN          6.00   #   1856:10   Single Ambig
  74 ASN  HB-          73 ASP  HN          6.00   #   1857:10   Preassigned
  72 LEU  MDX          73 ASP  HN          6.00   #   1860:10   Preassigned
  68 GLU  HB+          69 ASP  HN          5.00   #   1867:10   Preassigned
  78 ILE  HN           29 VAL  HN          6.00   #   1874:10   Preassigned
  52 CYS  HA           56 PHE  HN          6.00   #   1901:10   Preassigned
   4 MET  HB+           4 MET  HN          4.00   #   1925:10   Preassigned
   0 AMB  10-1:1962    72 LEU  HN          6.00   #   1962:10   Single Ambig
  78 ILE  MD1          72 LEU  HN          5.00   #   1963:10   Preassigned
  38 ASN  HB-          38 ASN  HD22        6.00   #   1975:10   Preassigned
  38 ASN  HB+          38 ASN  HD21        6.00   #   2033:10   Preassigned
  60 LYS  QD           61 ASP  HN          6.00   #   2037:10   Preassigned
  74 ASN  HB+          74 ASN  HD22        6.00   #   2108:10   Preassigned
  12 TYR  HA           12 TYR  HN          6.00   #   2159:10   Preassigned
   0 AMB  10-1:2161    27 ASP  HN          4.00   #   2161:10   Single Ambig
   7 GLY  HN            8 GLU  HN          4.00   #   2163:10   Preassigned
  11 LYS  QD           12 TYR  HN          6.00   #   2164:10   Preassigned
  13 ASP  HA           13 ASP  HN          6.00   #   2165:10   Preassigned
  15 CYS  HN           14 SER  HN          5.00   #   2166:10   Preassigned
  14 SER  HA           14 SER  HN          4.00   #   2171:10   Preassigned
  14 SER  HB+          14 SER  HN          5.00   #   2173:10   Preassigned
  14 SER  HB-          14 SER  HN          5.00   #   2174:10   Preassigned
   0 AMB  10-1:2175     0 AMB  10-3:2175   5.00   #   2175:10   Double Ambig
  13 ASP  HB-          14 SER  HN          6.00   #   2176:10   Preassigned
   0 AMB  10-1:2177    24 CYS  HN          6.00   #   2177:10   Single Ambig
  48 GLN  HB+          48 GLN  HN          6.00   #   2185:10   Preassigned
   0 AMB  10-1:2186    49 ASP  HN          6.00   #   2186:10   Single Ambig
  38 ASN  HB+          38 ASN  HD22        6.00   #   2189:10   Preassigned
  59 ASN  HD2-         63 LYS  HN          6.00   #   2190:10   Preassigned
  43 VAL  HB           45 VAL  HN          6.00   #   2197:10   Preassigned
   4 MET  HG-           4 MET  HN          6.00   #   2199:10   Preassigned
  13 ASP  HN           14 SER  HN          6.00   #   2203:10   Preassigned
  10 GLU  HG-          11 LYS  HN          6.00   #   2207:10   Preassigned
  42 LEU  MDX          42 LEU  HN          6.00   #   2212:10   Preassigned
  81 GLY  HA+          81 GLY  HN          4.00   #   2220:10   Preassigned
  50 CYS  HA           51 VAL  MGX         6.00   #      2:0    Preassigned
  65 VAL  HA           65 VAL  MGX         6.00   #      5:0    Preassigned
  65 VAL  HA           65 VAL  MGY         5.00   #      6:0    Preassigned
   6 CYS  HA            6 CYS  HB+         6.00   #      8:0    Preassigned
   0 AMB  0-2:9        52 CYS  HB+         6.00   #      9:0    Single Ambig
   6 CYS  HA            6 CYS  HB-         6.00   #     10:0    Preassigned
  23 LYS  HA            0 AMB  0-1:11      6.00   #     11:0    Single Ambig
  50 CYS  HA           50 CYS  HB-         6.00   #     12:0    Preassigned
  84 ASN  HA           85 PRO  HD+         6.00   #     14:0    Preassigned
  84 ASN  HA           85 PRO  HD-         6.00   #     15:0    Preassigned
  50 CYS  HA           50 CYS  HB+         6.00   #     16:0    Preassigned
  65 VAL  HA            0 AMB  0-1:18      6.00   #     18:0    Single Ambig
  84 ASN  HA           84 ASN  HB-         6.00   #     19:0    Preassigned
   0 AMB  0-2:20        0 AMB  0-1:20      5.00   #     20:0    Double Ambig
  64 CYS  HA           65 VAL  MGX         6.00   #     21:0    Preassigned
   0 AMB  0-2:22        0 AMB  0-1:22      5.00   #     22:0    Double Ambig
   0 AMB  0-2:23        0 AMB  0-1:23      6.00   #     23:0    Double Ambig
  61 ASP  HA           61 ASP  HB+         4.00   #     25:0    Preassigned
  59 ASN  HA           24 CYS  HB2         6.00   #     26:0    Preassigned
  61 ASP  HA           61 ASP  HB-         5.00   #     27:0    Preassigned
  49 ASP  HA           49 ASP  HB+         5.00   #     28:0    Preassigned
   0 AMB  0-2:29        0 AMB  0-1:29      5.00   #     29:0    Double Ambig
  58 ARG  HA           58 ARG  HB+         6.00   #     30:0    Preassigned
  17 SER  HA           17 SER  HB-         5.00   #     31:0    Preassigned
  56 PHE  HA           56 PHE  HB-         5.00   #     32:0    Preassigned
  17 SER  HA           17 SER  HB+         5.00   #     33:0    Preassigned
  48 GLN  HA           48 GLN  HB-         5.00   #     35:0    Preassigned
  47 HIS  HA           47 HIS  QB          4.00   #     36:0    Preassigned
  59 ASN  HA           59 ASN  HB-         5.00   #     38:0    Preassigned
  59 ASN  HA           65 VAL  MGX         6.00   #     39:0    Preassigned
  46 CYS  HA           15 CYS  HB+         6.00   #     43:0    Preassigned
  79 TYR  HA           80 PRO  HD+         5.00   #     46:0    Preassigned
  79 TYR  HA           80 PRO  HD-         5.00   #     47:0    Preassigned
  79 TYR  HA           79 TYR  HB3         6.00   #     48:0    Preassigned
  79 TYR  HA           79 TYR  HB2         6.00   #     50:0    Preassigned
  11 LYS  HA           11 LYS  HB+         5.00   #     51:0    Preassigned
  11 LYS  HA           11 LYS  HB-         5.00   #     52:0    Preassigned
  11 LYS  HA           11 LYS  QG          6.00   #     53:0    Preassigned
  51 VAL  HA           51 VAL  MGX         5.00   #     54:0    Preassigned
  51 VAL  HA           51 VAL  MGY         5.00   #     55:0    Preassigned
   0 AMB  0-2:57        0 AMB  0-1:57      4.00   #     57:0    Double Ambig
  69 ASP  HA           69 ASP  HB+         5.00   #     58:0    Preassigned
  69 ASP  HA           65 VAL  HB          6.00   #     59:0    Preassigned
   0 AMB  0-2:60        0 AMB  0-1:60      5.00   #     60:0    Double Ambig
  69 ASP  HA           72 LEU  MDX         6.00   #     61:0    Preassigned
  74 ASN  HA           74 ASN  HB-         5.00   #     63:0    Preassigned
  74 ASN  HA           74 ASN  HB+         5.00   #     65:0    Preassigned
  12 TYR  HA           12 TYR  HB-         3.00   #     66:0    Preassigned
  36 GLU  HA           37 PRO  HD+         5.00   #     67:0    Preassigned
  36 GLU  HA           36 GLU  QG          5.00   #     68:0    Preassigned
  64 CYS  HA           64 CYS  HB3         6.00   #     69:0    Preassigned
  10 GLU  HA           10 GLU  HG+         6.00   #     70:0    Preassigned
  36 GLU  HA           36 GLU  HB+         5.00   #     71:0    Preassigned
  36 GLU  HA           37 PRO  HB-         6.00   #     72:0    Preassigned
  36 GLU  HA           36 GLU  HB-         6.00   #     73:0    Preassigned
  36 GLU  HA           37 PRO  HD-         5.00   #     74:0    Preassigned
  26 TYR  HA           26 TYR  HB+         5.00   #     75:0    Preassigned
  12 TYR  HA           12 TYR  HB+         5.00   #     76:0    Preassigned
  76 ASP  HA           76 ASP  HB-         5.00   #     77:0    Preassigned
  13 ASP  HA           13 ASP  HB-         5.00   #     78:0    Preassigned
  58 ARG  HA           58 ARG  HG+         6.00   #     79:0    Preassigned
  13 ASP  HA           13 ASP  HB+         5.00   #     81:0    Preassigned
  15 CYS  HA           15 CYS  HB+         5.00   #     82:0    Preassigned
  15 CYS  HA           46 CYS  HB+         5.00   #     83:0    Preassigned
  63 LYS  HA           64 CYS  HB2         6.00   #     84:0    Preassigned
  21 ASP  HA           21 ASP  HB-         5.00   #     85:0    Preassigned
   0 AMB  0-2:86        0 AMB  0-1:86      3.00   #     86:0    Double Ambig
  57 TYR  HA           57 TYR  HB+         5.00   #     87:0    Preassigned
  15 CYS  HA           15 CYS  HB-         5.00   #     88:0    Preassigned
  73 ASP  HA           73 ASP  HB3         5.00   #     89:0    Preassigned
  64 CYS  HA           64 CYS  HB2         6.00   #     90:0    Preassigned
  73 ASP  HA           73 ASP  HB2         3.00   #     91:0    Preassigned
  63 LYS  HA           63 LYS  QB          5.00   #     92:0    Preassigned
   0 AMB  0-2:93        0 AMB  0-1:93      4.00   #     93:0    Double Ambig
  63 LYS  HA           63 LYS  QG          6.00   #     94:0    Preassigned
  46 CYS  HA           46 CYS  HB-         5.00   #     97:0    Preassigned
  46 CYS  HA           46 CYS  HB+         5.00   #     98:0    Preassigned
  46 CYS  HA           45 VAL  MGY         6.00   #     99:0    Preassigned
  41 CYS  HA           41 CYS  HB+         5.00   #    100:0    Preassigned
  77 PHE  HA           77 PHE  HB+         6.00   #    102:0    Preassigned
  77 PHE  HA           77 PHE  HB-         5.00   #    103:0    Preassigned
  42 LEU  HA           42 LEU  HB+         5.00   #    106:0    Preassigned
  42 LEU  HA           42 LEU  HB-         5.00   #    107:0    Preassigned
  42 LEU  HA           42 LEU  MDX         6.00   #    108:0    Preassigned
  42 LEU  HA           42 LEU  MDY         5.00   #    109:0    Preassigned
  37 PRO  HA           37 PRO  QG          5.00   #    111:0    Preassigned
  16 GLY  HA+          15 CYS  HB-         6.00   #    112:0    Preassigned
  75 MET  HA           75 MET  QG          5.00   #    113:0    Preassigned
  75 MET  HA           75 MET  HB+         5.00   #    114:0    Preassigned
   0 AMB  0-2:115       0 AMB  0-1:115     5.00   #    115:0    Double Ambig
   2 ALA  HA            2 ALA  MB          6.00   #    116:0    Preassigned
  39 VAL  HA           40 PRO  HD+         5.00   #    117:0    Preassigned
  39 VAL  HA           39 VAL  HB          5.00   #    118:0    Preassigned
  39 VAL  HA           39 VAL  MGX         5.00   #    119:0    Preassigned
  39 VAL  HA           39 VAL  MGY         5.00   #    120:0    Preassigned
  39 VAL  HA           40 PRO  HD-         5.00   #    121:0    Preassigned
  18 LYS  HA           18 LYS  QG          6.00   #    124:0    Preassigned
  70 CYS  HA           70 CYS  HB+         5.00   #    125:0    Preassigned
  70 CYS  HA           70 CYS  HB-         5.00   #    126:0    Preassigned
  16 GLY  HA+           0 AMB  0-1:127     5.00   #    127:0    Single Ambig
  70 CYS  HA           65 VAL  MGX         5.00   #    128:0    Preassigned
  40 PRO  HA           40 PRO  HG-         5.00   #    129:0    Preassigned
   5 GLN  HA            5 GLN  QG          5.00   #    131:0    Preassigned
   5 GLN  HA            5 GLN  HB+         5.00   #    132:0    Preassigned
  83 ARG  HA           83 ARG  HB-         5.00   #    133:0    Preassigned
   0 AMB  0-2:135       0 AMB  0-1:135     4.00   #    135:0    Double Ambig
   0 AMB  0-2:136       0 AMB  0-1:136     5.00   #    136:0    Double Ambig
  62 ASP  HA           62 ASP  HB+         5.00   #    137:0    Preassigned
  62 ASP  HA           64 CYS  HB2         6.00   #    138:0    Preassigned
   0 AMB  0-2:140       0 AMB  0-1:140     5.00   #    140:0    Double Ambig
  62 ASP  HA           62 ASP  HB-         5.00   #    141:0    Preassigned
  35 GLU  HA           35 GLU  HB+         5.00   #    143:0    Preassigned
  22 LYS  HA           22 LYS  QD          5.00   #    144:0    Preassigned
   0 AMB  0-2:145       0 AMB  0-1:145     5.00   #    145:0    Double Ambig
  82 THR  HA           82 THR  HB          6.00   #    148:0    Preassigned
   0 AMB  0-2:150       0 AMB  0-1:150     5.00   #    150:0    Double Ambig
  82 THR  HA           82 THR  MG2         6.00   #    151:0    Preassigned
   0 AMB  0-2:152       0 AMB  0-1:152     4.00   #    152:0    Double Ambig
   0 AMB  0-2:153       0 AMB  0-1:153     3.00   #    153:0    Double Ambig
   0 AMB  0-2:154       0 AMB  0-1:154     3.00   #    154:0    Double Ambig
   4 MET  HA            4 MET  HG-         6.00   #    155:0    Preassigned
   4 MET  HA            4 MET  HB+         5.00   #    156:0    Preassigned
   4 MET  HA            4 MET  HB-         5.00   #    157:0    Preassigned
  56 PHE  HA           56 PHE  HB+         6.00   #    158:0    Preassigned
   0 AMB  0-2:161       0 AMB  0-1:161     6.00   #    161:0    Double Ambig
  66 SER  HA           66 SER  QB          4.00   #    163:0    Preassigned
  44 ARG  HA           44 ARG  QD          6.00   #    164:0    Preassigned
  71 GLU  HA           71 GLU  HB+         5.00   #    165:0    Preassigned
  24 CYS  HA           57 TYR  HB-         6.00   #    166:0    Preassigned
  71 GLU  HA           71 GLU  HG+         5.00   #    167:0    Preassigned
  71 GLU  HA           71 GLU  HB-         5.00   #    168:0    Preassigned
  72 LEU  HA           72 LEU  HB+         4.00   #    169:0    Preassigned
   0 AMB  0-2:170       0 AMB  0-1:170     5.00   #    170:0    Double Ambig
   0 AMB  0-2:171       0 AMB  0-1:171     5.00   #    171:0    Double Ambig
  72 LEU  HA           72 LEU  MDX         6.00   #    172:0    Preassigned
  72 LEU  HA           72 LEU  MDY         4.00   #    173:0    Preassigned
  82 THR  HB           82 THR  HA          6.00   #    174:0    Preassigned
  25 LYS  HA           25 LYS  QD          4.00   #    175:0    Preassigned
   0 AMB  0-2:178       0 AMB  0-1:178     5.00   #    178:0    Double Ambig
   0 AMB  0-2:179       0 AMB  0-1:179     5.00   #    179:0    Double Ambig
  19 GLU  HA           19 GLU  QG          5.00   #    180:0    Preassigned
  19 GLU  HA           19 GLU  HB-         5.00   #    181:0    Preassigned
  18 LYS  HA           51 VAL  MGY         5.00   #    182:0    Preassigned
  60 LYS  HA           60 LYS  HB+         3.00   #    184:0    Preassigned
  60 LYS  HA           60 LYS  HB-         4.00   #    185:0    Preassigned
  60 LYS  HA           60 LYS  HG+         6.00   #    186:0    Preassigned
  60 LYS  HA           60 LYS  HG-         6.00   #    187:0    Preassigned
   3 THR  HA            3 THR  MG2         6.00   #    189:0    Preassigned
   3 THR  HA            3 THR  HB          5.00   #    190:0    Preassigned
  29 VAL  HA           29 VAL  HB          5.00   #    192:0    Preassigned
  29 VAL  HA           29 VAL  MGX         5.00   #    193:0    Preassigned
  29 VAL  HA           29 VAL  MGY         5.00   #    194:0    Preassigned
  45 VAL  HA           45 VAL  MGY         5.00   #    195:0    Preassigned
  45 VAL  HA           45 VAL  HB          5.00   #    196:0    Preassigned
  45 VAL  HA           45 VAL  MGX         5.00   #    197:0    Preassigned
  24 CYS  HA           24 CYS  HB2         5.00   #    198:0    Preassigned
  68 GLU  HA           68 GLU  HG+         5.00   #    200:0    Preassigned
  68 GLU  HA           68 GLU  HG-         5.00   #    201:0    Preassigned
   0 AMB  0-2:202       0 AMB  0-1:202     3.00   #    202:0    Double Ambig
   0 AMB  0-2:203       0 AMB  0-1:203     3.00   #    203:0    Double Ambig
  43 VAL  HA           43 VAL  QG          5.00   #    205:0    Preassigned
  43 VAL  HA           45 VAL  MGY         5.00   #    206:0    Preassigned
  78 ILE  HA           78 ILE  HB          6.00   #    210:0    Preassigned
  78 ILE  HA           78 ILE  HG1-        6.00   #    211:0    Preassigned
  78 ILE  HA           78 ILE  MD1         6.00   #    212:0    Preassigned
  78 ILE  HA           78 ILE  MG2         5.00   #    213:0    Preassigned
   3 THR  HB            3 THR  HA          6.00   #    220:0    Preassigned
   3 THR  HB            3 THR  MG2         5.00   #    221:0    Preassigned
  53 GLU  HA           53 GLU  HG+         5.00   #    223:0    Preassigned
   0 AMB  0-2:224       0 AMB  0-1:224     6.00   #    224:0    Double Ambig
  53 GLU  HA           53 GLU  HB+         6.00   #    225:0    Preassigned
  53 GLU  HA           11 LYS  QG          6.00   #    226:0    Preassigned
  66 SER  QB           66 SER  HA          5.00   #    227:0    Preassigned
   8 GLU  HA            8 GLU  QG          5.00   #    231:0    Preassigned
   8 GLU  HA            8 GLU  HB+         5.00   #    232:0    Preassigned
   8 GLU  HA            8 GLU  HB-         5.00   #    233:0    Preassigned
  40 PRO  HD+           0 AMB  0-1:241     6.00   #    241:0    Single Ambig
  40 PRO  HD+          37 PRO  HB-         5.00   #    245:0    Preassigned
  37 PRO  HD+          37 PRO  HB-         5.00   #    247:0    Preassigned
   9 ASN  HA            9 ASN  HB+         5.00   #    251:0    Preassigned
  40 PRO  HD-          40 PRO  HG+         5.00   #    252:0    Preassigned
   9 ASN  HA            9 ASN  HB-         5.00   #    253:0    Preassigned
  40 PRO  HD-           0 AMB  0-1:257     5.00   #    257:0    Single Ambig
  37 PRO  HD-          37 PRO  HB-         4.00   #    258:0    Preassigned
  40 PRO  HD-          39 VAL  MGX         6.00   #    259:0    Preassigned
  67 ALA  HA           67 ALA  MB          5.00   #    263:0    Preassigned
  62 ASP  HB+          62 ASP  HA          6.00   #    266:0    Preassigned
  44 ARG  QD           44 ARG  HB+         6.00   #    293:0    Preassigned
  44 ARG  QD           44 ARG  HB-         5.00   #    294:0    Preassigned
  44 ARG  QD           44 ARG  HG+         5.00   #    295:0    Preassigned
  44 ARG  QD           44 ARG  HG-         5.00   #    296:0    Preassigned
   0 AMB  0-2:305       0 AMB  0-1:305     5.00   #    305:0    Double Ambig
  41 CYS  HB-          23 LYS  HD+         6.00   #    306:0    Preassigned
  41 CYS  HB-          23 LYS  QG          6.00   #    307:0    Preassigned
   0 AMB  0-2:311       0 AMB  0-1:311     5.00   #    311:0    Double Ambig
  56 PHE  HB+          53 GLU  HB+         5.00   #    312:0    Preassigned
   0 AMB  0-2:315       0 AMB  0-1:315     5.00   #    315:0    Double Ambig
   0 AMB  0-2:316       0 AMB  0-1:316     5.00   #    316:0    Double Ambig
   0 AMB  0-2:317       0 AMB  0-1:317     5.00   #    317:0    Double Ambig
   0 AMB  0-2:318       0 AMB  0-1:318     5.00   #    318:0    Double Ambig
  61 ASP  HB+          63 LYS  QG          5.00   #    326:0    Preassigned
   0 AMB  0-2:327       0 AMB  0-1:327     5.00   #    327:0    Double Ambig
   0 AMB  0-2:328       0 AMB  0-1:328     5.00   #    328:0    Double Ambig
  50 CYS  HB+          10 GLU  HB-         4.00   #    331:0    Preassigned
  64 CYS  HB2           9 ASN  HB-         6.00   #    332:0    Preassigned
   0 AMB  0-2:333      72 LEU  HB-         5.00   #    333:0    Single Ambig
   0 AMB  0-2:343       0 AMB  0-1:343     4.00   #    343:0    Double Ambig
  51 VAL  HB           51 VAL  MGX         5.00   #    347:0    Preassigned
  51 VAL  HB           51 VAL  MGY         5.00   #    348:0    Preassigned
   0 AMB  0-2:354       0 AMB  0-1:354     5.00   #    354:0    Double Ambig
   0 AMB  0-2:357       0 AMB  0-1:357     6.00   #    357:0    Double Ambig
  21 ASP  HB-          15 CYS  HB-         5.00   #    368:0    Preassigned
   9 ASN  HB+           9 ASN  HA          5.00   #    379:0    Preassigned
   0 AMB  0-2:381       0 AMB  0-1:381     5.00   #    381:0    Double Ambig
  41 CYS  HB+          20 CYS  HB+         6.00   #    386:0    Preassigned
  65 VAL  HB           69 ASP  HB-         5.00   #    389:0    Preassigned
  65 VAL  HB           65 VAL  MGX         5.00   #    390:0    Preassigned
  65 VAL  HB           65 VAL  MGY         5.00   #    391:0    Preassigned
  65 VAL  HB           68 GLU  HB+         6.00   #    395:0    Preassigned
  65 VAL  HB           68 GLU  HB-         6.00   #    397:0    Preassigned
  13 ASP  HB+          51 VAL  MGX         6.00   #    401:0    Preassigned
   0 AMB  0-2:405       0 AMB  0-1:405     4.00   #    405:0    Double Ambig
  68 GLU  HG+          68 GLU  HA          6.00   #    406:0    Preassigned
  71 GLU  HG+          71 GLU  HB+         5.00   #    407:0    Preassigned
   0 AMB  0-2:411       0 AMB  0-1:411     3.00   #    411:0    Double Ambig
   0 AMB  0-2:413       0 AMB  0-1:413     5.00   #    413:0    Double Ambig
  19 GLU  QG           19 GLU  HA          5.00   #    414:0    Preassigned
  68 GLU  HG-          68 GLU  HA          5.00   #    415:0    Preassigned
   0 AMB  0-2:418       0 AMB  0-1:418     3.00   #    418:0    Double Ambig
   0 AMB  0-2:419       0 AMB  0-1:419     3.00   #    419:0    Double Ambig
   8 GLU  QG            8 GLU  HA          5.00   #    420:0    Preassigned
   8 GLU  QG            8 GLU  HB+         4.00   #    422:0    Preassigned
   8 GLU  QG            8 GLU  HB-         5.00   #    423:0    Preassigned
   4 MET  HG+           4 MET  HB-         5.00   #    424:0    Preassigned
   5 GLN  QG            5 GLN  HB+         3.00   #    427:0    Preassigned
  37 PRO  HB+          37 PRO  QG          3.00   #    429:0    Preassigned
   0 AMB  0-2:431       0 AMB  0-1:431     6.00   #    431:0    Double Ambig
   0 AMB  0-2:432       0 AMB  0-1:432     3.00   #    432:0    Double Ambig
  37 PRO  HB+          37 PRO  HA          6.00   #    435:0    Preassigned
   0 AMB  0-2:438       0 AMB  0-1:438     4.00   #    438:0    Double Ambig
  13 ASP  HB-          51 VAL  MGX         5.00   #    440:0    Preassigned
  71 GLU  HB+          71 GLU  HA          6.00   #    442:0    Preassigned
   5 GLN  QG            5 GLN  HA          6.00   #    445:0    Preassigned
  71 GLU  HB+          71 GLU  HG+         5.00   #    446:0    Preassigned
   0 AMB  0-2:448       0 AMB  0-1:448     4.00   #    448:0    Double Ambig
  10 GLU  HG+           8 GLU  HA          6.00   #    454:0    Preassigned
   0 AMB  0-2:455       0 AMB  0-1:455     3.00   #    455:0    Double Ambig
  71 GLU  HB-          71 GLU  HA          6.00   #    456:0    Preassigned
  53 GLU  HG+          53 GLU  HA          5.00   #    457:0    Preassigned
   0 AMB  0-2:458      40 PRO  HD+         5.00   #    458:0    Single Ambig
   0 AMB  0-2:459      40 PRO  HD-         5.00   #    459:0    Single Ambig
  39 VAL  HB           39 VAL  MGX         5.00   #    461:0    Preassigned
  39 VAL  HB           39 VAL  MGY         5.00   #    462:0    Preassigned
   0 AMB  0-2:463       0 AMB  0-1:463     5.00   #    463:0    Double Ambig
   0 AMB  0-2:464       0 AMB  0-1:464     3.00   #    464:0    Double Ambig
   0 AMB  0-2:466       0 AMB  0-1:466     5.00   #    466:0    Double Ambig
  29 VAL  HB           29 VAL  HA          5.00   #    467:0    Preassigned
   4 MET  ME           12 TYR  HB+         6.00   #    468:0    Preassigned
   0 AMB  0-2:469       0 AMB  0-1:469     5.00   #    469:0    Double Ambig
   0 AMB  0-2:472       0 AMB  0-1:472     4.00   #    472:0    Double Ambig
   0 AMB  0-2:473      11 LYS  QG          5.00   #    473:0    Single Ambig
  29 VAL  HB           29 VAL  MGY         5.00   #    474:0    Preassigned
  19 GLU  HB+          15 CYS  HB-         5.00   #    475:0    Preassigned
   0 AMB  0-2:476       0 AMB  0-1:476     4.00   #    476:0    Double Ambig
   5 GLN  HB+           5 GLN  HA          6.00   #    478:0    Preassigned
   5 GLN  HB+           5 GLN  QG          3.00   #    479:0    Preassigned
  37 PRO  HB-          37 PRO  HD-         4.00   #    480:0    Preassigned
  37 PRO  HB-          37 PRO  HD+         5.00   #    481:0    Preassigned
  43 VAL  HB           43 VAL  QG          4.00   #    482:0    Preassigned
  43 VAL  HB           45 VAL  MGY         4.00   #    483:0    Preassigned
   0 AMB  0-2:484       0 AMB  0-1:484     5.00   #    484:0    Double Ambig
  19 GLU  HB-          19 GLU  HA          5.00   #    486:0    Preassigned
   0 AMB  0-2:487       0 AMB  0-1:487     4.00   #    487:0    Double Ambig
   0 AMB  0-2:488       0 AMB  0-1:488     5.00   #    488:0    Double Ambig
   0 AMB  0-2:490       0 AMB  0-1:490     5.00   #    490:0    Double Ambig
   0 AMB  0-2:491       0 AMB  0-1:491     3.00   #    491:0    Double Ambig
   0 AMB  0-2:495       0 AMB  0-1:495     4.00   #    495:0    Double Ambig
  80 PRO  HB-          85 PRO  HD+         5.00   #    497:0    Preassigned
   0 AMB  0-2:499       0 AMB  0-1:499     5.00   #    499:0    Double Ambig
   0 AMB  0-2:500       0 AMB  0-1:500     3.00   #    500:0    Double Ambig
   8 GLU  HB+           8 GLU  QG          4.00   #    501:0    Preassigned
   8 GLU  HB+           8 GLU  HA          5.00   #    503:0    Preassigned
  22 LYS  QB           22 LYS  QD          3.00   #    505:0    Preassigned
   0 AMB  0-2:506       6 CYS  HB-         5.00   #    506:0    Single Ambig
   0 AMB  0-2:507       0 AMB  0-1:507     5.00   #    507:0    Double Ambig
   5 GLN  HB-           5 GLN  QG          4.00   #    508:0    Preassigned
  45 VAL  HB           45 VAL  HA          5.00   #    509:0    Preassigned
  45 VAL  HB           45 VAL  MGX         4.00   #    510:0    Preassigned
  45 VAL  HB           45 VAL  MGY         4.00   #    511:0    Preassigned
   1 LYS  QB            1 LYS  HA          6.00   #    513:0    Preassigned
  25 LYS  QB           67 ALA  MB          6.00   #    514:0    Preassigned
   1 LYS  QB            1 LYS  QG          4.00   #    515:0    Preassigned
   8 GLU  HB-           8 GLU  HA          5.00   #    516:0    Preassigned
   8 GLU  HB-           8 GLU  QG          4.00   #    517:0    Preassigned
  37 PRO  QG           37 PRO  HB+         3.00   #    518:0    Preassigned
  72 LEU  HB+          72 LEU  MDX         5.00   #    520:0    Preassigned
  72 LEU  HB+          72 LEU  MDY         5.00   #    521:0    Preassigned
   0 AMB  0-2:522       0 AMB  0-1:522     5.00   #    522:0    Double Ambig
  44 ARG  HB+          44 ARG  QD          5.00   #    523:0    Preassigned
   0 AMB  0-2:526       0 AMB  0-1:526     5.00   #    526:0    Double Ambig
   0 AMB  0-2:528       0 AMB  0-1:528     5.00   #    528:0    Double Ambig
  44 ARG  HB+          44 ARG  HG-         4.00   #    529:0    Preassigned
  60 LYS  HB+          60 LYS  HA          4.00   #    530:0    Preassigned
  60 LYS  HB+          60 LYS  HG-         5.00   #    531:0    Preassigned
   4 MET  HB-           4 MET  HG+         5.00   #    532:0    Preassigned
   0 AMB  0-2:533       0 AMB  0-1:533     5.00   #    533:0    Double Ambig
  40 PRO  HG-          37 PRO  HB-         5.00   #    534:0    Preassigned
  40 PRO  HG-          40 PRO  HB+         3.00   #    538:0    Preassigned
  63 LYS  QB           63 LYS  QG          5.00   #    539:0    Preassigned
  63 LYS  QB           60 LYS  HG-         5.00   #    540:0    Preassigned
  63 LYS  QB           65 VAL  MGY         6.00   #    541:0    Preassigned
  63 LYS  QB            0 AMB  0-1:542     5.00   #    542:0    Single Ambig
  72 LEU  HG           72 LEU  MDX         5.00   #    543:0    Preassigned
  72 LEU  HG           72 LEU  MDY         5.00   #    544:0    Preassigned
   0 AMB  0-2:545       0 AMB  0-1:545     5.00   #    545:0    Double Ambig
  44 ARG  HB-          44 ARG  QD          5.00   #    546:0    Preassigned
  60 LYS  HB-          60 LYS  HA          5.00   #    548:0    Preassigned
  60 LYS  HB-          60 LYS  HG-         5.00   #    549:0    Preassigned
  44 ARG  HB-           0 AMB  0-1:550     6.00   #    550:0    Single Ambig
  11 LYS  HB+          12 TYR  HB+         5.00   #    551:0    Preassigned
  18 LYS  HB-          58 ARG  QD          4.00   #    552:0    Preassigned
   0 AMB  0-2:555       0 AMB  0-1:555     5.00   #    555:0    Double Ambig
   0 AMB  0-2:557       0 AMB  0-1:557     3.00   #    557:0    Double Ambig
  18 LYS  HB-          18 LYS  QG          5.00   #    558:0    Preassigned
  58 ARG  HG-          58 ARG  HB-         4.00   #    559:0    Preassigned
  11 LYS  HB+          11 LYS  QG          5.00   #    563:0    Preassigned
  53 GLU  HB+          56 PHE  HB+         5.00   #    564:0    Preassigned
   0 AMB  0-2:565       0 AMB  0-1:565     3.00   #    565:0    Double Ambig
  78 ILE  HB           78 ILE  HA          6.00   #    566:0    Preassigned
  78 ILE  HB           78 ILE  HG1-        5.00   #    567:0    Preassigned
  78 ILE  HB           78 ILE  MD1         6.00   #    568:0    Preassigned
  78 ILE  HB           78 ILE  MG2         5.00   #    569:0    Preassigned
   0 AMB  0-2:570       0 AMB  0-1:570     5.00   #    570:0    Double Ambig
  22 LYS  QD           22 LYS  QB          4.00   #    571:0    Preassigned
   0 AMB  0-2:572       0 AMB  0-1:572     5.00   #    572:0    Double Ambig
   0 AMB  0-2:574       0 AMB  0-1:574     5.00   #    574:0    Double Ambig
  63 LYS  QD           63 LYS  QG          3.00   #    576:0    Preassigned
  78 ILE  HB           78 ILE  HG1+        3.00   #    577:0    Preassigned
  72 LEU  HB-          72 LEU  MDX         5.00   #    578:0    Preassigned
  53 GLU  HB-          53 GLU  HA          5.00   #    579:0    Preassigned
  72 LEU  HB-          72 LEU  MDY         4.00   #    581:0    Preassigned
  42 LEU  HB+          42 LEU  MDY         5.00   #    582:0    Preassigned
  11 LYS  QD           51 VAL  MGX         6.00   #    583:0    Preassigned
  44 ARG  HG+          44 ARG  QD          5.00   #    584:0    Preassigned
   0 AMB  0-2:585       0 AMB  0-1:585     5.00   #    585:0    Double Ambig
  11 LYS  QD           11 LYS  QG          4.00   #    586:0    Preassigned
  10 GLU  HB-          50 CYS  HB+         4.00   #    587:0    Preassigned
   0 AMB  0-2:590       0 AMB  0-1:590     4.00   #    590:0    Double Ambig
  25 LYS  QD           25 LYS  HA          5.00   #    591:0    Preassigned
  44 ARG  HG-          44 ARG  QD          5.00   #    592:0    Preassigned
  83 ARG  QG           83 ARG  QD          5.00   #    593:0    Preassigned
   0 AMB  0-2:594       0 AMB  0-1:594     3.00   #    594:0    Double Ambig
   0 AMB  0-2:595       0 AMB  0-1:595     5.00   #    595:0    Double Ambig
   0 AMB  0-2:597       0 AMB  0-1:597     3.00   #    597:0    Double Ambig
  18 LYS  QD           18 LYS  QG          3.00   #    598:0    Preassigned
  60 LYS  QD           60 LYS  HA          6.00   #    599:0    Preassigned
   0 AMB  0-2:600       0 AMB  0-1:600     4.00   #    600:0    Double Ambig
  42 LEU  HB-          42 LEU  MDX         4.00   #    601:0    Preassigned
  42 LEU  HB-          42 LEU  MDY         4.00   #    602:0    Preassigned
  23 LYS  QG           23 LYS  HB+         6.00   #    603:0    Preassigned
  63 LYS  QG           63 LYS  QB          5.00   #    608:0    Preassigned
  63 LYS  QG           63 LYS  QD          4.00   #    609:0    Preassigned
  63 LYS  QG           60 LYS  HG-         3.00   #    611:0    Preassigned
  60 LYS  HG+          60 LYS  HB+         6.00   #    612:0    Preassigned
  18 LYS  QG           58 ARG  HG-         5.00   #    614:0    Preassigned
  18 LYS  QG           18 LYS  QD          4.00   #    615:0    Preassigned
   1 LYS  QG            3 THR  MG2         5.00   #    617:0    Preassigned
   2 ALA  MB            2 ALA  HA          6.00   #    619:0    Preassigned
  60 LYS  HG-          60 LYS  HB+         5.00   #    620:0    Preassigned
   2 ALA  MB           50 CYS  HB-         5.00   #    622:0    Preassigned
  60 LYS  HG-          60 LYS  HB-         5.00   #    623:0    Preassigned
   0 AMB  0-2:624       0 AMB  0-1:624     5.00   #    624:0    Double Ambig
  78 ILE  HG1+         77 PHE  HB-         6.00   #    625:0    Preassigned
  78 ILE  HG1+         78 ILE  HB          3.00   #    626:0    Preassigned
  60 LYS  HG-          63 LYS  QG          3.00   #    627:0    Preassigned
  78 ILE  HG1+         78 ILE  MD1         5.00   #    628:0    Preassigned
  78 ILE  HG1+         78 ILE  MG2         6.00   #    630:0    Preassigned
  67 ALA  MB           67 ALA  HA          4.00   #    632:0    Preassigned
   9 ASN  HB-           9 ASN  HA          5.00   #    637:0    Preassigned
  82 THR  MG2          82 THR  HA          6.00   #    639:0    Preassigned
   0 AMB  0-2:640       0 AMB  0-1:640     6.00   #    640:0    Double Ambig
  25 LYS  QG           25 LYS  QD          4.00   #    642:0    Preassigned
  11 LYS  QG           11 LYS  HB-         5.00   #    646:0    Preassigned
  11 LYS  QG           11 LYS  QD          5.00   #    647:0    Preassigned
  11 LYS  QG           51 VAL  MGX         5.00   #    649:0    Preassigned
   3 THR  MG2           3 THR  HA          6.00   #    652:0    Preassigned
   3 THR  MG2           3 THR  HB          5.00   #    653:0    Preassigned
  78 ILE  HG1-         78 ILE  MG2         5.00   #    658:0    Preassigned
  78 ILE  HG1-         78 ILE  MD1         5.00   #    660:0    Preassigned
  65 VAL  MGX           0 AMB  0-1:661     5.00   #    661:0    Single Ambig
  65 VAL  MGX          69 ASP  HB-         6.00   #    662:0    Preassigned
  65 VAL  MGX          65 VAL  HB          5.00   #    663:0    Preassigned
  39 VAL  MGX          40 PRO  HD+         6.00   #    665:0    Preassigned
  39 VAL  MGX          40 PRO  HD-         6.00   #    666:0    Preassigned
  39 VAL  MGX          39 VAL  HB          5.00   #    667:0    Preassigned
  72 LEU  MDX          72 LEU  HB-         5.00   #    668:0    Preassigned
   0 AMB  0-2:670       0 AMB  0-1:670     6.00   #    670:0    Double Ambig
  72 LEU  MDX          72 LEU  HB+         5.00   #    671:0    Preassigned
  72 LEU  MDX          72 LEU  HG          4.00   #    672:0    Preassigned
  39 VAL  MGY          39 VAL  HB          4.00   #    674:0    Preassigned
  65 VAL  MGY          65 VAL  HA          6.00   #    676:0    Preassigned
  65 VAL  MGY           0 AMB  0-1:677     5.00   #    677:0    Single Ambig
  65 VAL  MGY          69 ASP  HB-         5.00   #    678:0    Preassigned
  29 VAL  MGX          29 VAL  HB          4.00   #    681:0    Preassigned
   0 AMB  0-2:682       0 AMB  0-1:682     5.00   #    682:0    Double Ambig
  72 LEU  MDY          72 LEU  HA          5.00   #    683:0    Preassigned
  72 LEU  MDY          71 GLU  HG+         6.00   #    684:0    Preassigned
  72 LEU  MDY          72 LEU  HB+         5.00   #    686:0    Preassigned
  72 LEU  MDY          72 LEU  HG          3.00   #    687:0    Preassigned
  72 LEU  MDY          72 LEU  HB-         3.00   #    688:0    Preassigned
  42 LEU  MDX          42 LEU  HB-         3.00   #    690:0    Preassigned
  29 VAL  MGX          29 VAL  HA          5.00   #    692:0    Preassigned
  43 VAL  QG           43 VAL  HB          4.00   #    693:0    Preassigned
  43 VAL  QG           43 VAL  HA          5.00   #    694:0    Preassigned
  43 VAL  QG           17 SER  HB+         5.00   #    696:0    Preassigned
  45 VAL  MGX          45 VAL  HA          5.00   #    697:0    Preassigned
  45 VAL  MGX          45 VAL  HB          4.00   #    698:0    Preassigned
  42 LEU  MDY          42 LEU  HA          6.00   #    699:0    Preassigned
  42 LEU  MDY          42 LEU  HB+         5.00   #    700:0    Preassigned
  42 LEU  MDY          42 LEU  HB-         4.00   #    701:0    Preassigned
  45 VAL  MGY          45 VAL  HA          5.00   #    705:0    Preassigned
  45 VAL  MGY          43 VAL  HA          5.00   #    706:0    Preassigned
  45 VAL  MGY          17 SER  HB+         6.00   #    708:0    Preassigned
  45 VAL  MGY          43 VAL  HB          4.00   #    709:0    Preassigned
  45 VAL  MGY          45 VAL  HB          4.00   #    710:0    Preassigned
  78 ILE  MD1          78 ILE  HG1+        6.00   #    712:0    Preassigned
  78 ILE  MD1          78 ILE  HG1-        5.00   #    713:0    Preassigned
  78 ILE  MD1          78 ILE  HA          6.00   #    714:0    Preassigned
  78 ILE  MD1          78 ILE  HB          6.00   #    715:0    Preassigned
  51 VAL  MGX          51 VAL  HB          5.00   #    719:0    Preassigned
  51 VAL  MGX          13 ASP  HB+         5.00   #    720:0    Preassigned
  51 VAL  MGX          13 ASP  HB-         5.00   #    721:0    Preassigned
  51 VAL  MGX          11 LYS  QG          5.00   #    722:0    Preassigned
  78 ILE  MG2          78 ILE  HA          6.00   #    726:0    Preassigned
  78 ILE  MG2          78 ILE  HB          5.00   #    727:0    Preassigned
  78 ILE  MG2          78 ILE  HG1+        6.00   #    728:0    Preassigned
  78 ILE  MG2          78 ILE  HG1-        5.00   #    729:0    Preassigned
  51 VAL  MGY          51 VAL  HB          5.00   #    732:0    Preassigned
  51 VAL  MGY          13 ASP  HB-         5.00   #    733:0    Preassigned
  50 CYS  HA           51 VAL  HN          5.00   #    738:0    Preassigned
  10 GLU  HA           11 LYS  HN          6.00   #    739:0    Preassigned
  65 VAL  HA           56 PHE  HE          6.00   #    740:0    Preassigned
  65 VAL  HA           56 PHE  HD          5.00   #    741:0    Preassigned
  23 LYS  HA           59 ASN  HN          5.00   #    742:0    Preassigned
  64 CYS  HA           65 VAL  HN          5.00   #    743:0    Preassigned
  52 CYS  HA           53 GLU  HN          5.00   #    744:0    Preassigned
  56 PHE  HA           57 TYR  HN          5.00   #    746:0    Preassigned
  17 SER  HA           47 HIS  HE1         6.00   #    747:0    Preassigned
  56 PHE  HA           56 PHE  HN          6.00   #    748:0    Preassigned
  56 PHE  HA           57 TYR  HD          6.00   #    749:0    Preassigned
  56 PHE  HA           56 PHE  HD          6.00   #    750:0    Preassigned
  79 TYR  HA           79 TYR  HD          6.00   #    756:0    Preassigned
  11 LYS  HA           11 LYS  HN          5.00   #    757:0    Preassigned
  26 TYR  HA           26 TYR  HD          5.00   #    758:0    Preassigned
  26 TYR  HA           26 TYR  HE          6.00   #    759:0    Preassigned
  12 TYR  HA           12 TYR  HD          5.00   #    760:0    Preassigned
  12 TYR  HA           12 TYR  HE          6.00   #    761:0    Preassigned
   0 AMB  0-2:762       0 AMB  0-1:762     5.00   #    762:0    Double Ambig
   0 AMB  0-2:763       0 AMB  0-1:763     5.00   #    763:0    Preassigned
  57 TYR  HA           57 TYR  HD          5.00   #    764:0    Preassigned
  77 PHE  HA           77 PHE  HD          6.00   #    765:0    Preassigned
  62 ASP  HA           62 ASP  HN          6.00   #    766:0    Preassigned
   0 AMB  0-2:767       0 AMB  0-1:767     5.00   #    767:0    Double Ambig
  66 SER  HA           56 PHE  HD          6.00   #    768:0    Preassigned
  66 SER  HA           56 PHE  HE          6.00   #    769:0    Preassigned
  71 GLU  HA           26 TYR  HD          6.00   #    770:0    Preassigned
  71 GLU  HA           26 TYR  HE          6.00   #    771:0    Preassigned
  24 CYS  HA           57 TYR  HD          6.00   #    772:0    Preassigned
  54 GLU  HA           56 PHE  HN          5.00   #    773:0    Preassigned
  14 SER  HB+          12 TYR  HE          6.00   #    774:0    Preassigned
  66 SER  QB           56 PHE  HE          6.00   #    775:0    Preassigned
  66 SER  QB           56 PHE  HD          6.00   #    776:0    Preassigned
  14 SER  HB-          12 TYR  HE          6.00   #    778:0    Preassigned
  67 ALA  HA           57 TYR  HD          6.00   #    779:0    Preassigned
  67 ALA  HA           57 TYR  HE          6.00   #    780:0    Preassigned
  47 HIS  QB           47 HIS  HD2         6.00   #    781:0    Preassigned
  26 TYR  HB+          26 TYR  HD          5.00   #    782:0    Preassigned
  26 TYR  HB+          26 TYR  HE          6.00   #    783:0    Preassigned
  12 TYR  HB+          12 TYR  HD          5.00   #    784:0    Preassigned
  12 TYR  HB+          12 TYR  HE          6.00   #    785:0    Preassigned
  79 TYR  HB3          79 TYR  HD          5.00   #    786:0    Preassigned
  56 PHE  HB+          56 PHE  HD          5.00   #    787:0    Preassigned
  56 PHE  HB+          57 TYR  HE          6.00   #    788:0    Preassigned
  77 PHE  HB+          77 PHE  HD          5.00   #    789:0    Preassigned
  77 PHE  HB-          77 PHE  HD          5.00   #    790:0    Preassigned
  64 CYS  HB2          56 PHE  HE          6.00   #    791:0    Preassigned
  79 TYR  HB2          79 TYR  HD          5.00   #    794:0    Preassigned
   0 AMB  0-2:795      26 TYR  HD          6.00   #    795:0    Single Ambig
  79 TYR  HB2          79 TYR  HE          5.00   #    796:0    Preassigned
  26 TYR  HB-          26 TYR  HD          4.00   #    799:0    Preassigned
  26 TYR  HB-          26 TYR  HE          5.00   #    800:0    Preassigned
  12 TYR  HB-          12 TYR  HD          5.00   #    801:0    Preassigned
  12 TYR  HB-          12 TYR  HE          6.00   #    802:0    Preassigned
  74 ASN  HB-          26 TYR  HE          6.00   #    803:0    Preassigned
  56 PHE  HB-          56 PHE  HD          5.00   #    804:0    Preassigned
   9 ASN  HB+          56 PHE  HE          6.00   #    805:0    Preassigned
  57 TYR  HB+          57 TYR  HN          5.00   #    806:0    Preassigned
  57 TYR  HB+          57 TYR  HD          5.00   #    807:0    Preassigned
  57 TYR  HB-          57 TYR  HD          5.00   #    808:0    Preassigned
  48 GLN  HB-          12 TYR  HE          5.00   #    809:0    Preassigned
  53 GLU  HG+          53 GLU  HN          5.00   #    810:0    Preassigned
  53 GLU  HG+          56 PHE  HE          5.00   #    811:0    Preassigned
  53 GLU  HG+          56 PHE  HD          5.00   #    812:0    Preassigned
   4 MET  ME           12 TYR  HE          5.00   #    813:0    Preassigned
   4 MET  ME           12 TYR  HD          6.00   #    814:0    Preassigned
   0 AMB  0-2:815       0 AMB  0-1:815     6.00   #    815:0    Preassigned
   0 AMB  0-2:816       0 AMB  0-1:816     6.00   #    816:0    Double Ambig
  22 LYS  QB           57 TYR  HE          5.00   #    817:0    Preassigned
  22 LYS  QB           57 TYR  HD          5.00   #    818:0    Preassigned
  63 LYS  QB           63 LYS  HN          5.00   #    819:0    Preassigned
  58 ARG  HG-          57 TYR  HD          5.00   #    821:0    Preassigned
   0 AMB  0-2:822       0 AMB  0-1:822     5.00   #    822:0    Double Ambig
  53 GLU  HB+          56 PHE  HD          5.00   #    823:0    Preassigned
  63 LYS  QD           63 LYS  HN          5.00   #    825:0    Preassigned
  63 LYS  QG           63 LYS  HN          6.00   #    826:0    Preassigned
   0 AMB  0-2:827       0 AMB  0-1:827     5.00   #    827:0    Double Ambig
  67 ALA  MB           57 TYR  HD          5.00   #    828:0    Preassigned
  67 ALA  MB           57 TYR  HE          4.00   #    829:0    Preassigned
  65 VAL  MGX          65 VAL  HN          5.00   #    830:0    Preassigned
  65 VAL  MGY          56 PHE  HD          6.00   #    831:0    Preassigned
  45 VAL  MGX          47 HIS  HE1         6.00   #    832:0    Preassigned
  45 VAL  MGX          47 HIS  HD2         6.00   #    833:0    Preassigned
  45 VAL  MGY          47 HIS  HE1         6.00   #    834:0    Preassigned
  45 VAL  MGY          47 HIS  HD2         6.00   #    835:0    Preassigned
  51 VAL  MGX          51 VAL  HN          5.00   #    836:0    Preassigned
  57 TYR  HN           57 TYR  HD          6.00   #    839:0    Preassigned
  56 PHE  HN           56 PHE  HD          6.00   #    864:0    Preassigned
  56 PHE  HZ           56 PHE  HE          5.00   #    881:0    Preassigned
  77 PHE  HE           77 PHE  HD          3.00   #    884:0    Preassigned
  79 TYR  HD           79 TYR  HE          4.00   #    885:0    Preassigned
  56 PHE  HE           56 PHE  HD          3.00   #    887:0    Preassigned
  77 PHE  HD           77 PHE  HE          4.00   #    892:0    Preassigned
  26 TYR  HD           26 TYR  HE          3.00   #    895:0    Preassigned
  12 TYR  HD           12 TYR  HE          3.00   #    897:0    Preassigned
  57 TYR  HD           57 TYR  HN          6.00   #    900:0    Preassigned
  57 TYR  HD           57 TYR  HE          3.00   #    901:0    Preassigned
  79 TYR  HE           79 TYR  HD          4.00   #    905:0    Preassigned
  26 TYR  HE           26 TYR  HD          3.00   #    906:0    Preassigned
  56 PHE  HD           56 PHE  HE          3.00   #    912:0    Preassigned
  12 TYR  HE           12 TYR  HD          3.00   #    914:0    Preassigned
  57 TYR  HE           57 TYR  HD          3.00   #    916:0    Preassigned
  65 VAL  HN           65 VAL  MGX         5.00   #    918:0    Preassigned
  51 VAL  HN           51 VAL  MGX         5.00   #    921:0    Preassigned
   0 AMB  0-2:922       0 AMB  0-1:922     6.00   #    922:0    Double Ambig
  63 LYS  HN           63 LYS  QB          6.00   #    923:0    Preassigned
  63 LYS  HN           63 LYS  QD          6.00   #    924:0    Preassigned
  47 HIS  HD2          47 HIS  QB          6.00   #    925:0    Preassigned
  79 TYR  HD           79 TYR  HB3         5.00   #    926:0    Preassigned
  79 TYR  HD           79 TYR  HB2         6.00   #    928:0    Preassigned
  10 GLU  HN           10 GLU  HG+         6.00   #    929:0    Preassigned
  77 PHE  HD           77 PHE  HB+         6.00   #    930:0    Preassigned
  77 PHE  HD           77 PHE  HB-         6.00   #    931:0    Preassigned
  26 TYR  HD           26 TYR  HB+         5.00   #    932:0    Preassigned
  26 TYR  HD           26 TYR  HB-         5.00   #    933:0    Preassigned
  12 TYR  HD           12 TYR  HB+         5.00   #    935:0    Preassigned
  12 TYR  HD           12 TYR  HB-         5.00   #    936:0    Preassigned
  57 TYR  HD           67 ALA  HA          6.00   #    937:0    Preassigned
  57 TYR  HD           57 TYR  HB+         5.00   #    938:0    Preassigned
  57 TYR  HD           57 TYR  HB-         5.00   #    939:0    Preassigned
  57 TYR  HD           67 ALA  MB          6.00   #    940:0    Preassigned
  26 TYR  HE            0 AMB  0-1:941     5.00   #    941:0    Single Ambig
  26 TYR  HE           73 ASP  HB2         6.00   #    942:0    Preassigned
  26 TYR  HE           24 CYS  HB2         6.00   #    943:0    Preassigned
  56 PHE  HD           56 PHE  HB+         6.00   #    945:0    Preassigned
  56 PHE  HD           56 PHE  HB-         5.00   #    946:0    Preassigned
  56 PHE  HD           53 GLU  HG+         6.00   #    947:0    Preassigned
  56 PHE  HD           53 GLU  HB+         6.00   #    948:0    Preassigned
  12 TYR  HE            4 MET  ME          6.00   #    949:0    Preassigned
  12 TYR  HE           14 SER  HB-         6.00   #    950:0    Preassigned
  12 TYR  HE           48 GLN  HB-         6.00   #    951:0    Preassigned
  57 TYR  HE           67 ALA  HA          6.00   #    952:0    Preassigned
  57 TYR  HE           22 LYS  QD          6.00   #    953:0    Preassigned
  57 TYR  HE           67 ALA  MB          5.00   #    954:0    Preassigned
  69 ASP  HA           72 LEU  HB+         6.00   #    955:0    Preassigned
  23 LYS  HA           58 ARG  HG+         6.00   #    956:0    Preassigned
  23 LYS  HA            0 AMB  0-1:957     6.00   #    957:0    Preassigned
  23 LYS  HA           23 LYS  HD+         6.00   #    958:0    Preassigned
  23 LYS  HA           23 LYS  QG          6.00   #    959:0    Preassigned
   0 AMB  0-2:960       0 AMB  0-1:960     6.00   #    960:0    Double Ambig
   0 AMB  0-2:963      51 VAL  MGY         6.00   #    963:0    Single Ambig
  16 GLY  HA+          51 VAL  MGY         6.00   #    964:0    Preassigned
  13 ASP  HA           51 VAL  MGX         6.00   #    965:0    Preassigned
   0 AMB  0-2:966      78 ILE  HG1-        6.00   #    966:0    Single Ambig
  40 PRO  HD+          40 PRO  HG+         5.00   #    969:0    Preassigned
  40 PRO  HD+           0 AMB  0-1:970     6.00   #    970:0    Single Ambig
   0 AMB  0-2:971       0 AMB  0-1:971     6.00   #    971:0    Double Ambig
  40 PRO  HD-          40 PRO  HG-         6.00   #    973:0    Preassigned
   0 AMB  0-2:976      80 PRO  HB+         6.00   #    976:0    Single Ambig
  80 PRO  HA           80 PRO  HB+         5.00   #    978:0    Preassigned
  37 PRO  HA           37 PRO  HB+         5.00   #    979:0    Preassigned
   0 AMB  0-2:980       0 AMB  0-1:980     6.00   #    980:0    Double Ambig
  24 CYS  HA           24 CYS  HB3         6.00   #    981:0    Preassigned
  15 CYS  HB+          51 VAL  MGY         6.00   #    982:0    Preassigned
  49 ASP  HB+          51 VAL  MGY         6.00   #    983:0    Preassigned
  13 ASP  HB+          51 VAL  MGY         6.00   #    984:0    Preassigned
   0 AMB  0-2:985       0 AMB  0-1:985     6.00   #    985:0    Double Ambig
  69 ASP  HB+          72 LEU  MDX         6.00   #    986:0    Preassigned
  79 TYR  HB3          80 PRO  HD-         6.00   #    999:0    Preassigned
   0 AMB  0-2:1003      0 AMB  0-1:1003    5.00   #   1003:0    Double Ambig
  58 ARG  HA           65 VAL  MGX         6.00   #   1008:0    Preassigned
  63 LYS  HA           64 CYS  HN          6.00   #   1009:0    Preassigned
  48 GLN  HB-          12 TYR  HD          6.00   #   1010:0    Preassigned
  53 GLU  HG-          56 PHE  HD          5.00   #   1011:0    Preassigned
  64 CYS  HA           57 TYR  HN          6.00   #   1016:0    Preassigned
  50 CYS  HA           11 LYS  HN          6.00   #   1018:0    Preassigned
  78 ILE  HG1+         77 PHE  HB+         6.00   #   1020:0    Preassigned
  57 TYR  HD           22 LYS  QD          6.00   #   1022:0    Preassigned
  56 PHE  HD           56 PHE  HN          6.00   #   1030:0    Preassigned
  57 TYR  HD           56 PHE  HD          6.00   #   1032:0    Preassigned
  82 THR  MG2          79 TYR  HD          6.00   #   1039:0    Preassigned
  65 VAL  MGX          57 TYR  HD          6.00   #   1041:0    Preassigned
  65 VAL  MGX          56 PHE  HD          6.00   #   1043:0    Preassigned
   9 ASN  HB-          56 PHE  HD          6.00   #   1045:0    Preassigned
  78 ILE  HG1+         26 TYR  HE          6.00   #   1046:0    Preassigned
  25 LYS  QD           26 TYR  HD          6.00   #   1047:0    Preassigned
   4 MET  HB+          12 TYR  HD          6.00   #   1049:0    Preassigned
   4 MET  HB-          12 TYR  HD          6.00   #   1050:0    Preassigned
  22 LYS  QG           57 TYR  HD          6.00   #   1051:0    Preassigned
  25 LYS  QD           26 TYR  HE          6.00   #   1052:0    Preassigned
   4 MET  HB-          12 TYR  HE          6.00   #   1053:0    Preassigned
  23 LYS  HD+          57 TYR  HD          5.00   #   1054:0    Preassigned
  22 LYS  QG           57 TYR  HE          6.00   #   1056:0    Preassigned
   4 MET  HG-          12 TYR  HD          6.00   #   1057:0    Preassigned
   4 MET  HG-          12 TYR  HE          6.00   #   1059:0    Preassigned
  64 CYS  HB3          56 PHE  HD          6.00   #   1061:0    Preassigned
  57 TYR  HB+          57 TYR  HE          6.00   #   1062:0    Preassigned
  52 CYS  HB+          56 PHE  HD          6.00   #   1063:0    Preassigned
  54 GLU  HA           56 PHE  HD          6.00   #   1068:0    Preassigned
  57 TYR  HA           57 TYR  HE          6.00   #   1072:0    Preassigned
  56 PHE  HA           57 TYR  HE          6.00   #   1073:0    Preassigned
  64 CYS  HA           56 PHE  HD          6.00   #   1074:0    Preassigned
  50 CYS  HA           12 TYR  HD          6.00   #   1075:0    Preassigned
  22 LYS  HA           57 TYR  HD          6.00   #   1077:0    Preassigned
  66 SER  HA           57 TYR  HD          6.00   #   1078:0    Preassigned
   9 ASN  HA           10 GLU  HN          6.00   #   1090:0    Preassigned
  47 HIS  HA           47 HIS  HD2         6.00   #   1094:0    Preassigned
  45 VAL  HB           47 HIS  HD2         6.00   #   1098:0    Preassigned
  55 GLY  HA-          56 PHE  HN          6.00   #   1100:0    Preassigned
  52 CYS  HB+          56 PHE  HN          6.00   #   1101:0    Preassigned
  56 PHE  HB+          56 PHE  HN          5.00   #   1102:0    Preassigned
  56 PHE  HB-          56 PHE  HN          5.00   #   1103:0    Preassigned
  58 ARG  HA           63 LYS  HN          6.00   #   1104:0    Preassigned
  10 GLU  HA           53 GLU  HN          6.00   #   1105:0    Preassigned
  76 ASP  HA           77 PHE  HN          6.00   #   1106:0    Preassigned
   0 AMB  0-2:1111      0 AMB  0-1:1111    5.00   #   1111:0    Double Ambig
   0 AMB  0-2:1112      0 AMB  0-1:1112    6.00   #   1112:0    Double Ambig
   0 AMB  0-2:1114      0 AMB  0-1:1114    6.00   #   1114:0    Double Ambig
   0 AMB  0-2:1115      0 AMB  0-1:1115    6.00   #   1115:0    Double Ambig
  52 CYS  HB+          53 GLU  HN          6.00   #   1116:0    Preassigned
   0 AMB  0-2:1117      0 AMB  0-1:1117    6.00   #   1117:0    Double Ambig
  53 GLU  HA           53 GLU  HN          6.00   #   1118:0    Preassigned
   0 AMB  0-2:1121     34 ASP  HN          6.00   #   1121:0    Single Ambig
  74 ASN  HB-          26 TYR  HD          6.00   #   1122:0    Preassigned
  10 GLU  HB-          10 GLU  HN          6.00   #   1123:0    Preassigned
   4 MET  HB+          12 TYR  HE          6.00   #   1124:0    Preassigned
  10 GLU  HB+          10 GLU  HN          6.00   #   1125:0    Preassigned
   0 AMB  0-2:1126     26 TYR  HD          6.00   #   1126:0    Single Ambig
   0 AMB  0-2:1127     26 TYR  HD          6.00   #   1127:0    Single Ambig
  30 GLU  QG           26 TYR  HD          6.00   #   1128:0    Preassigned
  77 PHE  HB+          77 PHE  HE          6.00   #   1129:0    Preassigned
   0 AMB  0-2:1132      0 AMB  0-1:1132    6.00   #   1132:0    Double Ambig
  56 PHE  HB+          57 TYR  HD          6.00   #   1133:0    Preassigned
  79 TYR  HB3          79 TYR  HE          6.00   #   1134:0    Preassigned
  24 CYS  HB2          26 TYR  HE          6.00   #   1135:0    Preassigned
  64 CYS  HB2          56 PHE  HD          6.00   #   1136:0    Preassigned
  65 VAL  HB           56 PHE  HD          6.00   #   1137:0    Preassigned
  57 TYR  HB-          57 TYR  HE          6.00   #   1138:0    Preassigned
  49 ASP  HB+          12 TYR  HE          6.00   #   1139:0    Preassigned
   4 MET  HG+          12 TYR  HE          6.00   #   1140:0    Preassigned
  68 GLU  HG-          57 TYR  HE          6.00   #   1141:0    Preassigned
  25 LYS  HA           26 TYR  HD          6.00   #   1143:0    Preassigned
  10 GLU  HA           10 GLU  HN          6.00   #   1145:0    Preassigned
  48 GLN  HA           12 TYR  HE          6.00   #   1147:0    Preassigned
   0 AMB  0-2:1149     12 TYR  HD          6.00   #   1149:0    Single Ambig
  12 TYR  HA           50 CYS  HA          6.00   #   1153:0    Preassigned
  68 GLU  HA           71 GLU  HB+         6.00   #   1172:0    Preassigned
  66 SER  HA           65 VAL  MGX         6.00   #   1178:0    Preassigned
  11 LYS  HA           10 GLU  HG+         6.00   #   1180:0    Preassigned
   0 AMB  0-2:1183      0 AMB  0-1:1183    6.00   #   1183:0    Double Ambig
  80 PRO  HD-          80 PRO  HB-         6.00   #   1184:0    Preassigned
  53 GLU  HA           53 GLU  HB-         6.00   #   1188:0    Preassigned
   8 GLU  HA           10 GLU  HG+         6.00   #   1190:0    Preassigned
  60 LYS  HA           60 LYS  QD          5.00   #   1195:0    Preassigned
  44 ARG  HA           44 ARG  HG-         5.00   #   1196:0    Preassigned
   0 AMB  0-2:1197      0 AMB  0-1:1197    6.00   #   1197:0    Double Ambig
  16 GLY  HA+          43 VAL  HB          5.00   #   1198:0    Preassigned
  83 ARG  HA           83 ARG  HB+         5.00   #   1199:0    Preassigned
  40 PRO  HD-          39 VAL  HA          6.00   #   1202:0    Preassigned
  40 PRO  HD+          39 VAL  HA          6.00   #   1203:0    Preassigned
  66 SER  QB           70 CYS  HB-         6.00   #   1204:0    Preassigned
  67 ALA  HA           70 CYS  HB+         6.00   #   1205:0    Preassigned
   0 AMB  0-2:1206      0 AMB  0-1:1206    6.00   #   1206:0    Double Ambig
  18 LYS  HA           51 VAL  HB          6.00   #   1207:0    Preassigned
  35 GLU  HA           35 GLU  QG          5.00   #   1212:0    Preassigned
   4 MET  HA            4 MET  HG+         6.00   #   1213:0    Preassigned
  70 CYS  HB-          67 ALA  HA          6.00   #   1216:0    Preassigned
  79 TYR  HB2          80 PRO  HD-         6.00   #   1217:0    Preassigned
  20 CYS  HB+          41 CYS  HB+         6.00   #   1218:0    Preassigned
  64 CYS  HB2           0 AMB  0-1:1219    4.00   #   1219:0    Single Ambig
   0 AMB  0-2:1220      0 AMB  0-1:1220    6.00   #   1220:0    Double Ambig
  29 VAL  HB           29 VAL  MGX         4.00   #   1221:0    Preassigned
  11 LYS  HB+          51 VAL  MGX         6.00   #   1222:0    Preassigned
  44 ARG  HB-           0 AMB  0-1:1223    6.00   #   1223:0    Single Ambig
  44 ARG  HG-          43 VAL  QG          6.00   #   1224:0    Preassigned
  18 LYS  HB+          51 VAL  MGY         6.00   #   1226:0    Preassigned
  65 VAL  HB           65 VAL  HA          6.00   #   1234:0    Preassigned
   0 AMB  0-2:1235     65 VAL  HA          6.00   #   1235:0    Single Ambig
  70 CYS  HB+          70 CYS  HA          6.00   #   1236:0    Preassigned
   0 AMB  0-2:1237      0 AMB  0-1:1237    6.00   #   1237:0    Double Ambig
  70 CYS  HB-          70 CYS  HA          6.00   #   1238:0    Preassigned
  73 ASP  HB3          73 ASP  HA          6.00   #   1239:0    Preassigned
   0 AMB  0-2:1240      0 AMB  0-1:1240    6.00   #   1240:0    Double Ambig
   0 AMB  0-2:1242      0 AMB  0-1:1242    6.00   #   1242:0    Double Ambig
   0 AMB  0-2:1243      0 AMB  0-1:1243    6.00   #   1243:0    Double Ambig
  62 ASP  HB-          62 ASP  HA          6.00   #   1244:0    Preassigned
   0 AMB  0-2:1245     18 LYS  HA          6.00   #   1245:0    Single Ambig
   0 AMB  0-2:1246      0 AMB  0-1:1246    6.00   #   1246:0    Double Ambig
  70 CYS  HB-          24 CYS  HA          6.00   #   1247:0    Preassigned
   0 AMB  0-2:1248      0 AMB  0-1:1248    6.00   #   1248:0    Double Ambig
  24 CYS  HB2          24 CYS  HA          6.00   #   1249:0    Preassigned
  24 CYS  HB3          24 CYS  HA          6.00   #   1251:0    Preassigned
  71 GLU  HG+          71 GLU  HA          6.00   #   1252:0    Preassigned
  64 CYS  HB2           9 ASN  HA          6.00   #   1257:0    Preassigned
  37 PRO  HB+          37 PRO  HD-         6.00   #   1259:0    Preassigned
  40 PRO  HG-          40 PRO  HD+         6.00   #   1260:0    Preassigned
  37 PRO  HB+          37 PRO  HD+         6.00   #   1261:0    Preassigned
   0 AMB  0-2:1262      0 AMB  0-1:1262    6.00   #   1262:0    Double Ambig
  40 PRO  HB+          40 PRO  HD+         6.00   #   1263:0    Preassigned
  80 PRO  HB+          80 PRO  HD+         6.00   #   1264:0    Preassigned
  40 PRO  HG-          40 PRO  HD-         6.00   #   1265:0    Preassigned
   0 AMB  0-2:1266      9 ASN  HA          6.00   #   1266:0    Single Ambig
  42 LEU  HB+          42 LEU  HA          6.00   #   1267:0    Preassigned
  42 LEU  HB-          42 LEU  HA          6.00   #   1268:0    Preassigned
  37 PRO  QG           37 PRO  HA          6.00   #   1269:0    Preassigned
  11 LYS  HB+           6 CYS  HB+         6.00   #   1271:0    Preassigned
  83 ARG  HB+          83 ARG  QD          6.00   #   1272:0    Preassigned
   4 MET  HG-           4 MET  HA          6.00   #   1273:0    Preassigned
  83 ARG  HB+          83 ARG  HA          6.00   #   1276:0    Preassigned
   4 MET  HB+           4 MET  HA          6.00   #   1277:0    Preassigned
   4 MET  HB-           4 MET  HA          6.00   #   1278:0    Preassigned
  22 LYS  QD           22 LYS  HA          6.00   #   1279:0    Preassigned
   0 AMB  0-2:1280      0 AMB  0-1:1280    6.00   #   1280:0    Double Ambig
  83 ARG  HB-          83 ARG  HA          6.00   #   1281:0    Preassigned
   0 AMB  0-2:1282      0 AMB  0-1:1282    5.00   #   1282:0    Double Ambig
  53 GLU  HB+          53 GLU  HA          6.00   #   1283:0    Preassigned
  37 PRO  QG           37 PRO  HD+         6.00   #   1284:0    Preassigned
  37 PRO  QG           37 PRO  HD-         6.00   #   1285:0    Preassigned
  36 GLU  HB+          37 PRO  HD+         6.00   #   1286:0    Preassigned
   0 AMB  0-2:1287      6 CYS  HB+         5.00   #   1287:0    Single Ambig
  37 PRO  HB-          40 PRO  HD+         5.00   #   1289:0    Preassigned
  10 GLU  HB-           6 CYS  HB+         6.00   #   1290:0    Preassigned
  83 ARG  HB-          83 ARG  QD          6.00   #   1291:0    Preassigned
   0 AMB  0-2:1292     41 CYS  HB-         6.00   #   1292:0    Single Ambig
  68 GLU  HG-          67 ALA  MB          6.00   #   1293:0    Preassigned
  64 CYS  HB3           9 ASN  HB-         6.00   #   1295:0    Preassigned
   0 AMB  0-2:1296      0 AMB  0-1:1296    6.00   #   1296:0    Double Ambig
  61 ASP  HB-          63 LYS  QG          6.00   #   1297:0    Preassigned
   6 CYS  HB-           0 AMB  0-1:1301    6.00   #   1301:0    Single Ambig
  83 ARG  QD           83 ARG  HB+         6.00   #   1302:0    Preassigned
  83 ARG  QD           83 ARG  QG          6.00   #   1305:0    Preassigned
   0 AMB  0-2:1306      0 AMB  0-1:1306    6.00   #   1306:0    Double Ambig
  59 ASN  HB-          58 ARG  HB-         6.00   #   1307:0    Preassigned
  56 PHE  HB+           9 ASN  HB-         6.00   #   1308:0    Preassigned
   5 GLN  QG            5 GLN  HB-         4.00   #   1310:0    Preassigned
   0 AMB  0-2:1312      0 AMB  0-1:1312    4.00   #   1312:0    Preassigned
   0 AMB  0-2:1313      0 AMB  0-1:1313    6.00   #   1313:0    Double Ambig
   0 AMB  0-2:1314      0 AMB  0-1:1314    6.00   #   1314:0    Double Ambig
  78 ILE  HG1-         78 ILE  HB          6.00   #   1315:0    Preassigned
  11 LYS  QG           11 LYS  HB+         5.00   #   1316:0    Preassigned
   0 AMB  0-2:1317      0 AMB  0-1:1317    3.00   #   1317:0    Preassigned
  68 GLU  HB-          67 ALA  MB          6.00   #   1318:0    Preassigned
  10 GLU  HG+           9 ASN  HB-         6.00   #   1319:0    Preassigned
  11 LYS  HB-          11 LYS  QG          5.00   #   1322:0    Preassigned
  60 LYS  QD           60 LYS  HG-         5.00   #   1323:0    Preassigned
  60 LYS  HG-          60 LYS  QD          4.00   #   1324:0    Preassigned
   0 AMB  0-2:1325      0 AMB  0-1:1325    4.00   #   1325:0    Double Ambig
   0 AMB  0-2:1330      0 AMB  0-1:1330    6.00   #   1330:0    Double Ambig
  65 VAL  MGY          67 ALA  MB          6.00   #   1331:0    Preassigned
  51 VAL  MGX          11 LYS  QD          6.00   #   1332:0    Preassigned
  45 VAL  MGX          44 ARG  HB-         6.00   #   1333:0    Preassigned
  42 LEU  MDY          40 PRO  HG-         6.00   #   1334:0    Preassigned
   0 AMB  0-2:1335      0 AMB  0-1:1335    5.00   #   1335:0    Double Ambig
  51 VAL  MGY          15 CYS  HB+         6.00   #   1336:0    Preassigned
  51 VAL  MGY          13 ASP  HB+         6.00   #   1339:0    Preassigned
  51 VAL  MGY          49 ASP  HB+         6.00   #   1340:0    Preassigned
  63 LYS  QG           61 ASP  HB-         6.00   #   1343:0    Preassigned
  67 ALA  MB           70 CYS  HB+         6.00   #   1344:0    Preassigned
  45 VAL  MGY          46 CYS  HB+         6.00   #   1345:0    Preassigned
  45 VAL  MGY          47 HIS  QB          6.00   #   1346:0    Preassigned
  72 LEU  MDX          69 ASP  HB+         6.00   #   1349:0    Preassigned
  10 GLU  HB-           6 CYS  HB-         6.00   #   1350:0    Preassigned
  51 VAL  MGY          18 LYS  HA          6.00   #   1351:0    Preassigned
  39 VAL  MGX          39 VAL  HA          6.00   #   1352:0    Preassigned
  39 VAL  MGY          39 VAL  HA          6.00   #   1353:0    Preassigned
  65 VAL  MGX          70 CYS  HA          6.00   #   1354:0    Preassigned
  72 LEU  MDX          72 LEU  HA          6.00   #   1357:0    Preassigned
  78 ILE  HG1-         78 ILE  HA          6.00   #   1358:0    Preassigned
  29 VAL  MGY          29 VAL  HA          5.00   #   1359:0    Preassigned
  11 LYS  HB+          53 GLU  HA          6.00   #   1360:0    Preassigned
  78 ILE  HG1+         78 ILE  HA          6.00   #   1361:0    Preassigned
   0 AMB  0-2:1363      0 AMB  0-1:1363    6.00   #   1363:0    Double Ambig
  60 LYS  HG-          60 LYS  HA          6.00   #   1364:0    Preassigned
   0 AMB  0-2:1366     20 CYS  HB+         6.00   #   1366:0    Single Ambig
  45 VAL  MGY          17 SER  HB-         6.00   #   1369:0    Preassigned
  43 VAL  QG           17 SER  HB-         5.00   #   1370:0    Preassigned
  60 LYS  HG+          60 LYS  HA          6.00   #   1371:0    Preassigned
  42 LEU  MDX          42 LEU  HA          6.00   #   1372:0    Preassigned
  51 VAL  MGX          50 CYS  HA          6.00   #   1373:0    Preassigned
  65 VAL  MGX          65 VAL  HA          6.00   #   1374:0    Preassigned
  57 TYR  HN           56 PHE  HD          6.00   #   1384:0    Preassigned
  57 TYR  HE           57 TYR  HN          6.00   #   1389:0    Preassigned
  56 PHE  HD           57 TYR  HN          6.00   #   1390:0    Preassigned
  59 ASN  HN           63 LYS  HN          6.00   #   1398:0    Preassigned
  11 LYS  HN           51 VAL  HN          6.00   #   1400:0    Preassigned
  51 VAL  HN           11 LYS  HN          6.00   #   1403:0    Preassigned
  65 VAL  HN           57 TYR  HN          6.00   #   1414:0    Preassigned
  57 TYR  HN           65 VAL  HN          6.00   #   1415:0    Preassigned
  65 VAL  HA           65 VAL  HN          6.00   #   1417:0    Preassigned
   0 AMB  0-2:1418      0 AMB  0-1:1418    6.00   #   1418:0    Preassigned
  57 TYR  HA           57 TYR  HN          6.00   #   1419:0    Preassigned
  66 SER  HA           57 TYR  HN          6.00   #   1422:0    Preassigned
  52 CYS  HA           11 LYS  HN          6.00   #   1424:0    Preassigned
  65 VAL  HA           66 SER  HN          6.00   #   1425:0    Preassigned
  66 SER  HA           66 SER  HN          6.00   #   1429:0    Preassigned
  66 SER  QB           66 SER  HN          6.00   #   1430:0    Preassigned
  51 VAL  MGX          11 LYS  HN          6.00   #   1432:0    Preassigned
  11 LYS  QG           11 LYS  HN          5.00   #   1433:0    Preassigned
  65 VAL  MGX          57 TYR  HN          6.00   #   1434:0    Preassigned
  65 VAL  MGY          65 VAL  HN          5.00   #   1435:0    Preassigned
  65 VAL  MGY          57 TYR  HN          6.00   #   1436:0    Preassigned
  65 VAL  MGX          66 SER  HN          6.00   #   1438:0    Preassigned
  65 VAL  MGY          66 SER  HN          6.00   #   1440:0    Preassigned
  51 VAL  MGY          51 VAL  HN          6.00   #   1441:0    Preassigned
  11 LYS  QG           51 VAL  HN          6.00   #   1442:0    Preassigned
  67 ALA  MB           67 ALA  HN          6.00   #   1444:0    Preassigned
  64 CYS  HB2          65 VAL  HN          6.00   #   1445:0    Preassigned
   0 AMB  0-2:1446     65 VAL  HN          6.00   #   1446:0    Single Ambig
  65 VAL  HB           65 VAL  HN          6.00   #   1447:0    Preassigned
  11 LYS  QD           11 LYS  HN          5.00   #   1448:0    Preassigned
  64 CYS  HB3          65 VAL  HN          6.00   #   1449:0    Preassigned
  57 TYR  HB-          57 TYR  HN          6.00   #   1451:0    Preassigned
  56 PHE  HB+          57 TYR  HN          6.00   #   1452:0    Preassigned
  52 CYS  HB+          11 LYS  HN          6.00   #   1454:0    Preassigned
   0 AMB  0-2:1457     11 LYS  HN          6.00   #   1457:0    Single Ambig
  10 GLU  HB+          11 LYS  HN          6.00   #   1458:0    Preassigned
  11 LYS  HB+          11 LYS  HN          6.00   #   1459:0    Preassigned
  69 ASP  HB-          66 SER  HN          6.00   #   1461:0    Preassigned
  65 VAL  HB           66 SER  HN          6.00   #   1463:0    Preassigned
  10 GLU  HB-          51 VAL  HN          6.00   #   1470:0    Preassigned
  45 VAL  HB           47 HIS  HE1         6.00   #   1471:0    Preassigned
  48 GLN  QG           47 HIS  HE1         6.00   #   1472:0    Preassigned
  77 PHE  HB+          77 PHE  HN          6.00   #   1474:0    Preassigned
  51 VAL  HB           51 VAL  HN          6.00   #   1475:0    Preassigned
  50 CYS  HB+          51 VAL  HN          6.00   #   1476:0    Preassigned
  12 TYR  HA           51 VAL  HN          6.00   #   1477:0    Preassigned
  51 VAL  HA           51 VAL  HN          6.00   #   1478:0    Preassigned
   0 AMB  0-2:1480     65 VAL  HN          6.00   #   1480:0    Single Ambig
   0 AMB  0-2:1481      0 AMB  0-1:1481    6.00   #   1481:0    Double Ambig
   0 AMB  0-2:1482      0 AMB  0-1:1482    5.00   #   1482:0    Preassigned
   0 AMB  0-2:1483      0 AMB  0-1:1483    5.00   #   1483:0    Preassigned
   0 AMB  0-2:1484      0 AMB  0-1:1484    5.00   #   1484:0    Double Ambig
  18 LYS  HB-          18 LYS  HN          6.00   #   1486:0    Preassigned
   0 AMB  0-2:1487     59 ASN  HN          6.00   #   1487:0    Single Ambig
   0 AMB  0-2:1494      0 AMB  0-1:1494    6.00   #   1494:0    Double Ambig
  29 VAL  HA           30 GLU  HN          6.00   #   1495:0    Preassigned
  37 PRO  HA           38 ASN  HN          6.00   #   1497:0    Preassigned
   0 AMB  0-2:1501      0 AMB  0-1:1501    6.00   #   1501:0    Double Ambig
   4 MET  HA            5 GLN  HN          6.00   #   1502:0    Preassigned
   0 AMB  0-2:1504      0 AMB  0-1:1504    6.00   #   1504:0    Double Ambig
   0 AMB  0-2:1505     48 GLN  HN          6.00   #   1505:0    Single Ambig
  27 ASP  HA           27 ASP  HN          6.00   #   1514:0    Preassigned
  72 LEU  HA           72 LEU  HN          6.00   #   1517:0    Preassigned
  43 VAL  HA           44 ARG  HN          6.00   #   1519:0    Preassigned
  53 GLU  HB+          53 GLU  HN          5.00   #   1520:0    Preassigned
  65 VAL  MGY          63 LYS  HN          6.00   #   1521:0    Preassigned
   0 AMB  0-2:1542     62 ASP  HB+         6.00   #   1542:0    Single Ambig
  18 LYS  HA           21 ASP  HB-         6.00   #   1566:0    Preassigned
   0 AMB  0-2:1574     36 GLU  HB-         6.00   #   1574:0    Single Ambig
   0 AMB  0-2:1575     18 LYS  HB-         6.00   #   1575:0    Single Ambig
  46 CYS  HB+          15 CYS  HB+         6.00   #   1576:0    Preassigned
  15 CYS  HB+          46 CYS  HB+         6.00   #   1577:0    Preassigned
  46 CYS  HB-          15 CYS  HB+         6.00   #   1578:0    Preassigned
  50 CYS  HB+           6 CYS  HB+         6.00   #   1580:0    Preassigned
  61 ASP  HB+          62 ASP  HB+         6.00   #   1581:0    Preassigned
  39 VAL  MGY          40 PRO  HD+         6.00   #   1586:0    Preassigned
  39 VAL  MGY          40 PRO  HD-         6.00   #   1587:0    Preassigned
  65 VAL  HN           65 VAL  MGY         6.00   #   1592:0    Preassigned
   0 AMB  0-2:1595      0 AMB  0-1:1595    6.00   #   1595:0    Double Ambig
   0 AMB  0-2:1596      0 AMB  0-1:1596    5.00   #   1596:0    Double Ambig
   0 AMB  0-2:1597      0 AMB  0-1:1597    6.00   #   1597:0    Double Ambig
   0 AMB  0-2:1598     10 GLU  HA          6.00   #   1598:0    Single Ambig
  53 GLU  HG-          56 PHE  HE          5.00   #   1599:0    Preassigned
  57 TYR  HD           22 LYS  QB          6.00   #   1601:0    Preassigned
  30 GLU  HB-          26 TYR  HE          6.00   #   1602:0    Preassigned
  68 GLU  HG-          57 TYR  HD          6.00   #   1603:0    Preassigned
  30 GLU  QG           26 TYR  HE          6.00   #   1604:0    Preassigned
  24 CYS  HB2          57 TYR  HD          6.00   #   1605:0    Preassigned
  56 PHE  HE           66 SER  QB          6.00   #   1620:0    Preassigned
   0 AMB  0-2:1622      0 AMB  0-1:1622    6.00   #   1622:0    Double Ambig
  79 TYR  HD           80 PRO  HD-         6.00   #   1623:0    Preassigned
  26 TYR  HE           26 TYR  HB+         6.00   #   1625:0    Preassigned
  12 TYR  HE           12 TYR  HB+         6.00   #   1627:0    Preassigned
   0 AMB  0-2:1640      0 AMB  0-1:1640    6.00   #   1640:0    Double Ambig
  56 PHE  HE            9 ASN  HB+         6.00   #   1641:0    Preassigned
  26 TYR  HD           74 ASN  HB-         6.00   #   1642:0    Preassigned
  26 TYR  HD            0 AMB  0-1:1643    6.00   #   1643:0    Single Ambig
   0 AMB  0-2:1649      0 AMB  0-1:1649    6.00   #   1649:0    Double Ambig
  56 PHE  HE            9 ASN  HB-         6.00   #   1650:0    Preassigned
  57 TYR  HN           57 TYR  HB+         6.00   #   1655:0    Preassigned
   0 AMB  0-2:1656      0 AMB  0-1:1656    5.00   #   1656:0    Double Ambig
   0 AMB  0-2:1657      0 AMB  0-1:1657    6.00   #   1657:0    Double Ambig
   0 AMB  0-2:1658      0 AMB  0-1:1658    4.00   #   1658:0    Double Ambig
  48 GLN  HA           48 GLN  HB+         6.00   #   1667:0    Preassigned
  52 CYS  HA           10 GLU  HG+         6.00   #   1668:0    Preassigned
   0 AMB  0-2:1669      0 AMB  0-1:1669    6.00   #   1669:0    Double Ambig
  80 PRO  HA           80 PRO  HB-         5.00   #   1670:0    Preassigned
   0 AMB  0-2:1671      0 AMB  0-1:1671    6.00   #   1671:0    Double Ambig
  23 LYS  QG           23 LYS  HB-         6.00   #   1672:0    Preassigned
  23 LYS  HA           23 LYS  HD-         6.00   #   1673:0    Preassigned
  58 ARG  QD           18 LYS  HB-         5.00   #   1675:0    Preassigned
  51 VAL  HN           51 VAL  MGY         6.00   #   1677:0    Preassigned
  51 VAL  HN           50 CYS  HA          6.00   #   1678:0    Preassigned
  56 PHE  HN           55 GLY  HA+         6.00   #   1685:0    Preassigned
  56 PHE  HN           55 GLY  HA-         6.00   #   1686:0    Preassigned
  56 PHE  HN           56 PHE  HB-         6.00   #   1688:0    Preassigned
  70 CYS  HB+          67 ALA  HA          6.00   #   1691:0    Preassigned
  71 GLU  HA           71 GLU  HG-         6.00   #   1692:0    Preassigned
  71 GLU  HB+          71 GLU  HG-         5.00   #   1694:0    Preassigned
  60 LYS  HG+          60 LYS  HB-         5.00   #   1695:0    Preassigned
  71 GLU  HG-          71 GLU  HA          6.00   #   1696:0    Preassigned
  29 VAL  MGY          29 VAL  HB          4.00   #   1698:0    Preassigned
  78 ILE  MD1          78 ILE  MG2         4.00   #   1699:0    Preassigned
  78 ILE  MG2          78 ILE  MD1         4.00   #   1700:0    Preassigned
  53 GLU  HG-          53 GLU  HA          5.00   #   1701:0    Preassigned
   0 AMB  0-2:1702     59 ASN  HN          6.00   #   1702:0    Single Ambig
   0 AMB  0-2:1703      0 AMB  0-1:1703    6.00   #   1703:0    Double Ambig
   0 AMB  0-2:1704      0 AMB  0-1:1704    3.00   #   1704:0    Double Ambig
   0 AMB  0-2:1705      0 AMB  0-1:1705    3.00   #   1705:0    Double Ambig
  71 GLU  HB-          71 GLU  HG+         4.00   #   1706:0    Preassigned
  11 LYS  HN           51 VAL  MGX         6.00   #   1710:0    Preassigned
  11 LYS  HN           11 LYS  QG          6.00   #   1712:0    Preassigned
  59 ASN  HN           65 VAL  MGX         6.00   #   1713:0    Preassigned
  57 TYR  HN           57 TYR  HB-         6.00   #   1718:0    Preassigned
  65 VAL  HN            0 AMB  0-1:1719    6.00   #   1719:0    Single Ambig
   0 AMB  0-2:1724      0 AMB  0-1:1724    6.00   #   1724:0    Double Ambig
  66 SER  HN           65 VAL  HB          6.00   #   1725:0    Preassigned
  63 LYS  HN           63 LYS  QG          6.00   #   1726:0    Preassigned
   0 AMB  0-2:1727      0 AMB  0-1:1727    6.00   #   1727:0    Double Ambig
   4 MET  HG+           4 MET  HB+         5.00   #   1731:0    Preassigned
  68 GLU  HA           67 ALA  MB          6.00   #   1733:0    Preassigned
  74 ASN  HA           26 TYR  HE          6.00   #   1738:0    Preassigned
   0 AMB  0-2:1739      0 AMB  0-1:1739    6.00   #   1739:0    Double Ambig
   4 MET  HG+           4 MET  HA          6.00   #   1740:0    Preassigned
  63 LYS  HA           61 ASP  HB+         6.00   #   1744:0    Preassigned
  72 LEU  MDY          71 GLU  HG-         6.00   #   1745:0    Preassigned
   0 AMB  0-2:1746     26 TYR  HD          6.00   #   1746:0    Single Ambig
  21 ASP  HB-           0 AMB  0-1:1748    6.00   #   1748:0    Single Ambig
   0 AMB  0-2:1749      0 AMB  0-1:1749    5.00   #   1749:0    Double Ambig
  41 CYS  HB-          23 LYS  HD-         6.00   #   1754:0    Preassigned
   0 AMB  0-2:1756     11 LYS  QG          6.00   #   1756:0    Single Ambig
  71 GLU  HG-          71 GLU  HB+         5.00   #   1757:0    Preassigned
  57 TYR  HA           57 TYR  HB-         5.00   #   1758:0    Preassigned
   0 AMB  0-2:1759      0 AMB  0-1:1759    3.00   #   1759:0    Double Ambig
AMBIG 10-1:5    = HN 12 HN 6 HN 49 
AMBIG 10-1:88   = HB+ 9 HB- 6 
AMBIG 10-1:104  = HB- 10 QD 11 
AMBIG 10-1:117  = HA 46 HA 15 
AMBIG 10-1:160  = QD 22 HG- 58 
AMBIG 10-1:223  = HB 29 HB+ 31 HB+ 30 
AMBIG 10-1:239  = HN 27 HN 35 HN 26 HN 36 
AMBIG 10-1:246  = HA 32 HA 30 HA 31 
AMBIG 10-1:250  = HB+ 32 HB+ 30 HB+ 31 HB+ 35 
AMBIG 10-1:251  = HB- 32 HB- 30 HB- 31 HB- 35 
AMBIG 10-1:256  = HA 31 HA 32 HA 30 HA 35 
AMBIG 10-1:260  = HB+ 30 QB 23 HB+ 32 HB+ 35 HB+ 31 
AMBIG 10-1:261  = HB- 30 HB- 32 HB- 35 HB- 31 
AMBIG 10-1:267  = HA 34 HA 33 
AMBIG 10-1:270  = HB+ 34 HB+ 33 
AMBIG 10-1:313  = QG 43 QG 45 MDX 42 
AMBIG 10-1:319  = HB+ 44 HB 45 
AMBIG 10-1:322  = QG 45 QG 43 
AMBIG 10-1:334  = HA 48 HA 49 
AMBIG 10-1:351  = HB 51 HB- 50 
AMBIG 10-1:376  = QG 11 HB- 9 
AMBIG 10-1:428  = HB- 56 HB+ 57 
AMBIG 10-1:437  = HB+ 21 HB- 21 
AMBIG 10-1:438  = HB+ 57 HB- 52 
AMBIG 10-1:490  = HG- 63 QG 60 
AMBIG 10-1:497  = HB+ 9 HB- 62 HB- 52 HB- 56 
AMBIG 10-1:506  = HN 64 HN 66 HN 58 
AMBIG 10-1:509  = HB+ 56 HB- 59 
AMBIG 10-1:510  = HB- 56 HB 65 HB+ 57 
AMBIG 10-1:511  = HB3 64 HB- 57 
AMBIG 10-1:596  = HB+ 69 HB- 59 
AMBIG 10-1:606  = HN 73 HN 69 HN 74 
AMBIG 10-1:630  = HB3 73 HB- 70 HB+ 74 
AMBIG 10-1:631  = HB2 73 HB- 69 HB- 26 
AMBIG 10-1:653  = ME 75 HB- 71 HB+ 75 
AMBIG 10-1:712  = HB- 76 HB- 74 
AMBIG 10-1:770  = HA 83 HA 80 HA 82 
AMBIG 10-1:890  = HN 29 HN 74 
AMBIG 10-1:1230 = HA 14 HA 15 
AMBIG 10-1:1415 = HA 58 HA 61 HA 64 
AMBIG 10-1:1579 = HB+ 25 HB+ 30 
AMBIG 10-1:1604 = HB- 34 HB- 33 
AMBIG 10-1:1622 = HB+ 30 HB+ 25 HB 29 HB+ 32 HB+ 31 
AMBIG 10-1:1667 = HA 35 HA 62 HB+ 59 HA 31 
AMBIG 10-3:1667 = HN 35 HN 63 
AMBIG 10-1:1683 = HA 34 HA 33 
AMBIG 10-1:1685 = HB- 34 HB- 33 
AMBIG 10-1:1686 = HB+ 34 HB+ 33 
AMBIG 10-1:1687 = HB+ 35 HB+ 32 HB+ 31 HB+ 58 HB+ 30 
AMBIG 10-3:1687 = HN 35 HN 63 
AMBIG 10-1:1697 = HA 15 HA 14 HA 46 
AMBIG 10-1:1704 = HA- 16 HB+ 15 
AMBIG 10-1:1707 = HB+ 49 QG 48 
AMBIG 10-1:1723 = HN 82 HN 81 
AMBIG 10-1:1735 = HN 42 HN 44 HN 41 
AMBIG 10-1:1797 = HB- 37 HB- 35 
AMBIG 10-1:1856 = HB+ 69 HB- 59 
AMBIG 10-1:1962 = HA 68 HA 78 
AMBIG 10-1:2161 = HA 26 HA 27 
AMBIG 10-1:2175 = HB- 57 HB+ 13 
AMBIG 10-3:2175 = HN 24 HN 14 
AMBIG 10-1:2177 = HB+ 57 HB3 24 
AMBIG 10-1:2186 = HN 15 HN 2 
AMBIG 0-2:9     = HA 52 HA 58 HA 64 
AMBIG 0-1:11    = HB+ 58 HB+ 23 
AMBIG 0-1:18    = HB+ 56 HB+ 69 
AMBIG 0-2:20    = HA 17 HA 48 HA 47 
AMBIG 0-1:20    = HB+ 49 QG 48 
AMBIG 0-2:22    = HA 47 HA 48 HA 56 HA 17 
AMBIG 0-1:22    = HB+ 13 HB- 57 
AMBIG 0-2:23    = HA 65 HA 10 
AMBIG 0-1:23    = HB- 56 HB- 52 HB- 6 HB+ 9 
AMBIG 0-2:29    = HA 17 HA 49 HA 48 
AMBIG 0-1:29    = HB- 49 HB+ 48 
AMBIG 0-2:57    = HA 38 HA 51 HA 11 
AMBIG 0-1:57    = HB+ 38 HB 51 HB+ 21 HB- 50 
AMBIG 0-2:60    = HA 51 HA 69 
AMBIG 0-1:60    = HB- 18 HG 72 
AMBIG 0-2:86    = HA 27 HA 76 HA 14 
AMBIG 0-1:86    = QB 27 HB+ 76 HB- 21 HB2 24 
AMBIG 0-2:93    = HA 63 HA 57 HA 27 
AMBIG 0-1:93    = QD 63 HD- 23 
AMBIG 0-2:115   = HA+ 16 HA 80 HA 75 HA 37 
AMBIG 0-1:115   = HB- 19 HB- 80 HB- 75 HG+ 40 
AMBIG 0-1:127   = HB- 49 HB- 13 
AMBIG 0-2:135   = HA 62 HA 5 HA 22 HA+ 7 HA 35 
AMBIG 0-1:135   = HB- 58 HB- 5 QB 22 HB+ 8 HB+ 10 HB- 36 
AMBIG 0-2:136   = HA 14 HA 15 HA 13 
AMBIG 0-1:136   = HB 51 HB- 46 
AMBIG 0-2:140   = HB+ 59 HA 35 HA 70 HA 5 HA 22 
AMBIG 0-1:140   = HB- 69 HB- 38 HB- 12 
AMBIG 0-2:145   = HA 22 HB+ 59 HA 62 HA 40 
AMBIG 0-1:145   = QG 22 QD 60 QD 18 HB- 42 
AMBIG 0-2:150   = HA 41 HA 46 HA 21 
AMBIG 0-1:150   = HB- 41 HB+ 46 
AMBIG 0-2:152   = HA 30 HA 32 HA 31 
AMBIG 0-1:152   = QG 30 QG 32 QG 31 
AMBIG 0-2:153   = HA 31 HA 32 HA 35 HA 30 
AMBIG 0-1:153   = HB- 31 HB- 32 HB- 35 HB- 30 
AMBIG 0-2:154   = HA 62 HA 31 HA 32 HA 30 HA 35 HA 82 
AMBIG 0-1:154   = HB+ 58 HB+ 31 HB+ 32 HB+ 30 HB+ 36 HB 29 
AMBIG 0-2:161   = HA 4 HA 66 
AMBIG 0-1:161   = HB- 5 QB 22 HB+ 10 
AMBIG 0-2:170   = HA 72 HA 44 
AMBIG 0-1:170   = HG 72 HB- 44 
AMBIG 0-2:171   = HA 44 HA 72 HA 25 
AMBIG 0-1:171   = HG+ 44 HB- 72 HD- 23 
AMBIG 0-2:178   = HA 25 HB 82 
AMBIG 0-1:178   = QG 25 MG2 82 
AMBIG 0-2:179   = HA 25 HA 19 HA 72 HA 18 HB 82 
AMBIG 0-1:179   = QB 25 HB+ 19 ME 75 HB+ 30 HB+ 58 HB+ 23 HB- 23 HB 29 
AMBIG 0-2:202   = HA 68 HA 54 
AMBIG 0-1:202   = HB+ 68 HB+ 54 
AMBIG 0-2:203   = HA 43 HA 68 HA 54 HA 78 
AMBIG 0-1:203   = HB- 19 HB- 68 HB- 54 HB- 30 
AMBIG 0-2:224   = QB 66 HB 3 
AMBIG 0-1:224   = HB+ 68 ME 4 
AMBIG 0-1:241   = HB 39 HB+ 36 HB- 40 
AMBIG 0-1:257   = HB 39 HB+ 36 HB- 40 
AMBIG 0-2:305   = HB- 20 HB+ 12 
AMBIG 0-1:305   = HB- 18 HB+ 11 
AMBIG 0-2:311   = HB- 59 HB+ 69 
AMBIG 0-1:311   = HB- 60 HG 72 
AMBIG 0-2:315   = HB3 79 HB- 59 
AMBIG 0-1:315   = QG 83 QD 60 
AMBIG 0-2:316   = HB+ 69 HB- 59 HB+ 77 
AMBIG 0-1:316   = MGX 65 HG1- 78 
AMBIG 0-2:317   = HB+ 69 HB+ 77 HB- 59 
AMBIG 0-1:317   = MGY 65 MGX 29 
AMBIG 0-2:318   = HB- 59 HB+ 69 
AMBIG 0-1:318   = HB+ 60 HB+ 72 HG+ 58 
AMBIG 0-2:327   = HB+ 61 HB- 59 HB+ 69 
AMBIG 0-1:327   = QD 63 HB- 72 
AMBIG 0-2:328   = HB+ 61 HB+ 77 HB- 77 
AMBIG 0-1:328   = HG- 60 HG1+ 78 
AMBIG 0-2:333   = HB+ 74 HB3 73 
AMBIG 0-2:343   = HB 51 HB+ 21 HB+ 38 
AMBIG 0-1:343   = QD 18 QG 22 HB- 42 
AMBIG 0-2:354   = HB- 69 HB2 73 HB- 26 
AMBIG 0-1:354   = MGX 65 HG1- 78 
AMBIG 0-2:357   = HB- 69 HB- 33 HB- 26 HB+ 38 HB- 38 
AMBIG 0-1:357   = MGY 65 MGX 29 MGY 39 
AMBIG 0-2:381   = HB+ 9 HB- 52 HB- 74 
AMBIG 0-1:381   = HB2 64 HB- 77 
AMBIG 0-2:405   = QG 75 HG+ 68 HB+ 49 
AMBIG 0-1:405   = HB- 75 HB- 68 HB- 19 
AMBIG 0-2:411   = QG 36 QG 48 HG- 71 HB3 64 HB+ 49 
AMBIG 0-1:411   = HB+ 36 HB- 48 HB- 71 HB- 40 HG+ 53 HG+ 10 
AMBIG 0-2:413   = QG 30 QG 32 QG 31 QG 35 
AMBIG 0-1:413   = HA 30 HA 32 HA 31 
AMBIG 0-2:418   = QG 19 QG 30 QG 32 QG 35 QG 31 
AMBIG 0-1:418   = HB+ 19 HB+ 30 HB+ 32 HB 29 QB 25 
AMBIG 0-2:419   = QG 19 QG 30 QG 32 QG 31 QG 54 QG 35 HG- 68 
AMBIG 0-1:419   = HB- 19 HB- 30 HB- 32 HB- 31 HB- 54 HB- 35 HB- 68 
AMBIG 0-2:431   = HB- 49 HB+ 40 HB- 13 
AMBIG 0-1:431   = HA+ 16 HA 40 
AMBIG 0-2:432   = HG- 4 HB+ 40 HB+ 37 QG 5 
AMBIG 0-1:432   = HB- 4 HG- 40 
AMBIG 0-2:438   = HB+ 40 HB+ 37 
AMBIG 0-1:438   = HG+ 40 HB- 35 
AMBIG 0-2:448   = HB- 57 QG 75 HG+ 68 HB3 64 
AMBIG 0-1:448   = HB- 23 HB+ 75 HB+ 68 HG- 10 
AMBIG 0-2:455   = HB+ 36 HB- 48 HB- 40 HG+ 53 HG+ 10 HB+ 35 
AMBIG 0-1:455   = QG 36 QG 48 HB3 64 HB+ 49 
AMBIG 0-2:458   = HB 39 HB+ 36 HB+ 35 HB- 40 
AMBIG 0-2:459   = HB 39 HB+ 36 HB+ 35 HB- 40 
AMBIG 0-2:463   = HB+ 31 HB+ 32 HB+ 30 HB 29 
AMBIG 0-1:463   = HA 31 HA 32 HA 30 HA 82 
AMBIG 0-2:464   = HB+ 58 HG+ 53 HG- 53 HB- 71 HB+ 23 
AMBIG 0-1:464   = HD+ 23 HD- 23 HB+ 53 HB 78 HB- 11 
AMBIG 0-2:466   = QB 25 HB+ 19 HB+ 30 HB+ 58 HB+ 23 HB- 23 HB 29 
AMBIG 0-1:466   = HA 25 HA 19 HA 18 HB 82 
AMBIG 0-2:469   = HB+ 30 HB 29 HB+ 58 ME 4 HG+ 53 
AMBIG 0-1:469   = HB- 77 HB2 64 HB+ 50 
AMBIG 0-2:472   = HB+ 23 HB+ 58 
AMBIG 0-1:472   = QG 23 QD 58 
AMBIG 0-2:473   = HG+ 53 HG- 53 
AMBIG 0-2:476   = HB+ 19 HB+ 68 HB+ 54 
AMBIG 0-1:476   = HA 43 HA 68 HA 54 
AMBIG 0-2:484   = HG+ 40 HB- 35 HB- 80 HB- 32 
AMBIG 0-1:484   = HD+ 40 HD+ 80 HA- 28 
AMBIG 0-2:487   = HB- 19 HB- 68 HB 43 HB- 54 
AMBIG 0-1:487   = HA 43 HA 68 HA 54 
AMBIG 0-2:488   = HB- 32 HB- 30 HB- 31 HB- 68 HG+ 40 
AMBIG 0-1:488   = MGX 29 MDY 72 MDX 42 
AMBIG 0-2:490   = HB- 31 HB- 32 HB- 30 HB- 35 
AMBIG 0-1:490   = HA 31 HA 32 HA 30 
AMBIG 0-2:491   = HB- 19 HB- 30 HB 43 HB- 32 HB- 31 HB- 54 HB- 68 
AMBIG 0-1:491   = QG 19 QG 30 QG 32 QG 31 QG 54 HG- 68 
AMBIG 0-2:495   = HB- 75 HB- 68 
AMBIG 0-1:495   = QG 75 HG+ 68 
AMBIG 0-2:499   = HB- 35 HB- 30 HB- 36 HB- 31 HB- 19 
AMBIG 0-1:499   = HB- 38 HB- 26 HB- 33 
AMBIG 0-2:500   = HB- 36 HG+ 40 HB- 35 HB+ 10 HB- 19 
AMBIG 0-1:500   = QG 36 HB3 64 HB+ 49 
AMBIG 0-2:506   = HB+ 10 HB+ 8 
AMBIG 0-2:507   = HB- 58 HB- 5 QB 22 HB+ 8 HB+ 10 HB- 36 
AMBIG 0-1:507   = HA 62 HA 5 HA 22 HA+ 7 HA 35 
AMBIG 0-2:522   = HB+ 72 HB+ 44 
AMBIG 0-1:522   = HA 72 HA 44 
AMBIG 0-2:526   = HB+ 60 HB+ 72 HG+ 58 
AMBIG 0-1:526   = HB- 59 HB+ 69 
AMBIG 0-2:528   = HB+ 4 QG 37 
AMBIG 0-1:528   = HB- 12 HB- 34 HB- 38 
AMBIG 0-2:533   = HB+ 18 HB- 4 
AMBIG 0-1:533   = HB+ 58 ME 4 HB+ 23 
AMBIG 0-1:542   = HB- 59 HB+ 69 
AMBIG 0-2:545   = HG 72 HB- 44 
AMBIG 0-1:545   = HA 72 HA 44 
AMBIG 0-1:550   = MGY 45 MDY 42 
AMBIG 0-2:555   = HB- 83 HB- 60 
AMBIG 0-1:555   = HB3 79 HB- 59 
AMBIG 0-2:557   = HB- 83 HB- 18 HG- 58 HB- 60 
AMBIG 0-1:557   = QG 83 QD 18 QD 60 
AMBIG 0-2:565   = HD+ 23 HD- 23 HB+ 53 HB 78 HB- 11 
AMBIG 0-1:565   = HB+ 58 HG+ 53 HG- 53 HB- 71 HB+ 23 
AMBIG 0-2:570   = HB 78 HB- 11 HB+ 53 HB- 53 QD 63 
AMBIG 0-1:570   = HB- 77 HB+ 50 HB2 64 
AMBIG 0-2:572   = QD 11 HB- 11 HB+ 42 HG+ 44 HD+ 23 HD- 23 
AMBIG 0-1:572   = HB+ 12 HB- 41 
AMBIG 0-2:574   = QD 11 QD 63 QD 22 
AMBIG 0-1:574   = HB+ 13 HB- 61 HB- 57 
AMBIG 0-2:585   = HB 78 HB- 72 
AMBIG 0-1:585   = HB+ 74 HB2 79 HB3 73 
AMBIG 0-2:590   = QD 25 QG 83 
AMBIG 0-1:590   = QG 25 MG2 82 
AMBIG 0-2:594   = QD 18 QD 60 HB- 10 
AMBIG 0-1:594   = HG+ 58 HB+ 60 HB- 8 
AMBIG 0-2:595   = QG 83 QD 60 
AMBIG 0-1:595   = HB3 79 HB- 59 
AMBIG 0-2:597   = QG 83 QD 18 
AMBIG 0-1:597   = HB- 83 HG- 58 
AMBIG 0-2:600   = HB- 10 HG- 44 
AMBIG 0-1:600   = HB- 50 HB- 46 
AMBIG 0-2:624   = HG- 60 MB 2 
AMBIG 0-1:624   = QB 63 HB- 4 
AMBIG 0-2:640   = QG 25 MG2 82 
AMBIG 0-1:640   = HA 25 HB 82 
AMBIG 0-1:661   = HB+ 69 HB- 59 
AMBIG 0-2:670   = MDX 72 MGX 39 
AMBIG 0-1:670   = HB2 73 HB- 38 HB- 69 
AMBIG 0-1:677   = HB+ 69 HB- 59 
AMBIG 0-2:682   = MGY 65 MGX 29 MGY 29 
AMBIG 0-1:682   = HG- 68 QG 31 QG 30 QG 32 
AMBIG 0-2:762   = HA 63 HA 76 HA 15 HA 73 
AMBIG 0-1:762   = HN 63 HN 76 HN 17 
AMBIG 0-2:763   = HA 15 HA 57 
AMBIG 0-1:763   = HN 18 HN 59 
AMBIG 0-2:767   = HA 35 HA 62 HB+ 59 
AMBIG 0-1:767   = HN 36 HN 63 
AMBIG 0-2:795   = HB+ 74 HB3 73 HB- 70 
AMBIG 0-2:815   = HB 29 HB+ 58 HB+ 68 HB+ 23 
AMBIG 0-1:815   = HE 77 HD2- 59 
AMBIG 0-2:816   = HG+ 53 HG- 53 HB+ 30 ME 75 
AMBIG 0-1:816   = HD2- 9 HE 26 
AMBIG 0-2:822   = HB+ 53 HB 78 
AMBIG 0-1:822   = HE 56 HD 79 
AMBIG 0-2:827   = HG1+ 78 HG- 60 
AMBIG 0-1:827   = HN 76 HN 63 
AMBIG 0-2:922   = HN 31 HN 53 
AMBIG 0-1:922   = HB+ 30 HG+ 53 HG- 53 HB+ 31 
AMBIG 0-1:941   = HB3 73 HB+ 74 HB- 70 
AMBIG 0-1:957   = HB- 18 HB- 60 
AMBIG 0-2:960   = HA 11 HA 38 HA 69 HA 36 
AMBIG 0-1:960   = QD 11 HB+ 42 HB- 72 HD- 23 
AMBIG 0-2:963   = HA 17 HA 52 
AMBIG 0-2:966   = HA 26 HA 74 
AMBIG 0-1:970   = HB+ 37 HB+ 40 
AMBIG 0-2:971   = HD- 40 HD- 37 
AMBIG 0-1:971   = HB+ 37 HB+ 40 
AMBIG 0-2:976   = HD+ 80 HA- 28 
AMBIG 0-2:980   = HA 71 HA 72 
AMBIG 0-1:980   = HB- 74 HB- 76 
AMBIG 0-2:985   = HB2 73 HB+ 38 HB- 38 
AMBIG 0-1:985   = MDX 72 MGX 39 
AMBIG 0-2:1003  = QD 63 HB 78 HB+ 42 
AMBIG 0-1:1003  = MGY 65 MGX 29 MGY 39 
AMBIG 0-2:1111  = HB- 59 HB+ 61 HB+ 77 HB- 77 
AMBIG 0-1:1111  = HN 63 HN 76 
AMBIG 0-2:1112  = HB+ 76 HB- 34 HB- 38 HB- 33 
AMBIG 0-1:1112  = HN 76 HN 36 
AMBIG 0-2:1114  = HB- 62 HB- 76 HB- 74 
AMBIG 0-1:1114  = HN 63 HN 76 
AMBIG 0-2:1115  = HB+ 13 HB- 61 
AMBIG 0-1:1115  = HN 17 HN 63 
AMBIG 0-2:1117  = HB- 52 HB- 6 HB- 56 
AMBIG 0-1:1117  = HN 53 HN 8 
AMBIG 0-2:1121  = HA 33 HA 34 
AMBIG 0-2:1126  = HB- 30 HB- 75 
AMBIG 0-2:1127  = HB+ 30 QB 25 HB 29 HB+ 23 
AMBIG 0-2:1132  = HB+ 57 HB+ 9 HB- 76 HB- 56 
AMBIG 0-1:1132  = HD2- 59 HN 10 HE 77 
AMBIG 0-2:1149  = HA 14 HA 13 
AMBIG 0-2:1183  = HA 57 HA 14 HA 21 HA 73 
AMBIG 0-1:1183  = QG 22 QD 18 QD 60 
AMBIG 0-2:1197  = HA 21 HA 15 HA 14 HA 57 
AMBIG 0-1:1197  = HB+ 18 HG+ 58 
AMBIG 0-2:1206  = HA 71 HA 72 
AMBIG 0-1:1206  = HB+ 74 HB3 73 HB- 70 
AMBIG 0-1:1219  = HB+ 9 HB- 52 
AMBIG 0-2:1220  = HB+ 74 HB- 70 HB3 73 
AMBIG 0-1:1220  = HG1- 78 MGX 65 
AMBIG 0-1:1223  = MGX 45 MDY 42 QG 43 
AMBIG 0-2:1235  = HB+ 56 HB+ 69 
AMBIG 0-2:1237  = QD 44 HB+ 26 
AMBIG 0-1:1237  = HA 44 HA 71 
AMBIG 0-2:1240  = HB+ 74 HB+ 34 HB+ 33 HB3 73 
AMBIG 0-1:1240  = HA 74 HA 34 HA 33 HA 26 HA 69 
AMBIG 0-2:1242  = HB- 26 HB- 69 HB- 34 HB- 33 HB- 12 HB2 73 HB+ 38 
AMBIG 0-1:1242  = HA 26 HA 69 HA 34 HA 33 HA 12 HA 36 
AMBIG 0-2:1243  = QB 27 HB+ 76 HB- 21 HB2 24 
AMBIG 0-1:1243  = HA 27 HA 76 HA 14 
AMBIG 0-2:1245  = HB+ 21 HB 51 
AMBIG 0-2:1246  = HB+ 74 HB3 73 HB- 70 
AMBIG 0-1:1246  = HA 71 HA 72 
AMBIG 0-2:1248  = HB2 79 HB- 70 
AMBIG 0-1:1248  = HA- 81 QB 66 
AMBIG 0-2:1262  = HB- 49 HB- 13 
AMBIG 0-1:1262  = HA- 16 HB+ 15 
AMBIG 0-2:1266  = HB+ 53 HB- 53 QD 11 
AMBIG 0-2:1280  = QG 22 QG 83 QD 18 HB- 10 
AMBIG 0-1:1280  = HA 22 HA 83 HA 62 HA+ 7 HA 82 
AMBIG 0-2:1282  = HB- 72 HD+ 23 HD- 23 
AMBIG 0-1:1282  = HA 72 HA 25 
AMBIG 0-2:1287  = HB+ 10 HB+ 8 
AMBIG 0-2:1292  = HB- 42 QG 23 
AMBIG 0-2:1296  = HB- 61 HG+ 71 
AMBIG 0-1:1296  = HG- 60 HG1+ 78 MB 67 
AMBIG 0-1:1301  = HB+ 10 HB+ 8 
AMBIG 0-2:1306  = HB2 64 HB+ 61 
AMBIG 0-1:1306  = HB+ 10 HB+ 8 HB- 58 
AMBIG 0-2:1312  = HB- 57 HG+ 71 
AMBIG 0-1:1312  = HB+ 23 HB- 71 
AMBIG 0-2:1313  = HB- 6 HB+ 57 HB+ 9 HB- 52 HB- 76 
AMBIG 0-1:1313  = HG- 10 HB- 23 HB+ 75 
AMBIG 0-2:1314  = QG 11 QG 25 
AMBIG 0-1:1314  = HG+ 53 HG- 53 HB+ 23 
AMBIG 0-2:1317  = HB+ 58 HG+ 53 HG- 53 
AMBIG 0-1:1317  = HB- 18 HB+ 11 
AMBIG 0-2:1325  = HB- 18 HB+ 11 HG 72 
AMBIG 0-1:1325  = HB+ 58 HG+ 53 HG- 53 HB- 71 
AMBIG 0-2:1330  = MGY 65 MDY 72 MGX 29 MGY 29 
AMBIG 0-1:1330  = HG- 60 HG1+ 78 MB 67 
AMBIG 0-2:1335  = MGX 29 MGY 65 MDY 72 
AMBIG 0-1:1335  = HB- 32 HB- 68 HB- 30 HB- 31 
AMBIG 0-2:1363  = QG 11 MG2 82 
AMBIG 0-1:1363  = HA 53 HA- 81 
AMBIG 0-2:1366  = HB+ 18 HG+ 58 HG- 40 
AMBIG 0-2:1418  = HA 58 HA 17 
AMBIG 0-1:1418  = HN 59 HN 18 
AMBIG 0-2:1446  = HB- 56 HB+ 57 HB- 52 
AMBIG 0-2:1457  = HG+ 53 HG- 53 
AMBIG 0-2:1480  = HA 58 HA 56 
AMBIG 0-2:1481  = HB+ 69 HB+ 56 HB- 59 
AMBIG 0-1:1481  = HN 66 HN 64 
AMBIG 0-2:1482  = HB+ 58 HB+ 23 HB- 48 HB+ 19 
AMBIG 0-1:1482  = HN 59 HN 18 
AMBIG 0-2:1483  = HB- 58 QB 22 
AMBIG 0-1:1483  = HN 59 HN 18 
AMBIG 0-2:1484  = HB+ 18 HG+ 58 HB+ 60 
AMBIG 0-1:1484  = HN 18 HN 59 
AMBIG 0-2:1487  = QD 63 HD+ 23 HD- 23 
AMBIG 0-2:1494  = HA 54 HA+ 55 HA 68 
AMBIG 0-1:1494  = HN 55 HN 68 
AMBIG 0-2:1501  = HA 32 HA+ 7 HA 30 HA 31 
AMBIG 0-1:1501  = HN 33 HN 7 
AMBIG 0-2:1504  = HA+ 7 HA 30 HA 31 
AMBIG 0-1:1504  = HN 8 HN 31 HN 34 
AMBIG 0-2:1505  = HA 15 HA 14 HA 13 
AMBIG 0-2:1542  = HA 52 HA 58 HA 61 
AMBIG 0-2:1574  = HB- 38 HB- 34 
AMBIG 0-2:1575  = HB+ 21 HB 51 
AMBIG 0-2:1595  = MGY 65 MGX 29 MGY 29 
AMBIG 0-1:1595  = HB+ 69 HB+ 77 HB- 59 HB3 79 
AMBIG 0-2:1596  = MGY 65 MDY 72 MGX 29 MGY 29 MDX 42 
AMBIG 0-1:1596  = HB- 69 HB2 73 HB- 33 HB- 26 HB- 38 
AMBIG 0-2:1597  = HG- 40 HB- 4 
AMBIG 0-1:1597  = HA 40 HA 2 
AMBIG 0-2:1598  = HG- 53 HG- 10 
AMBIG 0-2:1622  = HE 56 HN 10 HD 79 
AMBIG 0-1:1622  = HA 9 HD+ 85 
AMBIG 0-2:1640  = HE 26 HD2- 9 HE 79 
AMBIG 0-1:1640  = HB- 74 HB- 76 HB- 62 
AMBIG 0-1:1643  = HB+ 74 HB3 73 HB- 70 
AMBIG 0-2:1649  = HE 56 HD 79 
AMBIG 0-1:1649  = HB+ 53 HB 78 
AMBIG 0-2:1656  = HA 52 HA 64 HA 58 
AMBIG 0-1:1656  = HB- 52 HB- 56 
AMBIG 0-2:1657  = HA+ 16 HA 75 
AMBIG 0-1:1657  = HN 17 HN 76 
AMBIG 0-2:1658  = HA 34 HA 33 HA 26 HA 36 
AMBIG 0-1:1658  = HB+ 34 HB+ 33 
AMBIG 0-2:1669  = HB+ 37 HB+ 80 HB+ 40 
AMBIG 0-1:1669  = HA 37 HA 80 
AMBIG 0-2:1671  = HN 58 HN 18 
AMBIG 0-1:1671  = HG+ 58 HB+ 18 
AMBIG 0-2:1702  = HB+ 57 HB3 24 
AMBIG 0-2:1703  = HB- 57 HB+ 13 
AMBIG 0-1:1703  = HN 59 HN 18 
AMBIG 0-2:1704  = HB+ 19 HB+ 30 HB+ 32 HB+ 31 HB 29 QB 25 
AMBIG 0-1:1704  = QG 19 QG 30 QG 32 QG 31 
AMBIG 0-2:1705  = HB+ 75 HB+ 68 ME 75 HG- 53 HG- 10 
AMBIG 0-1:1705  = QG 75 HG+ 68 HB3 64 
AMBIG 0-1:1719  = HB- 56 HB 65 HB+ 57 
AMBIG 0-2:1724  = HN 66 HN 58 HN 59 
AMBIG 0-1:1724  = HB 65 HB+ 57 HB- 52 
AMBIG 0-2:1727  = HN 76 HN 63 
AMBIG 0-1:1727  = HG1+ 78 HG- 60 
AMBIG 0-2:1739  = HB+ 35 HG+ 10 
AMBIG 0-1:1739  = HA 35 HA+ 7 HA 62 
AMBIG 0-2:1746  = QB 27 HB+ 76 HB2 24 
AMBIG 0-1:1748  = HB+ 18 HG+ 58 
AMBIG 0-2:1749  = HB+ 21 HB 51 
AMBIG 0-1:1749  = HB+ 18 HG+ 58 
AMBIG 0-2:1756  = HB+ 50 HB2 64 
AMBIG 0-2:1759  = HA 38 HA 69 
AMBIG 0-1:1759  = HB- 38 HB- 69 HB2 73 
                                              

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    LYS   1          1H        LYS   1  -3.431  -0.997  -6.044
    2   2H    LYS   1          2H        LYS   1  -4.630  -0.684  -7.144
    3   3H    LYS   1          3H        LYS   1  -3.184   0.115  -7.225
    4    HA   LYS   1           HA       LYS   1  -4.802   1.554  -6.339
    5   1HB   LYS   1          1HB       LYS   1  -5.786   1.036  -4.114
    6   2HB   LYS   1          2HB       LYS   1  -6.409   0.057  -5.447
    7   1HG   LYS   1          1HG       LYS   1  -5.052  -1.851  -4.803
    8   2HG   LYS   1          2HG       LYS   1  -4.237  -0.936  -3.539
    9   1HD   LYS   1          1HD       LYS   1  -7.214  -1.634  -3.645
   10   2HD   LYS   1          2HD       LYS   1  -5.992  -2.443  -2.660
   11   1HE   LYS   1          1HE       LYS   1  -6.992   0.424  -2.339
   12   2HE   LYS   1          2HE       LYS   1  -7.232  -0.934  -1.245
   13   1HZ   LYS   1          1HZ       LYS   1  -4.863  -0.978  -0.874
   14   2HZ   LYS   1          2HZ       LYS   1  -4.655   0.324  -1.866
   15   3HZ   LYS   1          3HZ       LYS   1  -5.516   0.482  -0.470
   16    H    ALA   2           H        ALA   2  -4.040   3.210  -5.092
   17    HA   ALA   2           HA       ALA   2  -2.337   4.500  -4.436
   18   1HB   ALA   2          1HB       ALA   2  -3.284   3.720  -2.283
   19   2HB   ALA   2          2HB       ALA   2  -2.018   2.470  -2.207
   20   3HB   ALA   2          3HB       ALA   2  -1.585   4.199  -2.185
   21    H    THR   3           H        THR   3  -1.588   2.652  -6.459
   22    HA   THR   3           HA       THR   3   1.385   2.538  -6.097
   23    HB   THR   3           HB       THR   3   1.225   1.074  -8.123
   24    HG1  THR   3           HG1      THR   3  -0.646   1.845  -8.930
   25   1HG2  THR   3          1HG2      THR   3   1.255  -0.001  -5.885
   26   2HG2  THR   3          2HG2      THR   3  -0.518   0.018  -5.860
   27   3HG2  THR   3          3HG2      THR   3   0.334  -0.937  -7.081
   28    H    MET   4           H        MET   4   0.829   4.996  -6.195
   29    HA   MET   4           HA       MET   4   0.612   6.956  -7.266
   30   1HB   MET   4          1HB       MET   4   2.393   5.821  -8.804
   31   2HB   MET   4          2HB       MET   4   1.074   5.704  -9.976
   32   1HG   MET   4          1HG       MET   4   2.189   7.742 -10.464
   33   2HG   MET   4          2HG       MET   4   0.710   8.209  -9.633
   34   1HE   MET   4          1HE       MET   4   4.293   6.949  -8.355
   35   2HE   MET   4          2HE       MET   4   4.584   8.154  -9.631
   36   3HE   MET   4          3HE       MET   4   4.998   8.525  -7.944
   37    H    GLN   5           H        GLN   5  -1.582   5.188  -6.741
   38    HA   GLN   5           HA       GLN   5  -3.736   6.247  -8.474
   39   1HB   GLN   5          1HB       GLN   5  -3.290   3.286  -7.837
   40   2HB   GLN   5          2HB       GLN   5  -4.741   3.972  -8.583
   41   1HG   GLN   5          1HG       GLN   5  -3.381   4.742 -10.511
   42   2HG   GLN   5          2HG       GLN   5  -1.959   3.952  -9.825
   43   1HE2  GLN   5          2HE2      GLN   5  -2.457   1.454  -9.128
   44   2HE2  GLN   5          1HE2      GLN   5  -3.340   0.602 -10.378
   45    H    CYS   6           H        CYS   6  -3.370   7.414  -6.184
   46    HA   CYS   6           HA       CYS   6  -4.475   5.935  -3.881
   47   1HB   CYS   6          1HB       CYS   6  -3.489   8.776  -4.241
   48   2HB   CYS   6          2HB       CYS   6  -4.174   8.172  -2.747
   49    H    GLY   7           H        GLY   7  -6.094   7.923  -2.641
   50   1HA   GLY   7          1HA       GLY   7  -8.563   7.375  -3.989
   51   2HA   GLY   7          2HA       GLY   7  -8.317   8.300  -2.507
   52    H    GLU   8           H        GLU   8  -7.396   8.751  -5.949
   53    HA   GLU   8           HA       GLU   8  -7.702  10.295  -7.487
   54   1HB   GLU   8          1HB       GLU   8 -10.274  10.493  -5.943
   55   2HB   GLU   8          2HB       GLU   8 -10.023  11.297  -7.513
   56   1HG   GLU   8          1HG       GLU   8  -9.545   9.101  -8.553
   57   2HG   GLU   8          2HG       GLU   8  -9.757   8.293  -6.992
   58    H    ASN   9           H        ASN   9  -8.988  12.010  -4.600
   59    HA   ASN   9           HA       ASN   9  -7.557  14.482  -5.416
   60   1HB   ASN   9          1HB       ASN   9  -8.477  15.423  -3.293
   61   2HB   ASN   9          2HB       ASN   9  -9.616  15.030  -4.576
   62   1HD2  ASN   9          2HD2      ASN   9  -8.162  13.154  -1.856
   63   2HD2  ASN   9          1HD2      ASN   9  -9.723  12.758  -1.120
   64    H    GLU  10           H        GLU  10  -5.671  13.176  -5.554
   65    HA   GLU  10           HA       GLU  10  -4.194  12.751  -2.995
   66   1HB   GLU  10          1HB       GLU  10  -3.025  10.986  -4.105
   67   2HB   GLU  10          2HB       GLU  10  -4.766  10.742  -4.321
   68   1HG   GLU  10          1HG       GLU  10  -4.401  11.957  -6.642
   69   2HG   GLU  10          2HG       GLU  10  -2.695  11.609  -6.372
   70    H    LYS  11           H        LYS  11  -1.712  12.780  -3.543
   71    HA   LYS  11           HA       LYS  11  -0.928  14.845  -5.493
   72   1HB   LYS  11          1HB       LYS  11  -1.428  16.095  -3.460
   73   2HB   LYS  11          2HB       LYS  11  -0.527  14.919  -2.476
   74   1HG   LYS  11          1HG       LYS  11   0.713  16.972  -2.678
   75   2HG   LYS  11          2HG       LYS  11   1.573  15.660  -3.463
   76   1HD   LYS  11          1HD       LYS  11   0.637  16.507  -5.698
   77   2HD   LYS  11          2HD       LYS  11  -0.114  17.830  -4.794
   78   1HE   LYS  11          1HE       LYS  11   1.943  18.676  -5.716
   79   2HE   LYS  11          2HE       LYS  11   2.212  18.473  -3.977
   80   1HZ   LYS  11          1HZ       LYS  11   3.272  16.335  -4.522
   81   2HZ   LYS  11          2HZ       LYS  11   3.073  16.654  -6.122
   82   3HZ   LYS  11          3HZ       LYS  11   4.037  17.625  -5.208
   83    H    TYR  12           H        TYR  12   1.170  14.427  -6.247
   84    HA   TYR  12           HA       TYR  12   2.444  11.895  -5.736
   85   1HB   TYR  12          1HB       TYR  12   2.857  12.983  -7.828
   86   2HB   TYR  12          2HB       TYR  12   3.304  14.495  -7.035
   87    HD1  TYR  12           HD1      TYR  12   4.408  10.963  -7.556
   88    HD2  TYR  12           HD2      TYR  12   5.527  14.903  -6.223
   89    HE1  TYR  12           HE1      TYR  12   6.709  10.161  -7.122
   90    HE2  TYR  12           HE2      TYR  12   7.799  14.085  -5.707
   91    HH   TYR  12           HH       TYR  12   9.064  12.173  -5.383
   92    H    ASP  13           H        ASP  13   4.009  11.371  -4.176
   93    HA   ASP  13           HA       ASP  13   5.424  13.578  -2.831
   94   1HB   ASP  13          1HB       ASP  13   3.495  13.191  -1.343
   95   2HB   ASP  13          2HB       ASP  13   3.860  11.456  -1.331
   96    H    SER  14           H        SER  14   7.488  13.077  -2.442
   97    HA   SER  14           HA       SER  14   8.589  10.559  -3.345
   98   1HB   SER  14          1HB       SER  14   9.917  12.847  -1.864
   99   2HB   SER  14          2HB       SER  14  10.712  11.586  -2.820
  100    HG   SER  14           HG       SER  14  10.359  13.639  -3.927
  101    H    CYS  15           H        CYS  15   6.753   9.912  -1.265
  102    HA   CYS  15           HA       CYS  15   8.477   8.547   0.536
  103   1HB   CYS  15          1HB       CYS  15   8.417  10.983   1.513
  104   2HB   CYS  15          2HB       CYS  15   6.846  10.519   2.110
  105    H    GLY  16           H        GLY  16   7.127   6.958  -0.583
  106   1HA   GLY  16          1HA       GLY  16   5.858   5.138  -0.031
  107   2HA   GLY  16          2HA       GLY  16   5.231   5.980   1.393
  108    H    SER  17           H        SER  17   3.541   4.412   0.005
  109    HA   SER  17           HA       SER  17   1.857   5.855  -1.866
  110   1HB   SER  17          1HB       SER  17   0.502   3.706  -1.332
  111   2HB   SER  17          2HB       SER  17   2.052   3.554  -2.173
  112    HG   SER  17           HG       SER  17   1.962   2.097  -0.435
  113    H    LYS  18           H        LYS  18   2.384   6.411   1.335
  114    HA   LYS  18           HA       LYS  18  -0.375   7.252   1.942
  115   1HB   LYS  18          1HB       LYS  18   1.072   5.181   3.666
  116   2HB   LYS  18          2HB       LYS  18  -0.451   5.999   4.041
  117   1HG   LYS  18          1HG       LYS  18  -1.472   4.929   2.008
  118   2HG   LYS  18          2HG       LYS  18   0.039   4.055   1.750
  119   1HD   LYS  18          1HD       LYS  18  -1.477   2.567   2.841
  120   2HD   LYS  18          2HD       LYS  18  -0.143   2.944   3.931
  121   1HE   LYS  18          1HE       LYS  18  -2.334   2.871   5.086
  122   2HE   LYS  18          2HE       LYS  18  -1.584   4.462   5.231
  123   1HZ   LYS  18          1HZ       LYS  18  -3.638   3.738   3.256
  124   2HZ   LYS  18          2HZ       LYS  18  -3.954   4.522   4.665
  125   3HZ   LYS  18          3HZ       LYS  18  -3.021   5.244   3.511
  126    H    GLU  19           H        GLU  19   2.964   6.855   3.121
  127    HA   GLU  19           HA       GLU  19   4.235   7.836   4.643
  128   1HB   GLU  19          1HB       GLU  19   3.569   9.742   2.853
  129   2HB   GLU  19          2HB       GLU  19   2.950  10.524   4.298
  130   1HG   GLU  19          1HG       GLU  19   5.771   9.488   3.818
  131   2HG   GLU  19          2HG       GLU  19   5.266  11.179   3.704
  132    H    CYS  20           H        CYS  20   0.804   8.066   5.296
  133    HA   CYS  20           HA       CYS  20  -0.449   8.587   7.051
  134   1HB   CYS  20          1HB       CYS  20   1.987   7.431   8.430
  135   2HB   CYS  20          2HB       CYS  20   0.569   7.916   9.350
  136    H    ASP  21           H        ASP  21   1.147  10.626   5.834
  137    HA   ASP  21           HA       ASP  21   2.376  12.383   7.701
  138   1HB   ASP  21          1HB       ASP  21   2.867  12.608   5.342
  139   2HB   ASP  21          2HB       ASP  21   1.166  12.808   4.930
  140    H    LYS  22           H        LYS  22  -0.731  12.989   5.986
  141    HA   LYS  22           HA       LYS  22  -1.872  14.186   8.476
  142   1HB   LYS  22          1HB       LYS  22  -2.868  14.184   5.603
  143   2HB   LYS  22          2HB       LYS  22  -3.697  14.902   7.003
  144   1HG   LYS  22          1HG       LYS  22  -1.792  16.396   7.423
  145   2HG   LYS  22          2HG       LYS  22  -0.938  15.707   6.026
  146   1HD   LYS  22          1HD       LYS  22  -2.714  16.477   4.510
  147   2HD   LYS  22          2HD       LYS  22  -3.670  17.065   5.878
  148   1HE   LYS  22          1HE       LYS  22  -2.491  18.910   4.738
  149   2HE   LYS  22          2HE       LYS  22  -1.973  18.751   6.423
  150   1HZ   LYS  22          1HZ       LYS  22  -0.524  17.629   4.131
  151   2HZ   LYS  22          2HZ       LYS  22  -0.171  19.069   4.849
  152   3HZ   LYS  22          3HZ       LYS  22  -0.012  17.659   5.696
  153    H    LYS  23           H        LYS  23  -1.477  11.704   9.142
  154    HA   LYS  23           HA       LYS  23  -3.585   9.873   8.290
  155   1HB   LYS  23          1HB       LYS  23  -1.493   9.066   9.115
  156   2HB   LYS  23          2HB       LYS  23  -1.684   9.885  10.665
  157   1HG   LYS  23          1HG       LYS  23  -3.802   7.937   9.742
  158   2HG   LYS  23          2HG       LYS  23  -2.255   7.295  10.309
  159   1HD   LYS  23          1HD       LYS  23  -2.468   8.330  12.464
  160   2HD   LYS  23          2HD       LYS  23  -3.848   9.292  11.949
  161   1HE   LYS  23          1HE       LYS  23  -5.149   7.156  11.558
  162   2HE   LYS  23          2HE       LYS  23  -3.771   6.247  12.214
  163   1HZ   LYS  23          1HZ       LYS  23  -5.342   8.294  13.608
  164   2HZ   LYS  23          2HZ       LYS  23  -5.480   6.678  13.838
  165   3HZ   LYS  23          3HZ       LYS  23  -4.080   7.438  14.272
  166    H    CYS  24           H        CYS  24  -5.691   9.810   9.072
  167    HA   CYS  24           HA       CYS  24  -6.759  11.910  10.651
  168   1HB   CYS  24          1HB       CYS  24  -8.193  10.640   9.256
  169   2HB   CYS  24          2HB       CYS  24  -7.793   9.124  10.090
  170    H    LYS  25           H        LYS  25  -5.365  12.161  12.335
  171    HA   LYS  25           HA       LYS  25  -4.465  10.344  14.163
  172   1HB   LYS  25          1HB       LYS  25  -3.880  12.417  15.516
  173   2HB   LYS  25          2HB       LYS  25  -3.259  12.240  13.881
  174   1HG   LYS  25          1HG       LYS  25  -3.917  14.532  14.375
  175   2HG   LYS  25          2HG       LYS  25  -4.812  13.892  13.006
  176   1HD   LYS  25          1HD       LYS  25  -6.779  13.474  14.550
  177   2HD   LYS  25          2HD       LYS  25  -5.805  14.088  15.891
  178   1HE   LYS  25          1HE       LYS  25  -7.321  15.819  15.125
  179   2HE   LYS  25          2HE       LYS  25  -5.656  16.307  14.779
  180   1HZ   LYS  25          1HZ       LYS  25  -7.538  15.124  12.851
  181   2HZ   LYS  25          2HZ       LYS  25  -7.135  16.720  12.947
  182   3HZ   LYS  25          3HZ       LYS  25  -5.998  15.612  12.515
  183    H    TYR  26           H        TYR  26  -6.933   9.357  14.429
  184    HA   TYR  26           HA       TYR  26  -7.168   9.786  17.324
  185   1HB   TYR  26          1HB       TYR  26  -9.499   9.764  17.462
  186   2HB   TYR  26          2HB       TYR  26  -9.067  11.053  16.354
  187    HD1  TYR  26           HD1      TYR  26 -10.237   7.470  16.468
  188    HD2  TYR  26           HD2      TYR  26 -10.327  11.234  14.370
  189    HE1  TYR  26           HE1      TYR  26 -11.976   6.585  14.940
  190    HE2  TYR  26           HE2      TYR  26 -12.176  10.378  12.949
  191    HH   TYR  26           HH       TYR  26 -13.429   8.549  12.347
  192    H    ASP  27           H        ASP  27  -7.451   8.018  18.495
  193    HA   ASP  27           HA       ASP  27  -6.868   5.524  17.041
  194   1HB   ASP  27          1HB       ASP  27  -5.475   6.038  18.941
  195   2HB   ASP  27          2HB       ASP  27  -6.886   6.020  20.011
  196    H    GLY  28           H        GLY  28  -8.993   5.047  16.041
  197   1HA   GLY  28          1HA       GLY  28 -10.619   3.397  16.089
  198   2HA   GLY  28          2HA       GLY  28 -10.454   3.269  17.845
  199    H    VAL  29           H        VAL  29 -11.036   5.677  18.778
  200    HA   VAL  29           HA       VAL  29 -13.694   6.414  17.674
  201    HB   VAL  29           HB       VAL  29 -14.007   4.944  19.595
  202   1HG1  VAL  29          1HG1      VAL  29 -11.965   5.563  20.908
  203   2HG1  VAL  29          2HG1      VAL  29 -12.725   7.130  21.274
  204   3HG1  VAL  29          3HG1      VAL  29 -13.463   5.630  21.853
  205   1HG2  VAL  29          1HG2      VAL  29 -15.667   6.664  19.018
  206   2HG2  VAL  29          2HG2      VAL  29 -15.607   6.382  20.767
  207   3HG2  VAL  29          3HG2      VAL  29 -14.849   7.830  20.078
  208    H    GLU  30           H        GLU  30 -13.852   8.467  17.270
  209    HA   GLU  30           HA       GLU  30 -11.976  10.347  17.123
  210   1HB   GLU  30          1HB       GLU  30 -13.760  12.033  17.102
  211   2HB   GLU  30          2HB       GLU  30 -14.126  10.594  16.132
  212   1HG   GLU  30          1HG       GLU  30 -15.565   9.734  18.010
  213   2HG   GLU  30          2HG       GLU  30 -15.272  11.250  18.882
  214    H    GLU  31           H        GLU  31 -13.698   9.716  20.157
  215    HA   GLU  31           HA       GLU  31 -12.862  11.958  21.642
  216   1HB   GLU  31          1HB       GLU  31 -13.092   9.082  22.647
  217   2HB   GLU  31          2HB       GLU  31 -13.129  10.551  23.622
  218   1HG   GLU  31          1HG       GLU  31 -15.233   9.713  21.565
  219   2HG   GLU  31          2HG       GLU  31 -15.389   9.691  23.319
  220    H    GLU  32           H        GLU  32 -11.065   8.963  20.849
  221    HA   GLU  32           HA       GLU  32  -8.753   9.784  22.490
  222   1HB   GLU  32          1HB       GLU  32  -9.112   7.420  20.601
  223   2HB   GLU  32          2HB       GLU  32  -7.789   7.670  21.752
  224   1HG   GLU  32          1HG       GLU  32 -10.722   7.189  22.431
  225   2HG   GLU  32          2HG       GLU  32  -9.378   6.072  22.667
  226    H    ASP  33           H        ASP  33  -9.152  11.817  20.901
  227    HA   ASP  33           HA       ASP  33  -7.604  11.670  18.415
  228   1HB   ASP  33          1HB       ASP  33  -9.576  13.217  18.869
  229   2HB   ASP  33          2HB       ASP  33  -8.507  14.157  19.911
  230    H    ASP  34           H        ASP  34  -5.985  10.526  20.009
  231    HA   ASP  34           HA       ASP  34  -4.302  12.461  21.550
  232   1HB   ASP  34          1HB       ASP  34  -5.269  10.663  22.841
  233   2HB   ASP  34          2HB       ASP  34  -4.642   9.443  21.723
  234    H    GLU  35           H        GLU  35  -3.816   9.499  19.553
  235    HA   GLU  35           HA       GLU  35  -1.030   9.760  19.580
  236   1HB   GLU  35          1HB       GLU  35  -1.017   8.112  17.743
  237   2HB   GLU  35          2HB       GLU  35  -2.003   7.635  19.129
  238   1HG   GLU  35          1HG       GLU  35  -4.068   8.161  17.914
  239   2HG   GLU  35          2HG       GLU  35  -3.151   8.842  16.564
  240    H    GLU  36           H        GLU  36   0.443  10.895  18.449
  241    HA   GLU  36           HA       GLU  36  -0.249  12.917  16.577
  242   1HB   GLU  36          1HB       GLU  36   2.427  11.455  16.789
  243   2HB   GLU  36          2HB       GLU  36   2.129  13.061  16.133
  244   1HG   GLU  36          1HG       GLU  36   2.817  13.753  18.173
  245   2HG   GLU  36          2HG       GLU  36   1.147  13.448  18.654
  246    HA   PRO  37           HA       PRO  37  -0.523  10.235  12.917
  247   1HB   PRO  37          1HB       PRO  37  -0.142  11.973  10.893
  248   2HB   PRO  37          2HB       PRO  37  -1.607  12.040  11.912
  249   1HG   PRO  37          1HG       PRO  37   0.907  13.714  12.196
  250   2HG   PRO  37          2HG       PRO  37  -0.784  14.293  12.137
  251   1HD   PRO  37          1HD       PRO  37   0.544  13.864  14.496
  252   2HD   PRO  37          2HD       PRO  37  -1.204  13.529  14.347
  253    H    ASN  38           H        ASN  38   0.992   9.895  10.855
  254    HA   ASN  38           HA       ASN  38   2.866   8.891  10.190
  255   1HB   ASN  38          1HB       ASN  38   3.440  11.222   9.774
  256   2HB   ASN  38          2HB       ASN  38   4.166  11.365  11.379
  257   1HD2  ASN  38          2HD2      ASN  38   4.396   9.441   8.288
  258   2HD2  ASN  38          1HD2      ASN  38   6.116   9.240   8.421
  259    H    VAL  39           H        VAL  39   3.969  10.183  13.331
  260    HA   VAL  39           HA       VAL  39   5.995   8.508  13.936
  261    HB   VAL  39           HB       VAL  39   3.930   9.658  15.841
  262   1HG1  VAL  39          1HG1      VAL  39   6.696   8.512  16.423
  263   2HG1  VAL  39          2HG1      VAL  39   5.723   9.468  17.560
  264   3HG1  VAL  39          3HG1      VAL  39   5.149   7.885  17.035
  265   1HG2  VAL  39          1HG2      VAL  39   6.666  10.636  14.929
  266   2HG2  VAL  39          2HG2      VAL  39   5.103  11.357  14.491
  267   3HG2  VAL  39          3HG2      VAL  39   5.650  11.401  16.167
  268    HA   PRO  40           HA       PRO  40   3.502   4.991  15.962
  269   1HB   PRO  40          1HB       PRO  40   0.819   4.663  15.487
  270   2HB   PRO  40          2HB       PRO  40   1.461   5.689  16.799
  271   1HG   PRO  40          1HG       PRO  40   0.601   6.598  14.025
  272   2HG   PRO  40          2HG       PRO  40   0.081   7.264  15.597
  273   1HD   PRO  40          1HD       PRO  40   2.059   8.427  14.246
  274   2HD   PRO  40          2HD       PRO  40   2.223   8.197  16.008
  275    H    CYS  41           H        CYS  41   2.755   6.080  12.700
  276    HA   CYS  41           HA       CYS  41   2.055   3.374  11.731
  277   1HB   CYS  41          1HB       CYS  41   0.553   5.036  11.039
  278   2HB   CYS  41          2HB       CYS  41   1.841   6.188  10.683
  279    H    LEU  42           H        LEU  42   4.375   5.980  11.005
  280    HA   LEU  42           HA       LEU  42   6.059   6.045   9.395
  281   1HB   LEU  42          1HB       LEU  42   6.895   4.134  11.595
  282   2HB   LEU  42          2HB       LEU  42   8.043   4.802  10.431
  283    HG   LEU  42           HG       LEU  42   6.305   6.568  12.184
  284   1HD1  LEU  42          1HD1      LEU  42   7.740   5.124  13.597
  285   2HD1  LEU  42          2HD1      LEU  42   9.165   5.619  12.657
  286   3HD1  LEU  42          3HD1      LEU  42   8.282   6.810  13.638
  287   1HD2  LEU  42          1HD2      LEU  42   8.865   7.107  10.611
  288   2HD2  LEU  42          2HD2      LEU  42   7.248   7.715  10.202
  289   3HD2  LEU  42          3HD2      LEU  42   8.044   8.262  11.679
  290    H    VAL  43           H        VAL  43   4.927   5.057   7.577
  291    HA   VAL  43           HA       VAL  43   5.349   2.274   6.940
  292    HB   VAL  43           HB       VAL  43   4.981   3.068   4.538
  293   1HG1  VAL  43          1HG1      VAL  43   3.263   1.991   5.900
  294   2HG1  VAL  43          2HG1      VAL  43   2.853   3.546   6.650
  295   3HG1  VAL  43          3HG1      VAL  43   2.557   3.286   4.919
  296   1HG2  VAL  43          1HG2      VAL  43   5.522   5.523   4.925
  297   2HG2  VAL  43          2HG2      VAL  43   3.961   5.201   4.165
  298   3HG2  VAL  43          3HG2      VAL  43   4.027   5.638   5.877
  299    H    ARG  44           H        ARG  44   7.424   1.612   7.282
  300    HA   ARG  44           HA       ARG  44   9.812   2.832   6.681
  301   1HB   ARG  44          1HB       ARG  44   9.105  -0.129   6.435
  302   2HB   ARG  44          2HB       ARG  44  10.737   0.525   6.354
  303   1HG   ARG  44          1HG       ARG  44  10.898   0.227   8.523
  304   2HG   ARG  44          2HG       ARG  44   9.865   1.639   8.741
  305   1HD   ARG  44          1HD       ARG  44   8.812  -1.216   8.442
  306   2HD   ARG  44          2HD       ARG  44   9.251  -0.506  10.003
  307    HE   ARG  44           HE       ARG  44   7.583   1.391   9.183
  308   1HH1  ARG  44          1HH1      ARG  44   7.146  -2.130   9.281
  309   2HH1  ARG  44          2HH1      ARG  44   5.437  -2.013   9.602
  310   1HH2  ARG  44          1HH2      ARG  44   5.439   1.538   9.649
  311   2HH2  ARG  44          2HH2      ARG  44   4.441   0.113   9.815
  312    H    VAL  45           H        VAL  45   7.763   1.027   4.417
  313    HA   VAL  45           HA       VAL  45   9.605   1.229   2.178
  314    HB   VAL  45           HB       VAL  45   7.646   0.372   0.873
  315   1HG1  VAL  45          1HG1      VAL  45   9.302  -1.136   1.899
  316   2HG1  VAL  45          2HG1      VAL  45   8.344  -1.197   3.393
  317   3HG1  VAL  45          3HG1      VAL  45   7.685  -1.858   1.884
  318   1HG2  VAL  45          1HG2      VAL  45   5.799   1.332   2.315
  319   2HG2  VAL  45          2HG2      VAL  45   5.646  -0.394   1.971
  320   3HG2  VAL  45          3HG2      VAL  45   6.207   0.135   3.560
  321    H    CYS  46           H        CYS  46   9.661   3.727   2.981
  322    HA   CYS  46           HA       CYS  46   7.509   5.313   1.857
  323   1HB   CYS  46          1HB       CYS  46   9.268   5.696   3.909
  324   2HB   CYS  46          2HB       CYS  46   9.951   6.769   2.707
  325    H    HIS  47           H        HIS  47   8.277   3.883  -0.245
  326    HA   HIS  47           HA       HIS  47  10.346   5.215  -1.857
  327   1HB   HIS  47          1HB       HIS  47   9.619   3.737  -3.640
  328   2HB   HIS  47          2HB       HIS  47   9.875   2.812  -2.159
  329    HD1  HIS  47           HD1      HIS  47   6.870   4.314  -4.167
  330    HD2  HIS  47           HD2      HIS  47   7.865   1.331  -1.350
  331    HE1  HIS  47           HE1      HIS  47   4.775   2.886  -3.803
  332    H    GLN  48           H        GLN  48   9.893   6.717  -3.557
  333    HA   GLN  48           HA       GLN  48   7.785   8.471  -3.235
  334   1HB   GLN  48          1HB       GLN  48   8.256   9.300  -5.443
  335   2HB   GLN  48          2HB       GLN  48   9.782   8.939  -4.607
  336   1HG   GLN  48          1HG       GLN  48   9.793   6.718  -5.890
  337   2HG   GLN  48          2HG       GLN  48   8.441   7.347  -6.841
  338   1HE2  GLN  48          2HE2      GLN  48   9.490  10.196  -6.877
  339   2HE2  GLN  48          1HE2      GLN  48  10.842  10.095  -7.988
  340    H    ASP  49           H        ASP  49   5.696   8.778  -4.039
  341    HA   ASP  49           HA       ASP  49   4.470   7.079  -5.968
  342   1HB   ASP  49          1HB       ASP  49   4.806   5.554  -3.793
  343   2HB   ASP  49          2HB       ASP  49   3.469   6.501  -3.186
  344    H    CYS  50           H        CYS  50   1.812   7.238  -4.628
  345    HA   CYS  50           HA       CYS  50   1.294  10.164  -4.680
  346   1HB   CYS  50          1HB       CYS  50  -1.067   9.510  -4.958
  347   2HB   CYS  50          2HB       CYS  50  -0.056   8.866  -6.247
  348    H    VAL  51           H        VAL  51   0.079  11.019  -2.921
  349    HA   VAL  51           HA       VAL  51  -0.505   9.313  -0.585
  350    HB   VAL  51           HB       VAL  51   1.255  11.815  -0.612
  351   1HG1  VAL  51          1HG1      VAL  51  -0.090  10.469   1.759
  352   2HG1  VAL  51          2HG1      VAL  51   1.300  11.567   1.900
  353   3HG1  VAL  51          3HG1      VAL  51  -0.217  12.169   1.249
  354   1HG2  VAL  51          1HG2      VAL  51   1.705   8.998   0.468
  355   2HG2  VAL  51          2HG2      VAL  51   2.483   9.703  -0.960
  356   3HG2  VAL  51          3HG2      VAL  51   2.836  10.353   0.638
  357    H    CYS  52           H        CYS  52  -2.119  10.339   0.737
  358    HA   CYS  52           HA       CYS  52  -4.241  11.751  -0.448
  359   1HB   CYS  52          1HB       CYS  52  -4.844  10.795   1.471
  360   2HB   CYS  52          2HB       CYS  52  -3.306  11.084   2.283
  361    H    GLU  53           H        GLU  53  -4.593  13.726  -1.084
  362    HA   GLU  53           HA       GLU  53  -2.606  15.500  -1.647
  363   1HB   GLU  53          1HB       GLU  53  -4.785  15.441  -2.710
  364   2HB   GLU  53          2HB       GLU  53  -5.566  16.046  -1.237
  365   1HG   GLU  53          1HG       GLU  53  -4.342  18.193  -1.491
  366   2HG   GLU  53          2HG       GLU  53  -3.494  17.545  -2.910
  367    H    GLU  54           H        GLU  54  -1.611  17.142  -0.753
  368    HA   GLU  54           HA       GLU  54  -1.545  17.602   2.047
  369   1HB   GLU  54          1HB       GLU  54   0.276  17.915   0.264
  370   2HB   GLU  54          2HB       GLU  54  -0.496  19.449  -0.155
  371   1HG   GLU  54          1HG       GLU  54   0.600  18.671   2.588
  372   2HG   GLU  54          2HG       GLU  54   1.461  19.630   1.386
  373    H    GLY  55           H        GLY  55  -3.793  17.869   2.402
  374   1HA   GLY  55          1HA       GLY  55  -4.814  20.573   2.594
  375   2HA   GLY  55          2HA       GLY  55  -5.503  19.679   1.222
  376    H    PHE  56           H        PHE  56  -5.504  16.992   2.430
  377    HA   PHE  56           HA       PHE  56  -7.427  17.394   4.681
  378   1HB   PHE  56          1HB       PHE  56  -8.078  15.348   2.602
  379   2HB   PHE  56          2HB       PHE  56  -9.100  16.253   3.692
  380    HD1  PHE  56           HD1      PHE  56  -9.906  18.509   3.154
  381    HD2  PHE  56           HD2      PHE  56  -7.359  16.344   0.431
  382    HE1  PHE  56           HE1      PHE  56 -10.492  20.093   1.335
  383    HE2  PHE  56           HE2      PHE  56  -7.991  17.896  -1.394
  384    HZ   PHE  56           HZ       PHE  56  -9.542  19.782  -0.942
  385    H    TYR  57           H        TYR  57  -8.080  14.861   5.290
  386    HA   TYR  57           HA       TYR  57  -5.461  13.736   6.131
  387   1HB   TYR  57          1HB       TYR  57  -8.210  13.745   7.432
  388   2HB   TYR  57          2HB       TYR  57  -6.862  12.764   7.987
  389    HD1  TYR  57           HD1      TYR  57  -8.000  16.297   7.535
  390    HD2  TYR  57           HD2      TYR  57  -5.133  13.645   9.364
  391    HE1  TYR  57           HE1      TYR  57  -7.185  18.153   8.951
  392    HE2  TYR  57           HE2      TYR  57  -4.309  15.509  10.771
  393    HH   TYR  57           HH       TYR  57  -5.694  18.796  10.597
  394    H    ARG  58           H        ARG  58  -5.033  11.602   5.939
  395    HA   ARG  58           HA       ARG  58  -6.872  10.072   4.202
  396   1HB   ARG  58          1HB       ARG  58  -5.386   8.176   4.514
  397   2HB   ARG  58          2HB       ARG  58  -4.769   9.547   3.592
  398   1HG   ARG  58          1HG       ARG  58  -2.894   9.396   4.722
  399   2HG   ARG  58          2HG       ARG  58  -3.734   9.954   6.163
  400   1HD   ARG  58          1HD       ARG  58  -3.419   7.056   5.221
  401   2HD   ARG  58          2HD       ARG  58  -2.468   7.819   6.506
  402    HE   ARG  58           HE       ARG  58  -5.138   8.142   7.240
  403   1HH1  ARG  58          1HH1      ARG  58  -2.905   5.463   6.747
  404   2HH1  ARG  58          2HH1      ARG  58  -3.792   4.351   7.763
  405   1HH2  ARG  58          1HH2      ARG  58  -6.327   6.703   8.557
  406   2HH2  ARG  58          2HH2      ARG  58  -5.648   5.172   8.995
  407    H    ASN  59           H        ASN  59  -8.669   9.570   5.130
  408    HA   ASN  59           HA       ASN  59  -9.221   8.972   7.818
  409   1HB   ASN  59          1HB       ASN  59 -11.098   7.627   6.996
  410   2HB   ASN  59          2HB       ASN  59 -11.015   9.233   6.266
  411   1HD2  ASN  59          2HD2      ASN  59 -12.618   7.319   5.117
  412   2HD2  ASN  59          1HD2      ASN  59 -11.925   6.847   3.569
  413    H    LYS  60           H        LYS  60  -8.457   6.574   5.272
  414    HA   LYS  60           HA       LYS  60  -7.222   4.679   7.153
  415   1HB   LYS  60          1HB       LYS  60  -8.890   2.915   6.217
  416   2HB   LYS  60          2HB       LYS  60  -9.313   3.913   7.602
  417   1HG   LYS  60          1HG       LYS  60 -10.823   5.256   6.412
  418   2HG   LYS  60          2HG       LYS  60 -10.228   4.775   4.827
  419   1HD   LYS  60          1HD       LYS  60 -12.347   3.706   5.217
  420   2HD   LYS  60          2HD       LYS  60 -11.083   2.474   5.196
  421   1HE   LYS  60          1HE       LYS  60 -12.676   1.998   6.971
  422   2HE   LYS  60          2HE       LYS  60 -11.126   2.411   7.706
  423   1HZ   LYS  60          1HZ       LYS  60 -13.428   4.224   7.399
  424   2HZ   LYS  60          2HZ       LYS  60 -12.969   3.457   8.785
  425   3HZ   LYS  60          3HZ       LYS  60 -11.991   4.604   8.116
  426    H    ASP  61           H        ASP  61  -8.736   3.835   4.100
  427    HA   ASP  61           HA       ASP  61  -6.185   2.938   3.071
  428   1HB   ASP  61          1HB       ASP  61  -8.274   1.650   2.806
  429   2HB   ASP  61          2HB       ASP  61  -8.962   2.954   1.820
  430    H    ASP  62           H        ASP  62  -5.627   5.419   3.334
  431    HA   ASP  62           HA       ASP  62  -5.229   7.466   2.508
  432   1HB   ASP  62          1HB       ASP  62  -3.552   5.869   1.440
  433   2HB   ASP  62          2HB       ASP  62  -4.446   6.106  -0.065
  434    H    LYS  63           H        LYS  63  -7.922   7.249   2.442
  435    HA   LYS  63           HA       LYS  63  -8.720   8.563  -0.115
  436   1HB   LYS  63          1HB       LYS  63 -10.655   8.070   2.115
  437   2HB   LYS  63          2HB       LYS  63 -10.925   8.233   0.408
  438   1HG   LYS  63          1HG       LYS  63  -9.684   5.829   1.835
  439   2HG   LYS  63          2HG       LYS  63 -11.320   5.932   1.208
  440   1HD   LYS  63          1HD       LYS  63  -8.819   6.091  -0.544
  441   2HD   LYS  63          2HD       LYS  63  -9.781   4.640  -0.263
  442   1HE   LYS  63          1HE       LYS  63 -11.789   5.848  -1.217
  443   2HE   LYS  63          2HE       LYS  63 -10.721   7.204  -1.630
  444   1HZ   LYS  63          1HZ       LYS  63  -9.437   5.684  -2.962
  445   2HZ   LYS  63          2HZ       LYS  63 -10.465   4.450  -2.604
  446   3HZ   LYS  63          3HZ       LYS  63 -11.006   5.746  -3.465
  447    H    CYS  64           H        CYS  64  -7.824  10.584   0.042
  448    HA   CYS  64           HA       CYS  64  -7.552  12.024   2.499
  449   1HB   CYS  64          1HB       CYS  64  -6.608  12.375  -0.052
  450   2HB   CYS  64          2HB       CYS  64  -7.780  13.690   0.082
  451    H    VAL  65           H        VAL  65  -9.206  12.731   3.723
  452    HA   VAL  65           HA       VAL  65 -11.435  14.220   2.504
  453    HB   VAL  65           HB       VAL  65 -13.060  13.054   3.923
  454   1HG1  VAL  65          1HG1      VAL  65 -12.778  12.344   1.559
  455   2HG1  VAL  65          2HG1      VAL  65 -11.687  11.046   2.099
  456   3HG1  VAL  65          3HG1      VAL  65 -13.380  11.054   2.615
  457   1HG2  VAL  65          1HG2      VAL  65 -10.822  11.043   4.495
  458   2HG2  VAL  65          2HG2      VAL  65 -11.565  12.127   5.684
  459   3HG2  VAL  65          3HG2      VAL  65 -12.519  10.839   4.938
  460    H    SER  66           H        SER  66 -12.493  15.567   4.300
  461    HA   SER  66           HA       SER  66 -10.417  16.676   5.966
  462   1HB   SER  66          1HB       SER  66 -12.304  18.063   5.312
  463   2HB   SER  66          2HB       SER  66 -13.453  16.959   6.098
  464    HG   SER  66           HG       SER  66 -12.848  18.840   7.369
  465    H    ALA  67           H        ALA  67 -10.254  16.571   8.299
  466    HA   ALA  67           HA       ALA  67 -10.600  14.026   9.554
  467   1HB   ALA  67          1HB       ALA  67 -10.390  16.800  10.806
  468   2HB   ALA  67          2HB       ALA  67 -10.224  15.252  11.663
  469   3HB   ALA  67          3HB       ALA  67  -9.037  15.705  10.431
  470    H    GLU  68           H        GLU  68 -12.661  16.891   9.176
  471    HA   GLU  68           HA       GLU  68 -14.814  16.319  10.887
  472   1HB   GLU  68          1HB       GLU  68 -14.845  17.438   8.054
  473   2HB   GLU  68          2HB       GLU  68 -16.169  17.566   9.214
  474   1HG   GLU  68          1HG       GLU  68 -14.884  18.966  10.696
  475   2HG   GLU  68          2HG       GLU  68 -13.389  18.709   9.791
  476    H    ASP  69           H        ASP  69 -14.029  14.928   7.671
  477    HA   ASP  69           HA       ASP  69 -16.505  13.386   7.487
  478   1HB   ASP  69          1HB       ASP  69 -15.176  14.064   5.460
  479   2HB   ASP  69          2HB       ASP  69 -13.864  13.003   6.017
  480    H    CYS  70           H        CYS  70 -13.060  12.800   8.309
  481    HA   CYS  70           HA       CYS  70 -13.187  10.043   8.711
  482   1HB   CYS  70          1HB       CYS  70 -11.075  11.357   8.733
  483   2HB   CYS  70          2HB       CYS  70 -11.531  11.973  10.336
  484    H    GLU  71           H        GLU  71 -13.906  12.627  11.091
  485    HA   GLU  71           HA       GLU  71 -14.471  10.959  13.326
  486   1HB   GLU  71          1HB       GLU  71 -15.330  13.767  12.540
  487   2HB   GLU  71          2HB       GLU  71 -15.996  12.958  13.959
  488   1HG   GLU  71          1HG       GLU  71 -14.237  14.200  14.824
  489   2HG   GLU  71          2HG       GLU  71 -13.642  12.544  14.793
  490    H    LEU  72           H        LEU  72 -16.321  11.298  10.425
  491    HA   LEU  72           HA       LEU  72 -18.796  10.202  11.714
  492   1HB   LEU  72          1HB       LEU  72 -18.341  11.184   8.871
  493   2HB   LEU  72          2HB       LEU  72 -19.868  10.642   9.568
  494    HG   LEU  72           HG       LEU  72 -18.289  13.087  10.499
  495   1HD1  LEU  72          1HD1      LEU  72 -19.204  13.359   8.228
  496   2HD1  LEU  72          2HD1      LEU  72 -20.816  12.887   8.813
  497   3HD1  LEU  72          3HD1      LEU  72 -20.057  14.386   9.394
  498   1HD2  LEU  72          1HD2      LEU  72 -21.056  12.062  11.272
  499   2HD2  LEU  72          2HD2      LEU  72 -19.638  12.200  12.338
  500   3HD2  LEU  72          3HD2      LEU  72 -20.403  13.658  11.699
  501    H    ASP  73           H        ASP  73 -16.336   9.665   9.224
  502    HA   ASP  73           HA       ASP  73 -16.955   7.066   8.422
  503   1HB   ASP  73          1HB       ASP  73 -15.085   8.760   7.654
  504   2HB   ASP  73          2HB       ASP  73 -14.124   8.011   8.919
  505    H    ASN  74           H        ASN  74 -15.872   8.177  11.522
  506    HA   ASN  74           HA       ASN  74 -14.796   5.972  12.744
  507   1HB   ASN  74          1HB       ASN  74 -15.646   8.327  13.659
  508   2HB   ASN  74          2HB       ASN  74 -17.074   7.411  14.140
  509   1HD2  ASN  74          2HD2      ASN  74 -15.645   4.887  14.849
  510   2HD2  ASN  74          1HD2      ASN  74 -14.450   5.259  16.070
  511    H    MET  75           H        MET  75 -18.107   6.216  11.474
  512    HA   MET  75           HA       MET  75 -19.329   4.007  12.750
  513   1HB   MET  75          1HB       MET  75 -19.405   4.954   9.853
  514   2HB   MET  75          2HB       MET  75 -20.455   3.680  10.495
  515   1HG   MET  75          1HG       MET  75 -21.425   5.205  12.121
  516   2HG   MET  75          2HG       MET  75 -20.334   6.502  11.629
  517   1HE   MET  75          1HE       MET  75 -23.410   6.942  11.913
  518   2HE   MET  75          2HE       MET  75 -22.271   8.198  11.361
  519   3HE   MET  75          3HE       MET  75 -23.754   7.869  10.433
  520    H    ASP  76           H        ASP  76 -16.868   4.098  10.200
  521    HA   ASP  76           HA       ASP  76 -16.365   1.163  10.442
  522   1HB   ASP  76          1HB       ASP  76 -15.581   3.159   8.279
  523   2HB   ASP  76          2HB       ASP  76 -15.113   1.453   8.326
  524    H    PHE  77           H        PHE  77 -15.714   2.797  12.552
  525    HA   PHE  77           HA       PHE  77 -13.889   3.776  13.677
  526   1HB   PHE  77          1HB       PHE  77 -13.679   0.757  13.682
  527   2HB   PHE  77          2HB       PHE  77 -13.015   1.848  14.894
  528    HD1  PHE  77           HD1      PHE  77 -16.222   0.615  13.394
  529    HD2  PHE  77           HD2      PHE  77 -14.381   2.755  16.660
  530    HE1  PHE  77           HE1      PHE  77 -18.420   0.841  14.489
  531    HE2  PHE  77           HE2      PHE  77 -16.586   2.960  17.761
  532    HZ   PHE  77           HZ       PHE  77 -18.615   2.011  16.678
  533    H    ILE  78           H        ILE  78 -12.212   4.908  12.855
  534    HA   ILE  78           HA       ILE  78 -10.076   3.611  11.290
  535    HB   ILE  78           HB       ILE  78 -10.450   6.431  12.395
  536   1HG1  ILE  78          1HG1      ILE  78 -10.248   6.910   9.870
  537   2HG1  ILE  78          2HG1      ILE  78 -10.476   5.188   9.605
  538   1HG2  ILE  78          1HG2      ILE  78  -8.119   5.275  10.803
  539   2HG2  ILE  78          2HG2      ILE  78  -8.384   6.997  11.141
  540   3HG2  ILE  78          3HG2      ILE  78  -8.034   5.903  12.462
  541   1HD1  ILE  78          1HD1      ILE  78 -12.789   5.432  10.633
  542   2HD1  ILE  78          2HD1      ILE  78 -12.461   7.170  10.830
  543   3HD1  ILE  78          3HD1      ILE  78 -12.506   6.456   9.230
  544    H    TYR  79           H        TYR  79  -9.601   1.933  12.707
  545    HA   TYR  79           HA       TYR  79  -8.653   2.585  15.415
  546   1HB   TYR  79          1HB       TYR  79 -10.529   0.840  14.553
  547   2HB   TYR  79          2HB       TYR  79  -9.197  -0.259  14.787
  548    HD1  TYR  79           HD1      TYR  79  -7.829   0.968  17.179
  549    HD2  TYR  79           HD2      TYR  79 -12.001   0.305  16.307
  550    HE1  TYR  79           HE1      TYR  79  -8.351   1.059  19.593
  551    HE2  TYR  79           HE2      TYR  79 -12.516   0.394  18.717
  552    HH   TYR  79           HH       TYR  79 -11.676   0.673  20.848
  553    HA   PRO  80           HA       PRO  80  -4.373   1.721  13.916
  554   1HB   PRO  80          1HB       PRO  80  -4.179   3.320  16.481
  555   2HB   PRO  80          2HB       PRO  80  -3.077   3.311  15.082
  556   1HG   PRO  80          1HG       PRO  80  -4.977   5.253  15.387
  557   2HG   PRO  80          2HG       PRO  80  -4.611   4.563  13.779
  558   1HD   PRO  80          1HD       PRO  80  -6.974   4.047  15.549
  559   2HD   PRO  80          2HD       PRO  80  -6.834   4.073  13.767
  560    H    GLY  81           H        GLY  81  -5.478   1.868  17.352
  561   1HA   GLY  81          1HA       GLY  81  -5.619   0.336  19.001
  562   2HA   GLY  81          2HA       GLY  81  -5.828  -0.887  17.741
  563    H    THR  82           H        THR  82  -3.821  -1.727  16.744
  564    HA   THR  82           HA       THR  82  -1.564  -2.057  18.674
  565    HB   THR  82           HB       THR  82  -1.011  -3.967  17.096
  566    HG1  THR  82           HG1      THR  82  -2.853  -4.634  15.795
  567   1HG2  THR  82          1HG2      THR  82  -2.217  -4.342  19.245
  568   2HG2  THR  82          2HG2      THR  82  -3.768  -4.103  18.414
  569   3HG2  THR  82          3HG2      THR  82  -2.736  -5.485  17.992
  570    H    ARG  83           H        ARG  83  -1.937  -2.197  15.171
  571    HA   ARG  83           HA       ARG  83  -0.884   0.407  14.651
  572   1HB   ARG  83          1HB       ARG  83   1.284  -0.811  15.254
  573   2HB   ARG  83          2HB       ARG  83   0.992  -1.847  13.857
  574   1HG   ARG  83          1HG       ARG  83   0.677   0.723  12.791
  575   2HG   ARG  83          2HG       ARG  83   1.869   1.015  14.040
  576   1HD   ARG  83          1HD       ARG  83   3.467  -0.360  13.007
  577   2HD   ARG  83          2HD       ARG  83   2.272  -1.305  12.115
  578    HE   ARG  83           HE       ARG  83   3.411   1.285  11.348
  579   1HH1  ARG  83          1HH1      ARG  83   0.539  -0.794  10.916
  580   2HH1  ARG  83          2HH1      ARG  83   0.375  -0.392   9.229
  581   1HH2  ARG  83          1HH2      ARG  83   3.032   1.968   9.302
  582   2HH2  ARG  83          2HH2      ARG  83   1.744   1.315   8.299
  583    H    ASN  84           H        ASN  84  -3.202  -0.461  13.897
  584    HA   ASN  84           HA       ASN  84  -2.998  -1.122  10.969
  585   1HB   ASN  84          1HB       ASN  84  -4.250  -2.722  12.373
  586   2HB   ASN  84          2HB       ASN  84  -5.357  -1.438  12.856
  587   1HD2  ASN  84          2HD2      ASN  84  -6.482  -0.285  10.972
  588   2HD2  ASN  84          1HD2      ASN  84  -6.982  -1.303   9.613
  589    HA   PRO  85           HA       PRO  85  -4.077   3.347  11.824
  590   1HB   PRO  85          1HB       PRO  85  -2.446   4.610  10.014
  591   2HB   PRO  85          2HB       PRO  85  -1.876   4.017  11.599
  592   1HG   PRO  85          1HG       PRO  85  -1.654   2.597   8.924
  593   2HG   PRO  85          2HG       PRO  85  -0.365   2.866  10.133
  594   1HD   PRO  85          1HD       PRO  85  -1.708   0.528  10.051
  595   2HD   PRO  85          2HD       PRO  85  -1.267   1.300  11.609
  Start of MODEL    2
    1   1H    LYS   1          1H        LYS   1  -2.340   0.445  -6.300
    2   2H    LYS   1          2H        LYS   1  -3.859   0.882  -5.800
    3   3H    LYS   1          3H        LYS   1  -3.532   0.651  -7.406
    4    HA   LYS   1           HA       LYS   1  -3.653   2.939  -7.024
    5   1HB   LYS   1          1HB       LYS   1  -2.108   4.053  -5.482
    6   2HB   LYS   1          2HB       LYS   1  -3.234   2.976  -4.645
    7   1HG   LYS   1          1HG       LYS   1  -1.462   1.226  -4.510
    8   2HG   LYS   1          2HG       LYS   1  -0.318   2.312  -5.298
    9   1HD   LYS   1          1HD       LYS   1  -1.736   2.789  -2.628
   10   2HD   LYS   1          2HD       LYS   1  -0.072   2.232  -2.823
   11   1HE   LYS   1          1HE       LYS   1  -1.173   4.954  -3.658
   12   2HE   LYS   1          2HE       LYS   1  -0.107   4.620  -2.297
   13   1HZ   LYS   1          1HZ       LYS   1   1.554   3.858  -3.875
   14   2HZ   LYS   1          2HZ       LYS   1   0.577   4.270  -5.137
   15   3HZ   LYS   1          3HZ       LYS   1   1.139   5.432  -4.124
   16    H    ALA   2           H        ALA   2  -2.103   4.521  -7.918
   17    HA   ALA   2           HA       ALA   2  -0.133   3.279  -9.746
   18   1HB   ALA   2          1HB       ALA   2  -1.677   5.068 -10.546
   19   2HB   ALA   2          2HB       ALA   2  -0.964   6.175  -9.356
   20   3HB   ALA   2          3HB       ALA   2   0.022   5.538 -10.676
   21    H    THR   3           H        THR   3   1.972   4.992  -9.806
   22    HA   THR   3           HA       THR   3   3.143   4.729  -7.107
   23    HB   THR   3           HB       THR   3   5.258   5.267  -8.369
   24    HG1  THR   3           HG1      THR   3   5.129   5.112 -10.618
   25   1HG2  THR   3          1HG2      THR   3   4.595   2.945  -7.821
   26   2HG2  THR   3          2HG2      THR   3   3.659   2.844  -9.327
   27   3HG2  THR   3          3HG2      THR   3   5.425   3.023  -9.384
   28    H    MET   4           H        MET   4   3.837   7.165  -9.589
   29    HA   MET   4           HA       MET   4   3.637   9.320  -7.560
   30   1HB   MET   4          1HB       MET   4   4.413   9.433 -10.495
   31   2HB   MET   4          2HB       MET   4   4.502  10.770  -9.350
   32   1HG   MET   4          1HG       MET   4   6.113   9.419  -7.978
   33   2HG   MET   4          2HG       MET   4   6.102   8.182  -9.238
   34   1HE   MET   4          1HE       MET   4   6.944   8.620 -11.732
   35   2HE   MET   4          2HE       MET   4   6.038  10.144 -11.927
   36   3HE   MET   4          3HE       MET   4   7.783  10.104 -12.239
   37    H    GLN   5           H        GLN   5   2.503   8.606 -10.587
   38    HA   GLN   5           HA       GLN   5   0.481  10.576 -10.910
   39   1HB   GLN   5          1HB       GLN   5   0.010   9.530 -13.034
   40   2HB   GLN   5          2HB       GLN   5   1.741   9.693 -12.778
   41   1HG   GLN   5          1HG       GLN   5   0.150   7.096 -12.535
   42   2HG   GLN   5          2HG       GLN   5   1.116   7.598 -13.914
   43   1HE2  GLN   5          2HE2      GLN   5   1.478   5.116 -12.366
   44   2HE2  GLN   5          1HE2      GLN   5   3.070   5.266 -11.603
   45    H    CYS   6           H        CYS   6  -0.267   9.536  -8.556
   46    HA   CYS   6           HA       CYS   6  -2.597   7.745  -8.939
   47   1HB   CYS   6          1HB       CYS   6  -1.624   9.252  -6.510
   48   2HB   CYS   6          2HB       CYS   6  -2.882   7.998  -6.542
   49    H    GLY   7           H        GLY   7  -2.302  10.992  -7.331
   50   1HA   GLY   7          1HA       GLY   7  -3.152  13.012  -7.968
   51   2HA   GLY   7          2HA       GLY   7  -3.832  12.296  -9.432
   52    H    GLU   8           H        GLU   8  -5.508  10.364  -8.372
   53    HA   GLU   8           HA       GLU   8  -7.822  11.995  -7.865
   54   1HB   GLU   8          1HB       GLU   8  -7.532   8.964  -7.673
   55   2HB   GLU   8          2HB       GLU   8  -9.038   9.877  -7.830
   56   1HG   GLU   8          1HG       GLU   8  -6.812   9.665  -9.918
   57   2HG   GLU   8          2HG       GLU   8  -8.414   8.937  -9.988
   58    H    ASN   9           H        ASN   9  -7.127  13.087  -5.984
   59    HA   ASN   9           HA       ASN   9  -7.352  13.656  -3.789
   60   1HB   ASN   9          1HB       ASN   9  -8.292  10.809  -3.192
   61   2HB   ASN   9          2HB       ASN   9  -8.101  12.108  -2.036
   62   1HD2  ASN   9          2HD2      ASN   9 -10.394  11.864  -1.515
   63   2HD2  ASN   9          1HD2      ASN   9 -11.584  12.570  -2.599
   64    H    GLU  10           H        GLU  10  -5.881  10.482  -4.438
   65    HA   GLU  10           HA       GLU  10  -3.793  10.700  -2.554
   66   1HB   GLU  10          1HB       GLU  10  -4.018   9.105  -5.103
   67   2HB   GLU  10          2HB       GLU  10  -2.774   8.877  -3.848
   68   1HG   GLU  10          1HG       GLU  10  -4.717   8.523  -2.213
   69   2HG   GLU  10          2HG       GLU  10  -5.779   8.420  -3.625
   70    H    LYS  11           H        LYS  11  -3.200  13.038  -3.019
   71    HA   LYS  11           HA       LYS  11  -1.904  13.700  -5.483
   72   1HB   LYS  11          1HB       LYS  11  -2.223  14.987  -2.793
   73   2HB   LYS  11          2HB       LYS  11  -0.851  15.527  -3.755
   74   1HG   LYS  11          1HG       LYS  11  -2.787  16.931  -4.150
   75   2HG   LYS  11          2HG       LYS  11  -2.254  16.112  -5.623
   76   1HD   LYS  11          1HD       LYS  11  -4.094  14.421  -5.324
   77   2HD   LYS  11          2HD       LYS  11  -4.637  15.298  -3.887
   78   1HE   LYS  11          1HE       LYS  11  -5.049  17.317  -5.313
   79   2HE   LYS  11          2HE       LYS  11  -4.449  16.425  -6.725
   80   1HZ   LYS  11          1HZ       LYS  11  -6.211  14.854  -6.407
   81   2HZ   LYS  11          2HZ       LYS  11  -6.811  15.741  -5.134
   82   3HZ   LYS  11          3HZ       LYS  11  -6.798  16.379  -6.653
   83    H    TYR  12           H        TYR  12   0.250  14.073  -6.000
   84    HA   TYR  12           HA       TYR  12   2.133  12.076  -5.283
   85   1HB   TYR  12          1HB       TYR  12   2.307  13.131  -7.419
   86   2HB   TYR  12          2HB       TYR  12   2.358  14.741  -6.704
   87    HD1  TYR  12           HD1      TYR  12   4.314  11.604  -7.153
   88    HD2  TYR  12           HD2      TYR  12   4.416  15.704  -5.844
   89    HE1  TYR  12           HE1      TYR  12   6.709  11.364  -6.573
   90    HE2  TYR  12           HE2      TYR  12   6.779  15.429  -5.170
   91    HH   TYR  12           HH       TYR  12   8.445  13.836  -4.682
   92    H    ASP  13           H        ASP  13   4.027  12.193  -3.981
   93    HA   ASP  13           HA       ASP  13   4.908  14.672  -2.887
   94   1HB   ASP  13          1HB       ASP  13   3.185  14.298  -1.195
   95   2HB   ASP  13          2HB       ASP  13   3.816  12.647  -0.911
   96    H    SER  14           H        SER  14   6.960  14.510  -1.987
   97    HA   SER  14           HA       SER  14   8.592  12.227  -2.783
   98   1HB   SER  14          1HB       SER  14   9.305  14.726  -1.247
   99   2HB   SER  14          2HB       SER  14  10.419  13.587  -2.027
  100    HG   SER  14           HG       SER  14   9.912  15.443  -3.351
  101    H    CYS  15           H        CYS  15   6.724  11.109  -1.147
  102    HA   CYS  15           HA       CYS  15   8.394  10.120   0.927
  103   1HB   CYS  15          1HB       CYS  15   7.403  12.361   1.910
  104   2HB   CYS  15          2HB       CYS  15   6.023  11.338   2.250
  105    H    GLY  16           H        GLY  16   7.532   8.528  -0.890
  106   1HA   GLY  16          1HA       GLY  16   6.709   6.421  -1.020
  107   2HA   GLY  16          2HA       GLY  16   6.402   6.523   0.699
  108    H    SER  17           H        SER  17   4.833   4.952  -0.194
  109    HA   SER  17           HA       SER  17   2.469   5.864  -1.674
  110   1HB   SER  17          1HB       SER  17   3.389   3.169  -0.544
  111   2HB   SER  17          2HB       SER  17   2.001   3.413  -1.617
  112    HG   SER  17           HG       SER  17   3.578   4.391  -3.103
  113    H    LYS  18           H        LYS  18   1.495   7.238  -0.088
  114    HA   LYS  18           HA       LYS  18   0.116   7.801   1.619
  115   1HB   LYS  18          1HB       LYS  18  -0.343   4.999   2.591
  116   2HB   LYS  18          2HB       LYS  18  -1.395   6.398   2.623
  117   1HG   LYS  18          1HG       LYS  18  -0.766   4.529   0.330
  118   2HG   LYS  18          2HG       LYS  18  -2.294   4.785   1.165
  119   1HD   LYS  18          1HD       LYS  18  -0.935   6.879  -0.610
  120   2HD   LYS  18          2HD       LYS  18  -2.177   5.759  -1.158
  121   1HE   LYS  18          1HE       LYS  18  -2.580   7.784   1.089
  122   2HE   LYS  18          2HE       LYS  18  -3.021   7.995  -0.613
  123   1HZ   LYS  18          1HZ       LYS  18  -4.482   6.166  -0.471
  124   2HZ   LYS  18          2HZ       LYS  18  -4.099   5.869   1.108
  125   3HZ   LYS  18          3HZ       LYS  18  -4.873   7.264   0.692
  126    H    GLU  19           H        GLU  19   1.927   4.956   2.706
  127    HA   GLU  19           HA       GLU  19   2.866   4.387   4.664
  128   1HB   GLU  19          1HB       GLU  19   4.421   6.971   4.429
  129   2HB   GLU  19          2HB       GLU  19   4.943   5.373   4.986
  130   1HG   GLU  19          1HG       GLU  19   4.321   6.212   2.133
  131   2HG   GLU  19          2HG       GLU  19   5.920   6.006   2.849
  132    H    CYS  20           H        CYS  20   0.487   5.439   5.251
  133    HA   CYS  20           HA       CYS  20  -0.769   6.675   6.728
  134   1HB   CYS  20          1HB       CYS  20  -0.205   5.963   9.123
  135   2HB   CYS  20          2HB       CYS  20  -0.526   4.728   7.911
  136    H    ASP  21           H        ASP  21   1.039   8.384   5.487
  137    HA   ASP  21           HA       ASP  21   2.238  10.173   7.402
  138   1HB   ASP  21          1HB       ASP  21   3.003  10.133   5.108
  139   2HB   ASP  21          2HB       ASP  21   1.400  10.531   4.491
  140    H    LYS  22           H        LYS  22  -0.564  10.818   5.244
  141    HA   LYS  22           HA       LYS  22  -1.801  12.532   7.309
  142   1HB   LYS  22          1HB       LYS  22  -2.804  11.829   4.524
  143   2HB   LYS  22          2HB       LYS  22  -3.410  13.081   5.626
  144   1HG   LYS  22          1HG       LYS  22  -1.042  14.065   5.600
  145   2HG   LYS  22          2HG       LYS  22  -0.716  12.984   4.230
  146   1HD   LYS  22          1HD       LYS  22  -2.697  13.987   3.037
  147   2HD   LYS  22          2HD       LYS  22  -2.869  15.145   4.355
  148   1HE   LYS  22          1HE       LYS  22  -0.411  14.802   2.562
  149   2HE   LYS  22          2HE       LYS  22  -1.603  16.099   2.449
  150   1HZ   LYS  22          1HZ       LYS  22  -0.965  16.777   4.668
  151   2HZ   LYS  22          2HZ       LYS  22   0.185  15.594   4.721
  152   3HZ   LYS  22          3HZ       LYS  22   0.313  16.816   3.625
  153    H    LYS  23           H        LYS  23  -1.605  10.327   8.582
  154    HA   LYS  23           HA       LYS  23  -3.784   8.469   8.118
  155   1HB   LYS  23          1HB       LYS  23  -3.197   7.382  10.083
  156   2HB   LYS  23          2HB       LYS  23  -1.697   7.820   9.278
  157   1HG   LYS  23          1HG       LYS  23  -2.916   9.161  11.742
  158   2HG   LYS  23          2HG       LYS  23  -1.560   8.042  11.696
  159   1HD   LYS  23          1HD       LYS  23  -0.322   9.728  10.229
  160   2HD   LYS  23          2HD       LYS  23  -1.612  10.886  10.638
  161   1HE   LYS  23          1HE       LYS  23  -1.075  10.355  13.101
  162   2HE   LYS  23          2HE       LYS  23   0.331   9.456  12.500
  163   1HZ   LYS  23          1HZ       LYS  23  -0.127  12.284  11.889
  164   2HZ   LYS  23          2HZ       LYS  23   0.821  11.725  13.122
  165   3HZ   LYS  23          3HZ       LYS  23   1.211  11.369  11.567
  166    H    CYS  24           H        CYS  24  -5.863   8.491   8.971
  167    HA   CYS  24           HA       CYS  24  -6.878  10.999   9.980
  168   1HB   CYS  24          1HB       CYS  24  -8.352   9.636   8.716
  169   2HB   CYS  24          2HB       CYS  24  -8.054   8.220   9.752
  170    H    LYS  25           H        LYS  25  -7.165  11.661  12.049
  171    HA   LYS  25           HA       LYS  25  -5.840  10.179  14.202
  172   1HB   LYS  25          1HB       LYS  25  -7.301  12.844  14.266
  173   2HB   LYS  25          2HB       LYS  25  -6.123  12.239  15.446
  174   1HG   LYS  25          1HG       LYS  25  -5.677  13.171  12.576
  175   2HG   LYS  25          2HG       LYS  25  -5.131  13.942  14.066
  176   1HD   LYS  25          1HD       LYS  25  -3.669  11.957  14.531
  177   2HD   LYS  25          2HD       LYS  25  -4.141  11.260  12.968
  178   1HE   LYS  25          1HE       LYS  25  -2.799  13.988  13.335
  179   2HE   LYS  25          2HE       LYS  25  -1.981  12.495  12.876
  180   1HZ   LYS  25          1HZ       LYS  25  -3.442  12.394  10.943
  181   2HZ   LYS  25          2HZ       LYS  25  -4.062  13.866  11.336
  182   3HZ   LYS  25          3HZ       LYS  25  -2.469  13.730  10.946
  183    H    TYR  26           H        TYR  26  -6.912   9.473  16.112
  184    HA   TYR  26           HA       TYR  26  -9.889   9.362  16.031
  185   1HB   TYR  26          1HB       TYR  26  -8.026   6.987  16.161
  186   2HB   TYR  26          2HB       TYR  26  -9.773   6.901  16.394
  187    HD1  TYR  26           HD1      TYR  26 -11.155   8.143  14.359
  188    HD2  TYR  26           HD2      TYR  26  -7.248   6.344  14.051
  189    HE1  TYR  26           HE1      TYR  26 -11.605   7.603  12.010
  190    HE2  TYR  26           HE2      TYR  26  -7.678   5.826  11.689
  191    HH   TYR  26           HH       TYR  26 -10.802   6.638  10.126
  192    H    ASP  27           H        ASP  27  -7.189   9.876  17.961
  193    HA   ASP  27           HA       ASP  27  -6.928   8.727  20.155
  194   1HB   ASP  27          1HB       ASP  27  -6.066  10.954  19.857
  195   2HB   ASP  27          2HB       ASP  27  -7.664  11.668  20.100
  196    H    GLY  28           H        GLY  28  -9.657  11.028  20.592
  197   1HA   GLY  28          1HA       GLY  28 -11.208  10.373  22.516
  198   2HA   GLY  28          2HA       GLY  28 -11.865  10.420  20.873
  199    H    VAL  29           H        VAL  29 -11.305   8.203  19.679
  200    HA   VAL  29           HA       VAL  29 -12.747   6.106  21.247
  201    HB   VAL  29           HB       VAL  29 -12.254   6.377  18.253
  202   1HG1  VAL  29          1HG1      VAL  29 -13.842   4.314  19.841
  203   2HG1  VAL  29          2HG1      VAL  29 -13.862   4.487  18.074
  204   3HG1  VAL  29          3HG1      VAL  29 -12.372   4.005  18.892
  205   1HG2  VAL  29          1HG2      VAL  29 -14.784   6.712  19.933
  206   2HG2  VAL  29          2HG2      VAL  29 -13.914   8.017  19.103
  207   3HG2  VAL  29          3HG2      VAL  29 -14.706   6.745  18.160
  208    H    GLU  30           H        GLU  30  -9.863   6.672  19.184
  209    HA   GLU  30           HA       GLU  30  -8.748   4.014  19.806
  210   1HB   GLU  30          1HB       GLU  30  -8.431   5.210  17.595
  211   2HB   GLU  30          2HB       GLU  30  -7.420   6.387  18.458
  212   1HG   GLU  30          1HG       GLU  30  -6.168   4.118  19.245
  213   2HG   GLU  30          2HG       GLU  30  -6.906   3.501  17.760
  214    H    GLU  31           H        GLU  31  -9.167   4.726  22.196
  215    HA   GLU  31           HA       GLU  31  -7.680   6.772  23.389
  216   1HB   GLU  31          1HB       GLU  31  -8.746   4.206  24.644
  217   2HB   GLU  31          2HB       GLU  31  -8.154   5.615  25.543
  218   1HG   GLU  31          1HG       GLU  31  -9.866   7.052  24.451
  219   2HG   GLU  31          2HG       GLU  31 -10.516   5.647  23.604
  220    H    GLU  32           H        GLU  32  -6.465   3.738  22.340
  221    HA   GLU  32           HA       GLU  32  -4.107   3.480  23.916
  222   1HB   GLU  32          1HB       GLU  32  -4.958   1.823  22.244
  223   2HB   GLU  32          2HB       GLU  32  -4.537   2.948  20.937
  224   1HG   GLU  32          1HG       GLU  32  -2.137   2.799  21.608
  225   2HG   GLU  32          2HG       GLU  32  -2.584   1.688  22.914
  226    H    ASP  33           H        ASP  33  -5.052   5.684  21.370
  227    HA   ASP  33           HA       ASP  33  -4.123   7.335  20.241
  228   1HB   ASP  33          1HB       ASP  33  -4.349   8.233  22.585
  229   2HB   ASP  33          2HB       ASP  33  -2.629   7.896  22.833
  230    H    ASP  34           H        ASP  34  -2.951   5.084  19.520
  231    HA   ASP  34           HA       ASP  34  -0.013   5.291  19.476
  232   1HB   ASP  34          1HB       ASP  34  -0.936   3.078  19.360
  233   2HB   ASP  34          2HB       ASP  34  -2.053   3.516  18.060
  234    H    GLU  35           H        GLU  35  -2.731   5.604  17.193
  235    HA   GLU  35           HA       GLU  35  -2.880   6.472  15.097
  236   1HB   GLU  35          1HB       GLU  35  -1.632   8.846  16.532
  237   2HB   GLU  35          2HB       GLU  35  -2.637   8.892  15.073
  238   1HG   GLU  35          1HG       GLU  35  -4.494   7.792  16.403
  239   2HG   GLU  35          2HG       GLU  35  -3.516   8.021  17.865
  240    H    GLU  36           H        GLU  36  -0.639   4.856  15.129
  241    HA   GLU  36           HA       GLU  36   1.184   4.317  13.917
  242   1HB   GLU  36          1HB       GLU  36  -0.086   6.204  11.908
  243   2HB   GLU  36          2HB       GLU  36   1.085   4.928  11.589
  244   1HG   GLU  36          1HG       GLU  36  -1.007   4.011  11.003
  245   2HG   GLU  36          2HG       GLU  36  -0.544   3.236  12.522
  246    HA   PRO  37           HA       PRO  37   3.758   7.944  15.262
  247   1HB   PRO  37          1HB       PRO  37   5.522   5.524  15.740
  248   2HB   PRO  37          2HB       PRO  37   5.421   7.039  16.686
  249   1HG   PRO  37          1HG       PRO  37   4.110   4.839  17.557
  250   2HG   PRO  37          2HG       PRO  37   3.245   6.407  17.535
  251   1HD   PRO  37          1HD       PRO  37   3.107   4.179  15.485
  252   2HD   PRO  37          2HD       PRO  37   1.780   5.100  16.244
  253    H    ASN  38           H        ASN  38   4.269   8.919  13.357
  254    HA   ASN  38           HA       ASN  38   5.011   7.699  10.973
  255   1HB   ASN  38          1HB       ASN  38   5.305  10.536  12.005
  256   2HB   ASN  38          2HB       ASN  38   5.780  10.116  10.374
  257   1HD2  ASN  38          2HD2      ASN  38   3.956   8.621   9.178
  258   2HD2  ASN  38          1HD2      ASN  38   2.319   9.168   9.417
  259    H    VAL  39           H        VAL  39   7.370   8.478  13.493
  260    HA   VAL  39           HA       VAL  39   9.622   8.561  11.822
  261    HB   VAL  39           HB       VAL  39   9.422   7.433  14.640
  262   1HG1  VAL  39          1HG1      VAL  39  11.869   8.134  12.958
  263   2HG1  VAL  39          2HG1      VAL  39  11.879   7.764  14.695
  264   3HG1  VAL  39          3HG1      VAL  39  11.434   6.510  13.531
  265   1HG2  VAL  39          1HG2      VAL  39  10.338  10.115  13.540
  266   2HG2  VAL  39          2HG2      VAL  39   8.832   9.815  14.433
  267   3HG2  VAL  39          3HG2      VAL  39  10.391   9.603  15.237
  268    HA   PRO  40           HA       PRO  40   9.661   3.872  11.189
  269   1HB   PRO  40          1HB       PRO  40   7.837   2.208  12.367
  270   2HB   PRO  40          2HB       PRO  40   9.388   2.669  13.126
  271   1HG   PRO  40          1HG       PRO  40   6.675   3.933  13.575
  272   2HG   PRO  40          2HG       PRO  40   7.822   3.359  14.818
  273   1HD   PRO  40          1HD       PRO  40   7.792   5.969  14.179
  274   2HD   PRO  40          2HD       PRO  40   9.341   5.122  14.362
  275    H    CYS  41           H        CYS  41   6.257   5.041  11.805
  276    HA   CYS  41           HA       CYS  41   5.063   3.400   9.878
  277   1HB   CYS  41          1HB       CYS  41   3.394   4.228  11.130
  278   2HB   CYS  41          2HB       CYS  41   4.238   5.721  11.446
  279    H    LEU  42           H        LEU  42   6.637   6.540   9.261
  280    HA   LEU  42           HA       LEU  42   5.648   6.902   6.600
  281   1HB   LEU  42          1HB       LEU  42   8.220   7.741   7.966
  282   2HB   LEU  42          2HB       LEU  42   7.812   8.236   6.329
  283    HG   LEU  42           HG       LEU  42   5.971   8.785   8.662
  284   1HD1  LEU  42          1HD1      LEU  42   8.173  10.526   7.463
  285   2HD1  LEU  42          2HD1      LEU  42   6.966  11.097   8.631
  286   3HD1  LEU  42          3HD1      LEU  42   8.139   9.851   9.107
  287   1HD2  LEU  42          1HD2      LEU  42   6.140   9.995   5.882
  288   2HD2  LEU  42          2HD2      LEU  42   4.845   8.949   6.506
  289   3HD2  LEU  42          3HD2      LEU  42   5.081  10.558   7.190
  290    H    VAL  43           H        VAL  43   7.859   4.633   7.910
  291    HA   VAL  43           HA       VAL  43   9.080   2.966   7.035
  292    HB   VAL  43           HB       VAL  43   8.096   3.624   4.222
  293   1HG1  VAL  43          1HG1      VAL  43   9.095   1.043   5.485
  294   2HG1  VAL  43          2HG1      VAL  43   8.476   1.235   3.831
  295   3HG1  VAL  43          3HG1      VAL  43   9.968   2.042   4.302
  296   1HG2  VAL  43          1HG2      VAL  43   6.787   1.875   6.355
  297   2HG2  VAL  43          2HG2      VAL  43   6.085   3.315   5.589
  298   3HG2  VAL  43          3HG2      VAL  43   6.360   1.870   4.628
  299    H    ARG  44           H        ARG  44  11.236   2.724   6.331
  300    HA   ARG  44           HA       ARG  44  12.763   5.088   6.173
  301   1HB   ARG  44          1HB       ARG  44  14.671   3.652   5.665
  302   2HB   ARG  44          2HB       ARG  44  13.699   3.056   7.015
  303   1HG   ARG  44          1HG       ARG  44  12.622   1.386   5.442
  304   2HG   ARG  44          2HG       ARG  44  13.737   1.947   4.176
  305   1HD   ARG  44          1HD       ARG  44  15.662   1.318   5.573
  306   2HD   ARG  44          2HD       ARG  44  14.551   0.741   6.843
  307    HE   ARG  44           HE       ARG  44  13.862  -0.529   4.404
  308   1HH1  ARG  44          1HH1      ARG  44  16.503  -0.491   6.744
  309   2HH1  ARG  44          2HH1      ARG  44  17.000  -2.132   6.433
  310   1HH2  ARG  44          1HH2      ARG  44  14.495  -2.676   3.977
  311   2HH2  ARG  44          2HH2      ARG  44  15.833  -3.396   4.825
  312    H    VAL  45           H        VAL  45  11.737   2.902   3.525
  313    HA   VAL  45           HA       VAL  45  12.893   4.657   1.476
  314    HB   VAL  45           HB       VAL  45  11.754   3.078  -0.102
  315   1HG1  VAL  45          1HG1      VAL  45  14.116   2.860   0.507
  316   2HG1  VAL  45          2HG1      VAL  45  13.681   1.833   1.888
  317   3HG1  VAL  45          3HG1      VAL  45  13.361   1.280   0.235
  318   1HG2  VAL  45          1HG2      VAL  45   9.978   2.223   1.508
  319   2HG2  VAL  45          2HG2      VAL  45  10.888   0.972   0.649
  320   3HG2  VAL  45          3HG2      VAL  45  11.262   1.318   2.341
  321    H    CYS  46           H        CYS  46  11.525   6.401   2.780
  322    HA   CYS  46           HA       CYS  46   8.782   6.681   1.799
  323   1HB   CYS  46          1HB       CYS  46  10.056   7.735   3.937
  324   2HB   CYS  46          2HB       CYS  46  10.225   9.089   2.833
  325    H    HIS  47           H        HIS  47   9.631   6.131  -0.432
  326    HA   HIS  47           HA       HIS  47  11.221   8.191  -1.780
  327   1HB   HIS  47          1HB       HIS  47  11.221   6.570  -3.644
  328   2HB   HIS  47          2HB       HIS  47  11.809   5.916  -2.113
  329    HD1  HIS  47           HD1      HIS  47   8.040   6.042  -2.889
  330    HD2  HIS  47           HD2      HIS  47  11.291   3.374  -2.726
  331    HE1  HIS  47           HE1      HIS  47   7.069   3.690  -3.123
  332    H    GLN  48           H        GLN  48  10.621   9.432  -3.467
  333    HA   GLN  48           HA       GLN  48   8.389  10.705  -4.123
  334   1HB   GLN  48          1HB       GLN  48   9.106  10.668  -6.501
  335   2HB   GLN  48          2HB       GLN  48  10.369  11.076  -5.348
  336   1HG   GLN  48          1HG       GLN  48  11.685   9.426  -6.087
  337   2HG   GLN  48          2HG       GLN  48  10.463   8.197  -5.762
  338   1HE2  GLN  48          2HE2      GLN  48   8.696   7.972  -7.405
  339   2HE2  GLN  48          1HE2      GLN  48   9.128   8.211  -9.102
  340    H    ASP  49           H        ASP  49   6.300  10.090  -4.001
  341    HA   ASP  49           HA       ASP  49   5.217   8.227  -5.912
  342   1HB   ASP  49          1HB       ASP  49   6.400   6.748  -4.145
  343   2HB   ASP  49          2HB       ASP  49   5.181   7.319  -3.021
  344    H    CYS  50           H        CYS  50   2.922   7.702  -3.807
  345    HA   CYS  50           HA       CYS  50   1.905  10.500  -3.773
  346   1HB   CYS  50          1HB       CYS  50  -0.115   9.903  -4.754
  347   2HB   CYS  50          2HB       CYS  50   1.137   9.153  -5.730
  348    H    VAL  51           H        VAL  51   0.811  11.197  -2.168
  349    HA   VAL  51           HA       VAL  51   0.242   9.448   0.173
  350    HB   VAL  51           HB       VAL  51   0.541  11.480   1.571
  351   1HG1  VAL  51          1HG1      VAL  51   2.314   9.818   1.372
  352   2HG1  VAL  51          2HG1      VAL  51   2.978  10.642  -0.047
  353   3HG1  VAL  51          3HG1      VAL  51   2.994  11.443   1.536
  354   1HG2  VAL  51          1HG2      VAL  51   1.579  12.733  -1.013
  355   2HG2  VAL  51          2HG2      VAL  51   0.253  13.342  -0.048
  356   3HG2  VAL  51          3HG2      VAL  51   1.877  13.379   0.618
  357    H    CYS  52           H        CYS  52  -1.180  12.365   0.818
  358    HA   CYS  52           HA       CYS  52  -3.394  12.137  -1.064
  359   1HB   CYS  52          1HB       CYS  52  -3.731  11.669   1.903
  360   2HB   CYS  52          2HB       CYS  52  -5.027  12.324   0.893
  361    H    GLU  53           H        GLU  53  -4.853  13.862  -0.976
  362    HA   GLU  53           HA       GLU  53  -3.574  16.192  -1.462
  363   1HB   GLU  53          1HB       GLU  53  -6.031  15.388  -1.917
  364   2HB   GLU  53          2HB       GLU  53  -6.423  16.277  -0.441
  365   1HG   GLU  53          1HG       GLU  53  -5.563  18.351  -1.422
  366   2HG   GLU  53          2HG       GLU  53  -4.983  17.469  -2.844
  367    H    GLU  54           H        GLU  54  -3.411  18.235  -0.540
  368    HA   GLU  54           HA       GLU  54  -2.409  18.311   2.093
  369   1HB   GLU  54          1HB       GLU  54  -3.193  20.668   0.326
  370   2HB   GLU  54          2HB       GLU  54  -2.077  20.658   1.691
  371   1HG   GLU  54          1HG       GLU  54  -0.524  20.478   0.043
  372   2HG   GLU  54          2HG       GLU  54  -0.852  18.754   0.202
  373    H    GLY  55           H        GLY  55  -4.301  17.379   3.176
  374   1HA   GLY  55          1HA       GLY  55  -5.463  18.555   5.170
  375   2HA   GLY  55          2HA       GLY  55  -6.433  19.351   3.924
  376    H    PHE  56           H        PHE  56  -5.752  16.290   2.675
  377    HA   PHE  56           HA       PHE  56  -8.311  15.175   3.692
  378   1HB   PHE  56          1HB       PHE  56  -6.608  14.531   1.263
  379   2HB   PHE  56          2HB       PHE  56  -7.960  13.560   1.825
  380    HD1  PHE  56           HD1      PHE  56  -8.481  17.246   1.986
  381    HD2  PHE  56           HD2      PHE  56  -8.785  13.717  -0.488
  382    HE1  PHE  56           HE1      PHE  56  -9.794  18.502   0.342
  383    HE2  PHE  56           HE2      PHE  56 -10.161  14.989  -2.101
  384    HZ   PHE  56           HZ       PHE  56 -10.665  17.384  -1.693
  385    H    TYR  57           H        TYR  57  -8.251  13.180   4.745
  386    HA   TYR  57           HA       TYR  57  -5.533  12.103   5.400
  387   1HB   TYR  57          1HB       TYR  57  -7.842  12.676   7.300
  388   2HB   TYR  57          2HB       TYR  57  -6.403  11.744   7.704
  389    HD1  TYR  57           HD1      TYR  57  -7.562  15.146   6.645
  390    HD2  TYR  57           HD2      TYR  57  -4.353  12.815   8.328
  391    HE1  TYR  57           HE1      TYR  57  -6.296  17.216   7.071
  392    HE2  TYR  57           HE2      TYR  57  -3.053  14.895   8.710
  393    HH   TYR  57           HH       TYR  57  -4.323  18.127   7.877
  394    H    ARG  58           H        ARG  58  -5.418   9.878   5.532
  395    HA   ARG  58           HA       ARG  58  -7.519   8.497   4.072
  396   1HB   ARG  58          1HB       ARG  58  -6.268   6.507   4.383
  397   2HB   ARG  58          2HB       ARG  58  -5.309   7.746   3.610
  398   1HG   ARG  58          1HG       ARG  58  -3.899   8.040   5.430
  399   2HG   ARG  58          2HG       ARG  58  -4.971   7.254   6.576
  400   1HD   ARG  58          1HD       ARG  58  -3.113   6.075   4.554
  401   2HD   ARG  58          2HD       ARG  58  -3.298   5.669   6.261
  402    HE   ARG  58           HE       ARG  58  -4.325   4.277   4.105
  403   1HH1  ARG  58          1HH1      ARG  58  -6.199   5.737   6.822
  404   2HH1  ARG  58          2HH1      ARG  58  -7.156   4.291   6.962
  405   1HH2  ARG  58          1HH2      ARG  58  -5.711   2.496   4.388
  406   2HH2  ARG  58          2HH2      ARG  58  -6.948   2.587   5.634
  407    H    ASN  59           H        ASN  59  -9.402   8.785   5.263
  408    HA   ASN  59           HA       ASN  59  -9.606   7.789   7.980
  409   1HB   ASN  59          1HB       ASN  59 -11.097   9.547   6.951
  410   2HB   ASN  59          2HB       ASN  59 -11.836   8.262   5.976
  411   1HD2  ASN  59          2HD2      ASN  59 -13.815   9.239   7.235
  412   2HD2  ASN  59          1HD2      ASN  59 -14.150   8.344   8.728
  413    H    LYS  60           H        LYS  60  -9.869   5.717   8.622
  414    HA   LYS  60           HA       LYS  60  -9.721   3.460   8.448
  415   1HB   LYS  60          1HB       LYS  60 -12.010   2.511   7.761
  416   2HB   LYS  60          2HB       LYS  60 -11.890   3.623   9.117
  417   1HG   LYS  60          1HG       LYS  60 -12.788   5.445   7.926
  418   2HG   LYS  60          2HG       LYS  60 -12.702   4.629   6.359
  419   1HD   LYS  60          1HD       LYS  60 -14.419   3.036   7.068
  420   2HD   LYS  60          2HD       LYS  60 -14.356   3.662   8.727
  421   1HE   LYS  60          1HE       LYS  60 -16.330   4.531   7.553
  422   2HE   LYS  60          2HE       LYS  60 -15.226   5.834   8.013
  423   1HZ   LYS  60          1HZ       LYS  60 -15.407   4.630   5.343
  424   2HZ   LYS  60          2HZ       LYS  60 -16.047   6.081   5.792
  425   3HZ   LYS  60          3HZ       LYS  60 -14.414   5.874   5.782
  426    H    ASP  61           H        ASP  61 -11.716   3.071   5.657
  427    HA   ASP  61           HA       ASP  61  -9.710   1.341   4.478
  428   1HB   ASP  61          1HB       ASP  61 -12.482   2.132   3.498
  429   2HB   ASP  61          2HB       ASP  61 -11.499   0.792   2.895
  430    H    ASP  62           H        ASP  62  -8.338   3.465   4.339
  431    HA   ASP  62           HA       ASP  62  -7.410   5.187   3.208
  432   1HB   ASP  62          1HB       ASP  62  -7.785   3.151   1.003
  433   2HB   ASP  62          2HB       ASP  62  -6.953   4.679   0.717
  434    H    LYS  63           H        LYS  63 -10.154   5.696   3.719
  435    HA   LYS  63           HA       LYS  63 -11.172   7.046   1.293
  436   1HB   LYS  63          1HB       LYS  63 -12.183   7.119   4.150
  437   2HB   LYS  63          2HB       LYS  63 -12.999   7.760   2.727
  438   1HG   LYS  63          1HG       LYS  63 -12.336   4.817   3.233
  439   2HG   LYS  63          2HG       LYS  63 -13.898   5.597   3.506
  440   1HD   LYS  63          1HD       LYS  63 -14.081   6.139   1.096
  441   2HD   LYS  63          2HD       LYS  63 -12.505   5.380   0.800
  442   1HE   LYS  63          1HE       LYS  63 -14.287   3.857   0.171
  443   2HE   LYS  63          2HE       LYS  63 -13.327   3.201   1.501
  444   1HZ   LYS  63          1HZ       LYS  63 -15.935   4.541   1.772
  445   2HZ   LYS  63          2HZ       LYS  63 -15.682   2.913   1.823
  446   3HZ   LYS  63          3HZ       LYS  63 -15.058   3.877   3.002
  447    H    CYS  64           H        CYS  64  -9.171   8.159   0.952
  448    HA   CYS  64           HA       CYS  64  -8.398  10.331   2.728
  449   1HB   CYS  64          1HB       CYS  64  -7.692   9.763  -0.153
  450   2HB   CYS  64          2HB       CYS  64  -7.276  11.253   0.684
  451    H    VAL  65           H        VAL  65 -10.261  11.346   3.294
  452    HA   VAL  65           HA       VAL  65 -11.132  13.394   1.319
  453    HB   VAL  65           HB       VAL  65 -13.363  13.378   2.566
  454   1HG1  VAL  65          1HG1      VAL  65 -13.113  12.586   0.245
  455   2HG1  VAL  65          2HG1      VAL  65 -12.692  10.963   0.831
  456   3HG1  VAL  65          3HG1      VAL  65 -14.310  11.626   1.132
  457   1HG2  VAL  65          1HG2      VAL  65 -12.550  11.822   4.432
  458   2HG2  VAL  65          2HG2      VAL  65 -14.098  11.388   3.667
  459   3HG2  VAL  65          3HG2      VAL  65 -12.629  10.501   3.253
  460    H    SER  66           H        SER  66 -12.006  15.328   2.544
  461    HA   SER  66           HA       SER  66 -10.021  16.562   3.857
  462   1HB   SER  66          1HB       SER  66 -12.952  17.132   4.347
  463   2HB   SER  66          2HB       SER  66 -11.615  18.291   4.199
  464    HG   SER  66           HG       SER  66 -11.400  17.499   1.988
  465    H    ALA  67           H        ALA  67  -9.313  16.866   5.932
  466    HA   ALA  67           HA       ALA  67  -9.407  15.296   8.086
  467   1HB   ALA  67          1HB       ALA  67  -8.226  17.524   7.934
  468   2HB   ALA  67          2HB       ALA  67  -9.746  18.330   8.308
  469   3HB   ALA  67          3HB       ALA  67  -9.001  17.247   9.501
  470    H    GLU  68           H        GLU  68 -11.810  17.746   7.482
  471    HA   GLU  68           HA       GLU  68 -13.558  17.702   9.548
  472   1HB   GLU  68          1HB       GLU  68 -14.448  17.611   6.631
  473   2HB   GLU  68          2HB       GLU  68 -15.232  18.419   7.994
  474   1HG   GLU  68          1HG       GLU  68 -13.140  19.885   8.194
  475   2HG   GLU  68          2HG       GLU  68 -12.561  19.202   6.671
  476    H    ASP  69           H        ASP  69 -13.626  15.306   6.840
  477    HA   ASP  69           HA       ASP  69 -15.926  13.864   7.843
  478   1HB   ASP  69          1HB       ASP  69 -15.335  13.684   5.497
  479   2HB   ASP  69          2HB       ASP  69 -13.711  13.107   5.901
  480    H    CYS  70           H        CYS  70 -12.418  13.225   7.882
  481    HA   CYS  70           HA       CYS  70 -12.322  10.835   9.361
  482   1HB   CYS  70          1HB       CYS  70 -10.281  11.572   8.440
  483   2HB   CYS  70          2HB       CYS  70 -10.472  13.206   9.057
  484    H    GLU  71           H        GLU  71 -12.312  14.194  10.565
  485    HA   GLU  71           HA       GLU  71 -12.260  13.533  13.313
  486   1HB   GLU  71          1HB       GLU  71 -13.177  16.035  11.845
  487   2HB   GLU  71          2HB       GLU  71 -13.061  15.921  13.610
  488   1HG   GLU  71          1HG       GLU  71 -10.670  15.453  13.493
  489   2HG   GLU  71          2HG       GLU  71 -10.706  15.391  11.733
  490    H    LEU  72           H        LEU  72 -15.082  14.645  11.338
  491    HA   LEU  72           HA       LEU  72 -16.997  14.328  13.367
  492   1HB   LEU  72          1HB       LEU  72 -17.067  14.350  10.363
  493   2HB   LEU  72          2HB       LEU  72 -18.481  13.718  11.183
  494    HG   LEU  72           HG       LEU  72 -18.638  16.115  10.601
  495   1HD1  LEU  72          1HD1      LEU  72 -20.029  15.075  12.376
  496   2HD1  LEU  72          2HD1      LEU  72 -18.845  15.599  13.593
  497   3HD1  LEU  72          3HD1      LEU  72 -19.728  16.799  12.642
  498   1HD2  LEU  72          1HD2      LEU  72 -16.357  16.890  11.082
  499   2HD2  LEU  72          2HD2      LEU  72 -17.551  17.812  11.996
  500   3HD2  LEU  72          3HD2      LEU  72 -16.589  16.573  12.816
  501    H    ASP  73           H        ASP  73 -15.822  11.892  11.030
  502    HA   ASP  73           HA       ASP  73 -17.627   9.835  11.665
  503   1HB   ASP  73          1HB       ASP  73 -16.180   9.941   9.670
  504   2HB   ASP  73          2HB       ASP  73 -14.746   9.720  10.688
  505    H    ASN  74           H        ASN  74 -14.858  10.997  13.515
  506    HA   ASN  74           HA       ASN  74 -14.437   8.562  15.023
  507   1HB   ASN  74          1HB       ASN  74 -12.737  10.355  14.761
  508   2HB   ASN  74          2HB       ASN  74 -13.797  11.443  15.676
  509   1HD2  ASN  74          2HD2      ASN  74 -12.246   8.191  16.045
  510   2HD2  ASN  74          1HD2      ASN  74 -11.709   8.512  17.682
  511    H    MET  75           H        MET  75 -16.805  11.135  15.204
  512    HA   MET  75           HA       MET  75 -18.653  11.412  16.383
  513   1HB   MET  75          1HB       MET  75 -18.135   8.810  17.872
  514   2HB   MET  75          2HB       MET  75 -19.648   9.686  17.714
  515   1HG   MET  75          1HG       MET  75 -18.123   8.230  15.529
  516   2HG   MET  75          2HG       MET  75 -19.679   7.801  16.216
  517   1HE   MET  75          1HE       MET  75 -21.921   9.163  15.783
  518   2HE   MET  75          2HE       MET  75 -21.166  10.718  16.224
  519   3HE   MET  75          3HE       MET  75 -22.027  10.555  14.679
  520    H    ASP  76           H        ASP  76 -16.111  10.186  18.563
  521    HA   ASP  76           HA       ASP  76 -16.773  11.977  20.753
  522   1HB   ASP  76          1HB       ASP  76 -15.518   9.890  21.056
  523   2HB   ASP  76          2HB       ASP  76 -14.233  10.495  20.005
  524    H    PHE  77           H        PHE  77 -14.554  12.031  18.010
  525    HA   PHE  77           HA       PHE  77 -13.859  13.745  16.708
  526   1HB   PHE  77          1HB       PHE  77 -14.628  15.818  18.753
  527   2HB   PHE  77          2HB       PHE  77 -14.288  16.039  17.051
  528    HD1  PHE  77           HD1      PHE  77 -15.957  13.912  15.751
  529    HD2  PHE  77           HD2      PHE  77 -16.851  16.509  19.080
  530    HE1  PHE  77           HE1      PHE  77 -18.375  13.723  15.263
  531    HE2  PHE  77           HE2      PHE  77 -19.259  16.367  18.533
  532    HZ   PHE  77           HZ       PHE  77 -20.025  14.978  16.621
  533    H    ILE  78           H        ILE  78 -12.331  12.229  18.419
  534    HA   ILE  78           HA       ILE  78 -10.183  11.933  18.860
  535    HB   ILE  78           HB       ILE  78  -9.814  14.561  17.354
  536   1HG1  ILE  78          1HG1      ILE  78  -8.917  12.900  15.651
  537   2HG1  ILE  78          2HG1      ILE  78  -9.662  11.612  16.599
  538   1HG2  ILE  78          1HG2      ILE  78  -7.799  14.067  18.800
  539   2HG2  ILE  78          2HG2      ILE  78  -7.695  12.483  17.996
  540   3HG2  ILE  78          3HG2      ILE  78  -7.499  13.977  17.073
  541   1HD1  ILE  78          1HD1      ILE  78 -11.122  13.979  15.350
  542   2HD1  ILE  78          2HD1      ILE  78 -10.920  12.373  14.600
  543   3HD1  ILE  78          3HD1      ILE  78 -11.870  12.537  16.072
  544    H    TYR  79           H        TYR  79 -10.377  15.449  19.304
  545    HA   TYR  79           HA       TYR  79  -8.345  15.579  21.156
  546   1HB   TYR  79          1HB       TYR  79 -10.549  17.644  21.094
  547   2HB   TYR  79          2HB       TYR  79  -8.860  17.837  21.508
  548    HD1  TYR  79           HD1      TYR  79  -7.119  17.184  19.608
  549    HD2  TYR  79           HD2      TYR  79 -11.282  18.035  18.868
  550    HE1  TYR  79           HE1      TYR  79  -6.668  17.312  17.172
  551    HE2  TYR  79           HE2      TYR  79 -10.827  18.159  16.444
  552    HH   TYR  79           HH       TYR  79  -9.250  17.915  14.772
  553    HA   PRO  80           HA       PRO  80 -11.444  15.580  24.812
  554   1HB   PRO  80          1HB       PRO  80 -13.519  13.677  23.762
  555   2HB   PRO  80          2HB       PRO  80 -13.702  15.004  24.937
  556   1HG   PRO  80          1HG       PRO  80 -14.471  15.384  22.352
  557   2HG   PRO  80          2HG       PRO  80 -13.536  16.657  23.193
  558   1HD   PRO  80          1HD       PRO  80 -12.489  14.533  21.304
  559   2HD   PRO  80          2HD       PRO  80 -12.201  16.284  21.277
  560    H    GLY  81           H        GLY  81 -10.348  12.866  22.877
  561   1HA   GLY  81          1HA       GLY  81 -10.316  10.802  24.828
  562   2HA   GLY  81          2HA       GLY  81  -9.087  11.080  23.581
  563    H    THR  82           H        THR  82  -8.498  13.807  24.499
  564    HA   THR  82           HA       THR  82  -6.673  13.390  26.707
  565    HB   THR  82           HB       THR  82  -7.559  16.080  25.586
  566    HG1  THR  82           HG1      THR  82  -7.198  14.988  23.776
  567   1HG2  THR  82          1HG2      THR  82  -5.912  16.032  27.463
  568   2HG2  THR  82          2HG2      THR  82  -4.852  14.988  26.484
  569   3HG2  THR  82          3HG2      THR  82  -5.201  16.648  25.959
  570    H    ARG  83           H        ARG  83  -8.809  12.494  27.817
  571    HA   ARG  83           HA       ARG  83 -10.128  12.530  29.552
  572   1HB   ARG  83          1HB       ARG  83  -8.377  13.760  30.703
  573   2HB   ARG  83          2HB       ARG  83  -9.037  15.302  30.163
  574   1HG   ARG  83          1HG       ARG  83  -9.534  14.893  32.484
  575   2HG   ARG  83          2HG       ARG  83 -11.018  15.031  31.545
  576   1HD   ARG  83          1HD       ARG  83  -9.762  12.363  32.330
  577   2HD   ARG  83          2HD       ARG  83 -10.967  13.206  33.329
  578    HE   ARG  83           HE       ARG  83 -12.179  13.173  30.902
  579   1HH1  ARG  83          1HH1      ARG  83 -10.945  10.517  32.880
  580   2HH1  ARG  83          2HH1      ARG  83 -11.656   9.288  31.867
  581   1HH2  ARG  83          1HH2      ARG  83 -12.933  11.701  29.570
  582   2HH2  ARG  83          2HH2      ARG  83 -12.925   9.983  29.938
  583    H    ASN  84           H        ASN  84 -10.412  15.768  28.023
  584    HA   ASN  84           HA       ASN  84 -13.271  15.430  27.610
  585   1HB   ASN  84          1HB       ASN  84 -13.468  15.898  29.933
  586   2HB   ASN  84          2HB       ASN  84 -12.328  17.238  29.853
  587   1HD2  ASN  84          2HD2      ASN  84 -15.529  16.145  28.581
  588   2HD2  ASN  84          1HD2      ASN  84 -16.178  17.770  28.439
  589    HA   PRO  85           HA       PRO  85 -12.080  19.595  25.646
  590   1HB   PRO  85          1HB       PRO  85  -9.493  20.529  25.788
  591   2HB   PRO  85          2HB       PRO  85 -10.770  20.957  26.962
  592   1HG   PRO  85          1HG       PRO  85  -8.671  18.782  27.237
  593   2HG   PRO  85          2HG       PRO  85  -9.099  20.049  28.425
  594   1HD   PRO  85          1HD       PRO  85 -10.135  17.580  28.635
  595   2HD   PRO  85          2HD       PRO  85 -11.187  18.996  28.903
  Start of MODEL    3
    1   1H    LYS   1          1H        LYS   1   7.517   1.624  -4.720
    2   2H    LYS   1          2H        LYS   1   8.455   0.915  -5.870
    3   3H    LYS   1          3H        LYS   1   9.145   1.859  -4.705
    4    HA   LYS   1           HA       LYS   1   8.023   3.782  -5.521
    5   1HB   LYS   1          1HB       LYS   1   9.186   3.907  -7.783
    6   2HB   LYS   1          2HB       LYS   1  10.172   3.654  -6.337
    7   1HG   LYS   1          1HG       LYS   1  10.530   1.333  -6.857
    8   2HG   LYS   1          2HG       LYS   1   9.285   1.347  -8.108
    9   1HD   LYS   1          1HD       LYS   1  11.540   1.397  -9.093
   10   2HD   LYS   1          2HD       LYS   1  10.574   2.806  -9.533
   11   1HE   LYS   1          1HE       LYS   1  12.918   3.404  -9.022
   12   2HE   LYS   1          2HE       LYS   1  11.787   4.221  -7.944
   13   1HZ   LYS   1          1HZ       LYS   1  13.322   1.793  -7.303
   14   2HZ   LYS   1          2HZ       LYS   1  13.661   3.317  -6.776
   15   3HZ   LYS   1          3HZ       LYS   1  12.281   2.565  -6.284
   16    H    ALA   2           H        ALA   2   5.780   3.688  -5.637
   17    HA   ALA   2           HA       ALA   2   4.463   2.161  -7.814
   18   1HB   ALA   2          1HB       ALA   2   3.485   2.080  -5.562
   19   2HB   ALA   2          2HB       ALA   2   3.297   3.843  -5.577
   20   3HB   ALA   2          3HB       ALA   2   2.391   2.845  -6.730
   21    H    THR   3           H        THR   3   5.922   3.581  -9.146
   22    HA   THR   3           HA       THR   3   6.404   5.515 -10.347
   23    HB   THR   3           HB       THR   3   4.857   5.500 -12.297
   24    HG1  THR   3           HG1      THR   3   3.434   3.584 -10.751
   25   1HG2  THR   3          1HG2      THR   3   6.678   3.828 -12.108
   26   2HG2  THR   3          2HG2      THR   3   5.584   2.719 -11.252
   27   3HG2  THR   3          3HG2      THR   3   5.253   3.173 -12.933
   28    H    MET   4           H        MET   4   3.015   6.076 -10.755
   29    HA   MET   4           HA       MET   4   2.965   8.475  -9.024
   30   1HB   MET   4          1HB       MET   4   2.178   8.492 -11.973
   31   2HB   MET   4          2HB       MET   4   1.806   9.766 -10.797
   32   1HG   MET   4          1HG       MET   4   4.212  10.181 -10.450
   33   2HG   MET   4          2HG       MET   4   4.615   8.867 -11.555
   34   1HE   MET   4          1HE       MET   4   3.123  12.493 -11.293
   35   2HE   MET   4          2HE       MET   4   2.765  12.841 -12.997
   36   3HE   MET   4          3HE       MET   4   1.791  11.644 -12.122
   37    H    GLN   5           H        GLN   5   2.047   6.412  -8.052
   38    HA   GLN   5           HA       GLN   5   0.072   4.901  -8.679
   39   1HB   GLN   5          1HB       GLN   5   1.352   5.011  -6.552
   40   2HB   GLN   5          2HB       GLN   5   0.201   6.153  -5.905
   41   1HG   GLN   5          1HG       GLN   5  -0.926   3.571  -6.972
   42   2HG   GLN   5          2HG       GLN   5   0.146   3.443  -5.583
   43   1HE2  GLN   5          2HE2      GLN   5  -2.865   5.011  -6.689
   44   2HE2  GLN   5          1HE2      GLN   5  -3.532   5.205  -5.068
   45    H    CYS   6           H        CYS   6  -0.748   8.311  -8.067
   46    HA   CYS   6           HA       CYS   6  -3.355   8.083  -9.105
   47   1HB   CYS   6          1HB       CYS   6  -4.756   8.323  -7.187
   48   2HB   CYS   6          2HB       CYS   6  -3.772   6.920  -6.859
   49    H    GLY   7           H        GLY   7  -4.592  10.244  -8.647
   50   1HA   GLY   7          1HA       GLY   7  -2.936  12.567  -7.948
   51   2HA   GLY   7          2HA       GLY   7  -3.178  12.311  -9.678
   52    H    GLU   8           H        GLU   8  -5.107  12.258  -6.660
   53    HA   GLU   8           HA       GLU   8  -7.027  14.222  -7.729
   54   1HB   GLU   8          1HB       GLU   8  -7.874  11.531  -6.543
   55   2HB   GLU   8          2HB       GLU   8  -8.950  12.871  -7.008
   56   1HG   GLU   8          1HG       GLU   8  -8.174  12.643  -9.367
   57   2HG   GLU   8          2HG       GLU   8  -7.225  11.222  -8.896
   58    H    ASN   9           H        ASN   9  -8.431  12.992  -5.032
   59    HA   ASN   9           HA       ASN   9  -7.442  14.970  -3.179
   60   1HB   ASN   9          1HB       ASN   9  -8.792  13.713  -1.533
   61   2HB   ASN   9          2HB       ASN   9  -9.724  14.148  -2.971
   62   1HD2  ASN   9          2HD2      ASN   9 -10.043  11.895  -0.910
   63   2HD2  ASN   9          1HD2      ASN   9 -10.173  10.454  -1.916
   64    H    GLU  10           H        GLU  10  -7.061  11.472  -3.647
   65    HA   GLU  10           HA       GLU  10  -4.678  11.334  -1.882
   66   1HB   GLU  10          1HB       GLU  10  -4.578   8.977  -2.783
   67   2HB   GLU  10          2HB       GLU  10  -5.997   9.335  -1.808
   68   1HG   GLU  10          1HG       GLU  10  -7.438   9.475  -3.738
   69   2HG   GLU  10          2HG       GLU  10  -6.073   9.348  -4.854
   70    H    LYS  11           H        LYS  11  -2.593  11.618  -2.826
   71    HA   LYS  11           HA       LYS  11  -2.489  12.073  -5.773
   72   1HB   LYS  11          1HB       LYS  11  -3.100  14.211  -4.662
   73   2HB   LYS  11          2HB       LYS  11  -1.695  14.043  -3.596
   74   1HG   LYS  11          1HG       LYS  11  -0.220  14.088  -5.632
   75   2HG   LYS  11          2HG       LYS  11  -1.645  14.403  -6.631
   76   1HD   LYS  11          1HD       LYS  11  -2.023  16.519  -5.519
   77   2HD   LYS  11          2HD       LYS  11  -0.824  16.160  -4.264
   78   1HE   LYS  11          1HE       LYS  11  -0.148  16.445  -7.230
   79   2HE   LYS  11          2HE       LYS  11   0.010  17.741  -6.033
   80   1HZ   LYS  11          1HZ       LYS  11   1.559  16.395  -4.831
   81   2HZ   LYS  11          2HZ       LYS  11   1.446  15.169  -5.920
   82   3HZ   LYS  11          3HZ       LYS  11   2.073  16.621  -6.378
   83    H    TYR  12           H        TYR  12  -0.619  11.408  -6.682
   84    HA   TYR  12           HA       TYR  12   1.454  10.066  -5.445
   85   1HB   TYR  12          1HB       TYR  12   1.434   9.844  -7.714
   86   2HB   TYR  12          2HB       TYR  12   1.117  11.548  -7.999
   87    HD1  TYR  12           HD1      TYR  12   3.911   9.438  -6.540
   88    HD2  TYR  12           HD2      TYR  12   2.778  12.888  -8.869
   89    HE1  TYR  12           HE1      TYR  12   6.241  10.285  -6.458
   90    HE2  TYR  12           HE2      TYR  12   5.142  13.603  -8.952
   91    HH   TYR  12           HH       TYR  12   7.586  12.248  -6.821
   92    H    ASP  13           H        ASP  13   3.226  10.562  -4.271
   93    HA   ASP  13           HA       ASP  13   4.550  13.128  -4.560
   94   1HB   ASP  13          1HB       ASP  13   3.061  13.654  -2.673
   95   2HB   ASP  13          2HB       ASP  13   3.550  12.148  -1.861
   96    H    SER  14           H        SER  14   6.749  12.964  -3.828
   97    HA   SER  14           HA       SER  14   7.886  10.378  -4.346
   98   1HB   SER  14          1HB       SER  14   9.201  12.941  -3.455
   99   2HB   SER  14          2HB       SER  14   9.980  11.545  -4.223
  100    HG   SER  14           HG       SER  14   9.383  13.245  -5.716
  101    H    CYS  15           H        CYS  15   6.341   9.918  -1.952
  102    HA   CYS  15           HA       CYS  15   8.502   9.108  -0.234
  103   1HB   CYS  15          1HB       CYS  15   8.228  11.598   0.340
  104   2HB   CYS  15          2HB       CYS  15   6.713  11.134   1.115
  105    H    GLY  16           H        GLY  16   7.110   7.210  -1.031
  106   1HA   GLY  16          1HA       GLY  16   6.268   5.301  -0.186
  107   2HA   GLY  16          2HA       GLY  16   6.387   6.007   1.430
  108    H    SER  17           H        SER  17   4.535   4.199   0.990
  109    HA   SER  17           HA       SER  17   2.060   4.941  -0.051
  110   1HB   SER  17          1HB       SER  17   2.588   2.913   2.162
  111   2HB   SER  17          2HB       SER  17   1.386   2.835   0.861
  112    HG   SER  17           HG       SER  17   3.213   2.725  -0.603
  113    H    LYS  18           H        LYS  18   1.721   7.115   0.838
  114    HA   LYS  18           HA       LYS  18   0.813   8.610   2.260
  115   1HB   LYS  18          1HB       LYS  18  -0.715   6.271   3.493
  116   2HB   LYS  18          2HB       LYS  18  -1.125   7.985   3.518
  117   1HG   LYS  18          1HG       LYS  18  -2.468   7.430   1.785
  118   2HG   LYS  18          2HG       LYS  18  -1.005   7.715   0.862
  119   1HD   LYS  18          1HD       LYS  18  -0.747   5.009   1.469
  120   2HD   LYS  18          2HD       LYS  18  -2.494   5.201   1.399
  121   1HE   LYS  18          1HE       LYS  18  -2.116   6.390  -0.880
  122   2HE   LYS  18          2HE       LYS  18  -0.438   5.844  -0.767
  123   1HZ   LYS  18          1HZ       LYS  18  -1.238   3.598  -0.676
  124   2HZ   LYS  18          2HZ       LYS  18  -2.799   4.114  -0.818
  125   3HZ   LYS  18          3HZ       LYS  18  -1.733   4.361  -2.050
  126    H    GLU  19           H        GLU  19   3.314   7.675   2.945
  127    HA   GLU  19           HA       GLU  19   3.958   6.678   5.384
  128   1HB   GLU  19          1HB       GLU  19   5.473   7.236   3.512
  129   2HB   GLU  19          2HB       GLU  19   5.413   8.942   3.989
  130   1HG   GLU  19          1HG       GLU  19   6.368   8.334   6.192
  131   2HG   GLU  19          2HG       GLU  19   6.397   6.625   5.729
  132    H    CYS  20           H        CYS  20   2.454   7.301   6.927
  133    HA   CYS  20           HA       CYS  20   1.214   8.516   8.313
  134   1HB   CYS  20          1HB       CYS  20   2.230   9.636  10.096
  135   2HB   CYS  20          2HB       CYS  20   3.225   8.251   9.719
  136    H    ASP  21           H        ASP  21   1.238   9.645   5.702
  137    HA   ASP  21           HA       ASP  21   1.459  12.561   6.050
  138   1HB   ASP  21          1HB       ASP  21   2.105  11.651   3.901
  139   2HB   ASP  21          2HB       ASP  21   0.499  10.915   3.694
  140    H    LYS  22           H        LYS  22  -0.070  13.533   7.188
  141    HA   LYS  22           HA       LYS  22  -2.019  13.925   8.289
  142   1HB   LYS  22          1HB       LYS  22  -3.125  13.668   5.462
  143   2HB   LYS  22          2HB       LYS  22  -3.899  14.496   6.820
  144   1HG   LYS  22          1HG       LYS  22  -1.371  15.341   5.377
  145   2HG   LYS  22          2HG       LYS  22  -2.952  16.130   5.425
  146   1HD   LYS  22          1HD       LYS  22  -2.544  16.223   8.045
  147   2HD   LYS  22          2HD       LYS  22  -0.853  15.934   7.610
  148   1HE   LYS  22          1HE       LYS  22  -1.079  18.285   7.793
  149   2HE   LYS  22          2HE       LYS  22  -1.059  17.975   6.049
  150   1HZ   LYS  22          1HZ       LYS  22  -3.471  18.365   7.704
  151   2HZ   LYS  22          2HZ       LYS  22  -2.779  19.510   6.740
  152   3HZ   LYS  22          3HZ       LYS  22  -3.447  18.169   6.062
  153    H    LYS  23           H        LYS  23  -1.479  11.623   9.082
  154    HA   LYS  23           HA       LYS  23  -3.660   9.702   8.667
  155   1HB   LYS  23          1HB       LYS  23  -2.614   8.787  10.914
  156   2HB   LYS  23          2HB       LYS  23  -1.957   8.460   9.325
  157   1HG   LYS  23          1HG       LYS  23  -0.138   8.892  10.793
  158   2HG   LYS  23          2HG       LYS  23  -0.226  10.122   9.558
  159   1HD   LYS  23          1HD       LYS  23   0.359  11.214  11.598
  160   2HD   LYS  23          2HD       LYS  23  -1.295  11.685  11.248
  161   1HE   LYS  23          1HE       LYS  23  -1.199  11.192  13.581
  162   2HE   LYS  23          2HE       LYS  23  -2.062   9.838  12.851
  163   1HZ   LYS  23          1HZ       LYS  23   0.070   8.637  12.876
  164   2HZ   LYS  23          2HZ       LYS  23   0.783   9.916  13.615
  165   3HZ   LYS  23          3HZ       LYS  23  -0.412   9.087  14.388
  166    H    CYS  24           H        CYS  24  -5.596   9.785   9.625
  167    HA   CYS  24           HA       CYS  24  -6.297  11.972  11.439
  168   1HB   CYS  24          1HB       CYS  24  -7.827  10.955   9.714
  169   2HB   CYS  24          2HB       CYS  24  -7.836   9.473  10.672
  170    H    LYS  25           H        LYS  25  -7.425  11.234  13.671
  171    HA   LYS  25           HA       LYS  25  -6.287   8.775  14.804
  172   1HB   LYS  25          1HB       LYS  25  -5.790  11.559  15.901
  173   2HB   LYS  25          2HB       LYS  25  -5.774  10.138  16.936
  174   1HG   LYS  25          1HG       LYS  25  -3.922  10.691  14.590
  175   2HG   LYS  25          2HG       LYS  25  -3.515  10.714  16.304
  176   1HD   LYS  25          1HD       LYS  25  -4.135   8.279  14.577
  177   2HD   LYS  25          2HD       LYS  25  -2.636   8.693  15.385
  178   1HE   LYS  25          1HE       LYS  25  -3.695   8.302  17.593
  179   2HE   LYS  25          2HE       LYS  25  -5.237   7.923  16.797
  180   1HZ   LYS  25          1HZ       LYS  25  -4.182   6.126  15.668
  181   2HZ   LYS  25          2HZ       LYS  25  -2.755   6.425  16.441
  182   3HZ   LYS  25          3HZ       LYS  25  -4.076   5.954  17.307
  183    H    TYR  26           H        TYR  26  -8.023   7.742  15.347
  184    HA   TYR  26           HA       TYR  26 -10.016   8.727  17.197
  185   1HB   TYR  26          1HB       TYR  26 -11.941   8.697  15.782
  186   2HB   TYR  26          2HB       TYR  26 -10.818   9.877  15.126
  187    HD1  TYR  26           HD1      TYR  26  -9.146   8.803  13.253
  188    HD2  TYR  26           HD2      TYR  26 -13.089   7.360  14.239
  189    HE1  TYR  26           HE1      TYR  26  -9.239   7.601  11.132
  190    HE2  TYR  26           HE2      TYR  26 -13.188   6.234  12.034
  191    HH   TYR  26           HH       TYR  26 -10.367   6.155   9.829
  192    H    ASP  27           H        ASP  27  -9.077   6.407  14.720
  193    HA   ASP  27           HA       ASP  27  -9.627   4.292  14.324
  194   1HB   ASP  27          1HB       ASP  27  -8.301   2.801  15.726
  195   2HB   ASP  27          2HB       ASP  27  -7.450   4.267  15.239
  196    H    GLY  28           H        GLY  28 -10.199   3.812  17.863
  197   1HA   GLY  28          1HA       GLY  28 -11.946   2.751  18.885
  198   2HA   GLY  28          2HA       GLY  28 -12.997   3.248  17.551
  199    H    VAL  29           H        VAL  29 -13.032   1.907  15.648
  200    HA   VAL  29           HA       VAL  29 -12.245  -0.956  16.050
  201    HB   VAL  29           HB       VAL  29 -14.423   0.173  14.242
  202   1HG1  VAL  29          1HG1      VAL  29 -13.655  -2.675  14.988
  203   2HG1  VAL  29          2HG1      VAL  29 -15.121  -2.210  14.100
  204   3HG1  VAL  29          3HG1      VAL  29 -13.535  -1.926  13.381
  205   1HG2  VAL  29          1HG2      VAL  29 -14.633  -1.219  16.948
  206   2HG2  VAL  29          2HG2      VAL  29 -15.086   0.463  16.596
  207   3HG2  VAL  29          3HG2      VAL  29 -15.997  -0.863  15.867
  208    H    GLU  30           H        GLU  30 -11.873   1.962  14.066
  209    HA   GLU  30           HA       GLU  30 -10.916   0.544  11.725
  210   1HB   GLU  30          1HB       GLU  30 -10.445   3.474  12.367
  211   2HB   GLU  30          2HB       GLU  30 -10.448   2.667  10.800
  212   1HG   GLU  30          1HG       GLU  30 -12.798   3.311  12.607
  213   2HG   GLU  30          2HG       GLU  30 -12.487   3.891  10.980
  214    H    GLU  31           H        GLU  31  -9.490  -0.858  12.934
  215    HA   GLU  31           HA       GLU  31  -7.260  -0.293  14.344
  216   1HB   GLU  31          1HB       GLU  31  -8.153  -2.558  13.706
  217   2HB   GLU  31          2HB       GLU  31  -7.376  -2.384  12.121
  218   1HG   GLU  31          1HG       GLU  31  -5.157  -2.223  13.258
  219   2HG   GLU  31          2HG       GLU  31  -5.980  -2.344  14.829
  220    H    GLU  32           H        GLU  32  -7.527  -0.029  10.847
  221    HA   GLU  32           HA       GLU  32  -4.891   0.405  10.073
  222   1HB   GLU  32          1HB       GLU  32  -7.387   1.774   9.020
  223   2HB   GLU  32          2HB       GLU  32  -5.830   1.688   8.188
  224   1HG   GLU  32          1HG       GLU  32  -5.994  -0.781   8.092
  225   2HG   GLU  32          2HG       GLU  32  -7.586  -0.718   8.866
  226    H    ASP  33           H        ASP  33  -6.881   2.479  11.985
  227    HA   ASP  33           HA       ASP  33  -5.283   4.916  11.423
  228   1HB   ASP  33          1HB       ASP  33  -7.746   4.978  11.279
  229   2HB   ASP  33          2HB       ASP  33  -7.853   4.491  12.971
  230    H    ASP  34           H        ASP  34  -4.984   2.299  13.537
  231    HA   ASP  34           HA       ASP  34  -3.212   3.985  15.152
  232   1HB   ASP  34          1HB       ASP  34  -3.832   3.151  17.290
  233   2HB   ASP  34          2HB       ASP  34  -5.174   4.010  16.538
  234    H    GLU  35           H        GLU  35  -4.261   0.527  15.095
  235    HA   GLU  35           HA       GLU  35  -1.428  -0.172  15.585
  236   1HB   GLU  35          1HB       GLU  35  -3.751  -2.085  15.256
  237   2HB   GLU  35          2HB       GLU  35  -2.171  -2.384  15.971
  238   1HG   GLU  35          1HG       GLU  35  -4.424  -0.671  17.103
  239   2HG   GLU  35          2HG       GLU  35  -3.763  -2.163  17.761
  240    H    GLU  36           H        GLU  36  -1.138   1.024  13.389
  241    HA   GLU  36           HA       GLU  36  -0.718  -1.079  11.358
  242   1HB   GLU  36          1HB       GLU  36  -2.823  -0.002  10.796
  243   2HB   GLU  36          2HB       GLU  36  -2.063   1.598  10.850
  244   1HG   GLU  36          1HG       GLU  36  -0.521   0.880   9.011
  245   2HG   GLU  36          2HG       GLU  36  -1.358  -0.682   8.950
  246    HA   PRO  37           HA       PRO  37   3.368   0.744  11.937
  247   1HB   PRO  37          1HB       PRO  37   3.493  -0.112   9.023
  248   2HB   PRO  37          2HB       PRO  37   4.793  -0.209  10.248
  249   1HG   PRO  37          1HG       PRO  37   3.310  -2.394   9.762
  250   2HG   PRO  37          2HG       PRO  37   3.604  -1.910  11.459
  251   1HD   PRO  37          1HD       PRO  37   1.121  -1.486   9.800
  252   2HD   PRO  37          2HD       PRO  37   1.291  -1.943  11.524
  253    H    ASN  38           H        ASN  38   1.434   1.726   9.075
  254    HA   ASN  38           HA       ASN  38   2.999   3.950   8.346
  255   1HB   ASN  38          1HB       ASN  38   1.122   3.029   6.973
  256   2HB   ASN  38          2HB       ASN  38  -0.033   3.716   8.135
  257   1HD2  ASN  38          2HD2      ASN  38  -0.858   5.733   7.356
  258   2HD2  ASN  38          1HD2      ASN  38   0.124   6.807   6.340
  259    H    VAL  39           H        VAL  39   0.582   3.621  10.943
  260    HA   VAL  39           HA       VAL  39  -0.002   6.377  11.159
  261    HB   VAL  39           HB       VAL  39  -0.335   4.151  13.191
  262   1HG1  VAL  39          1HG1      VAL  39  -1.484   6.980  13.141
  263   2HG1  VAL  39          2HG1      VAL  39  -1.963   5.691  14.254
  264   3HG1  VAL  39          3HG1      VAL  39  -0.328   6.356  14.344
  265   1HG2  VAL  39          1HG2      VAL  39  -1.576   3.910  11.022
  266   2HG2  VAL  39          2HG2      VAL  39  -2.616   4.144  12.422
  267   3HG2  VAL  39          3HG2      VAL  39  -2.315   5.495  11.311
  268    HA   PRO  40           HA       PRO  40   3.575   7.029  14.181
  269   1HB   PRO  40          1HB       PRO  40   5.152   5.069  15.170
  270   2HB   PRO  40          2HB       PRO  40   3.500   5.323  15.785
  271   1HG   PRO  40          1HG       PRO  40   4.350   3.357  13.629
  272   2HG   PRO  40          2HG       PRO  40   3.462   2.989  15.138
  273   1HD   PRO  40          1HD       PRO  40   2.158   3.431  12.806
  274   2HD   PRO  40          2HD       PRO  40   1.513   4.050  14.356
  275    H    CYS  41           H        CYS  41   3.548   6.679  11.257
  276    HA   CYS  41           HA       CYS  41   4.848   6.636   9.435
  277   1HB   CYS  41          1HB       CYS  41   5.546   8.691  11.203
  278   2HB   CYS  41          2HB       CYS  41   7.101   8.067  10.722
  279    H    LEU  42           H        LEU  42   5.294   4.136  10.845
  280    HA   LEU  42           HA       LEU  42   8.133   3.742  11.077
  281   1HB   LEU  42          1HB       LEU  42   5.946   2.476  12.081
  282   2HB   LEU  42          2HB       LEU  42   6.300   1.404  10.732
  283    HG   LEU  42           HG       LEU  42   7.269   0.552  12.730
  284   1HD1  LEU  42          1HD1      LEU  42   8.684   0.343  10.675
  285   2HD1  LEU  42          2HD1      LEU  42   9.618   1.758  11.227
  286   3HD1  LEU  42          3HD1      LEU  42   9.591   0.281  12.197
  287   1HD2  LEU  42          1HD2      LEU  42   7.323   2.651  14.037
  288   2HD2  LEU  42          2HD2      LEU  42   8.829   1.727  14.164
  289   3HD2  LEU  42          3HD2      LEU  42   8.766   3.173  13.146
  290    H    VAL  43           H        VAL  43   5.832   3.397   8.468
  291    HA   VAL  43           HA       VAL  43   7.411   1.656   6.810
  292    HB   VAL  43           HB       VAL  43   5.786   2.161   5.062
  293   1HG1  VAL  43          1HG1      VAL  43   5.324   0.484   6.848
  294   2HG1  VAL  43          2HG1      VAL  43   4.457   1.734   7.767
  295   3HG1  VAL  43          3HG1      VAL  43   3.852   1.211   6.186
  296   1HG2  VAL  43          1HG2      VAL  43   4.746   4.310   6.953
  297   2HG2  VAL  43          2HG2      VAL  43   5.150   4.452   5.236
  298   3HG2  VAL  43          3HG2      VAL  43   3.736   3.535   5.715
  299    H    ARG  44           H        ARG  44   9.429   2.927   7.251
  300    HA   ARG  44           HA       ARG  44   9.882   5.449   6.123
  301   1HB   ARG  44          1HB       ARG  44  11.214   3.965   7.883
  302   2HB   ARG  44          2HB       ARG  44  12.073   3.392   6.457
  303   1HG   ARG  44          1HG       ARG  44  13.461   5.121   6.942
  304   2HG   ARG  44          2HG       ARG  44  12.288   6.092   6.058
  305   1HD   ARG  44          1HD       ARG  44  12.528   5.685   9.073
  306   2HD   ARG  44          2HD       ARG  44  12.806   7.186   8.197
  307    HE   ARG  44           HE       ARG  44  10.295   6.099   9.144
  308   1HH1  ARG  44          1HH1      ARG  44  11.657   8.123   6.571
  309   2HH1  ARG  44          2HH1      ARG  44  10.101   8.809   6.145
  310   1HH2  ARG  44          1HH2      ARG  44   8.344   7.086   8.672
  311   2HH2  ARG  44          2HH2      ARG  44   8.246   8.354   7.460
  312    H    VAL  45           H        VAL  45   8.820   3.435   4.074
  313    HA   VAL  45           HA       VAL  45  10.993   3.238   2.080
  314    HB   VAL  45           HB       VAL  45   9.192   2.123   0.733
  315   1HG1  VAL  45          1HG1      VAL  45  10.898   0.864   1.961
  316   2HG1  VAL  45          2HG1      VAL  45   9.886   0.874   3.421
  317   3HG1  VAL  45          3HG1      VAL  45   9.350   0.006   1.967
  318   1HG2  VAL  45          1HG2      VAL  45   7.176   3.031   2.018
  319   2HG2  VAL  45          2HG2      VAL  45   7.196   1.280   1.779
  320   3HG2  VAL  45          3HG2      VAL  45   7.633   1.955   3.352
  321    H    CYS  46           H        CYS  46  11.055   5.663   2.411
  322    HA   CYS  46           HA       CYS  46   8.995   7.324   1.306
  323   1HB   CYS  46          1HB       CYS  46  10.773   7.993   2.962
  324   2HB   CYS  46          2HB       CYS  46  11.917   7.954   1.600
  325    H    HIS  47           H        HIS  47   8.911   5.735  -0.652
  326    HA   HIS  47           HA       HIS  47  10.459   6.923  -2.911
  327   1HB   HIS  47          1HB       HIS  47  10.227   4.767  -4.056
  328   2HB   HIS  47          2HB       HIS  47  11.234   4.687  -2.613
  329    HD1  HIS  47           HD1      HIS  47   7.410   4.373  -2.276
  330    HD2  HIS  47           HD2      HIS  47  10.903   2.035  -2.435
  331    HE1  HIS  47           HE1      HIS  47   6.724   1.996  -1.665
  332    H    GLN  48           H        GLN  48   9.273   7.710  -4.422
  333    HA   GLN  48           HA       GLN  48   6.867   8.612  -4.727
  334   1HB   GLN  48          1HB       GLN  48   6.779   8.115  -7.092
  335   2HB   GLN  48          2HB       GLN  48   8.406   8.571  -6.567
  336   1HG   GLN  48          1HG       GLN  48   8.944   6.068  -6.472
  337   2HG   GLN  48          2HG       GLN  48   7.398   5.790  -7.297
  338   1HE2  GLN  48          2HE2      GLN  48   7.160   7.633  -9.227
  339   2HE2  GLN  48          1HE2      GLN  48   8.559   7.608 -10.298
  340    H    ASP  49           H        ASP  49   4.902   8.220  -4.107
  341    HA   ASP  49           HA       ASP  49   3.374   6.027  -5.040
  342   1HB   ASP  49          1HB       ASP  49   4.786   5.010  -3.051
  343   2HB   ASP  49          2HB       ASP  49   3.820   6.071  -2.031
  344    H    CYS  50           H        CYS  50   1.166   6.303  -3.324
  345    HA   CYS  50           HA       CYS  50   0.670   9.206  -3.588
  346   1HB   CYS  50          1HB       CYS  50  -1.179   6.859  -3.365
  347   2HB   CYS  50          2HB       CYS  50  -1.694   8.489  -2.892
  348    H    VAL  51           H        VAL  51  -0.215  10.488  -2.124
  349    HA   VAL  51           HA       VAL  51  -0.234   9.814   0.733
  350    HB   VAL  51           HB       VAL  51   0.829  11.905   1.298
  351   1HG1  VAL  51          1HG1      VAL  51   2.303   9.959   1.046
  352   2HG1  VAL  51          2HG1      VAL  51   2.618  10.401  -0.640
  353   3HG1  VAL  51          3HG1      VAL  51   3.133  11.475   0.673
  354   1HG2  VAL  51          1HG2      VAL  51   1.244  12.395  -1.665
  355   2HG2  VAL  51          2HG2      VAL  51   0.168  13.318  -0.603
  356   3HG2  VAL  51          3HG2      VAL  51   1.913  13.371  -0.340
  357    H    CYS  52           H        CYS  52  -1.309  12.320   1.550
  358    HA   CYS  52           HA       CYS  52  -3.763  12.547  -0.165
  359   1HB   CYS  52          1HB       CYS  52  -3.335  13.289   2.756
  360   2HB   CYS  52          2HB       CYS  52  -4.783  13.562   1.796
  361    H    GLU  53           H        GLU  53  -4.260  14.568  -1.018
  362    HA   GLU  53           HA       GLU  53  -2.274  16.663  -0.939
  363   1HB   GLU  53          1HB       GLU  53  -3.870  16.448  -2.755
  364   2HB   GLU  53          2HB       GLU  53  -5.240  16.684  -1.674
  365   1HG   GLU  53          1HG       GLU  53  -3.075  18.795  -1.946
  366   2HG   GLU  53          2HG       GLU  53  -4.401  18.664  -3.109
  367    H    GLU  54           H        GLU  54  -1.938  18.042   0.688
  368    HA   GLU  54           HA       GLU  54  -2.256  17.640   3.205
  369   1HB   GLU  54          1HB       GLU  54  -2.375  20.436   2.002
  370   2HB   GLU  54          2HB       GLU  54  -1.959  20.058   3.681
  371   1HG   GLU  54          1HG       GLU  54  -0.044  18.650   2.865
  372   2HG   GLU  54          2HG       GLU  54  -0.382  19.190   1.212
  373    H    GLY  55           H        GLY  55  -4.892  19.457   1.577
  374   1HA   GLY  55          1HA       GLY  55  -6.332  20.216   3.893
  375   2HA   GLY  55          2HA       GLY  55  -7.019  19.938   2.286
  376    H    PHE  56           H        PHE  56  -5.976  17.045   2.463
  377    HA   PHE  56           HA       PHE  56  -8.383  15.961   3.821
  378   1HB   PHE  56          1HB       PHE  56  -6.673  14.821   1.612
  379   2HB   PHE  56          2HB       PHE  56  -8.224  14.227   2.177
  380    HD1  PHE  56           HD1      PHE  56 -10.007  16.531   2.244
  381    HD2  PHE  56           HD2      PHE  56  -6.836  15.643  -0.533
  382    HE1  PHE  56           HE1      PHE  56 -11.113  17.932   0.542
  383    HE2  PHE  56           HE2      PHE  56  -7.919  17.110  -2.225
  384    HZ   PHE  56           HZ       PHE  56 -10.072  18.234  -1.699
  385    H    TYR  57           H        TYR  57  -8.220  13.917   4.958
  386    HA   TYR  57           HA       TYR  57  -5.486  13.165   5.845
  387   1HB   TYR  57          1HB       TYR  57  -8.119  13.370   7.370
  388   2HB   TYR  57          2HB       TYR  57  -6.753  12.419   7.934
  389    HD1  TYR  57           HD1      TYR  57  -7.466  15.956   6.765
  390    HD2  TYR  57           HD2      TYR  57  -5.283  13.392   9.461
  391    HE1  TYR  57           HE1      TYR  57  -6.339  17.925   7.718
  392    HE2  TYR  57           HE2      TYR  57  -4.148  15.364  10.408
  393    HH   TYR  57           HH       TYR  57  -3.860  17.658  10.277
  394    H    ARG  58           H        ARG  58  -5.022  10.995   5.818
  395    HA   ARG  58           HA       ARG  58  -6.866   9.308   4.242
  396   1HB   ARG  58          1HB       ARG  58  -5.258   7.472   4.758
  397   2HB   ARG  58          2HB       ARG  58  -4.704   8.760   3.707
  398   1HG   ARG  58          1HG       ARG  58  -2.994   9.295   5.030
  399   2HG   ARG  58          2HG       ARG  58  -3.989   9.354   6.488
  400   1HD   ARG  58          1HD       ARG  58  -2.982   6.783   5.230
  401   2HD   ARG  58          2HD       ARG  58  -2.198   7.643   6.572
  402    HE   ARG  58           HE       ARG  58  -4.831   7.360   7.390
  403   1HH1  ARG  58          1HH1      ARG  58  -2.461   4.999   6.253
  404   2HH1  ARG  58          2HH1      ARG  58  -2.828   3.821   7.488
  405   1HH2  ARG  58          1HH2      ARG  58  -5.291   5.842   9.034
  406   2HH2  ARG  58          2HH2      ARG  58  -4.436   4.317   9.123
  407    H    ASN  59           H        ASN  59  -8.731   9.154   5.354
  408    HA   ASN  59           HA       ASN  59  -9.054   9.014   8.101
  409   1HB   ASN  59          1HB       ASN  59 -10.891   7.576   6.135
  410   2HB   ASN  59          2HB       ASN  59 -11.255   8.047   7.780
  411   1HD2  ASN  59          2HD2      ASN  59  -9.438  10.601   6.328
  412   2HD2  ASN  59          1HD2      ASN  59 -10.784  11.606   5.980
  413    H    LYS  60           H        LYS  60  -8.489   6.264   5.909
  414    HA   LYS  60           HA       LYS  60  -7.428   4.689   8.059
  415   1HB   LYS  60          1HB       LYS  60  -9.063   2.805   7.919
  416   2HB   LYS  60          2HB       LYS  60  -9.625   4.232   8.770
  417   1HG   LYS  60          1HG       LYS  60 -10.992   4.889   6.799
  418   2HG   LYS  60          2HG       LYS  60 -10.423   3.433   5.938
  419   1HD   LYS  60          1HD       LYS  60 -11.307   2.014   7.776
  420   2HD   LYS  60          2HD       LYS  60 -11.975   3.455   8.559
  421   1HE   LYS  60          1HE       LYS  60 -12.715   2.548   5.734
  422   2HE   LYS  60          2HE       LYS  60 -13.608   2.104   7.199
  423   1HZ   LYS  60          1HZ       LYS  60 -13.196   4.871   6.313
  424   2HZ   LYS  60          2HZ       LYS  60 -14.572   3.986   6.116
  425   3HZ   LYS  60          3HZ       LYS  60 -14.047   4.364   7.628
  426    H    ASP  61           H        ASP  61  -8.901   4.458   4.825
  427    HA   ASP  61           HA       ASP  61  -6.661   2.623   3.977
  428   1HB   ASP  61          1HB       ASP  61  -8.704   1.343   4.359
  429   2HB   ASP  61          2HB       ASP  61  -9.636   2.456   3.348
  430    H    ASP  62           H        ASP  62  -5.757   4.760   3.411
  431    HA   ASP  62           HA       ASP  62  -5.409   6.620   2.190
  432   1HB   ASP  62          1HB       ASP  62  -4.697   4.710   0.658
  433   2HB   ASP  62          2HB       ASP  62  -6.247   4.888  -0.174
  434    H    LYS  63           H        LYS  63  -8.139   6.308   3.209
  435    HA   LYS  63           HA       LYS  63  -9.954   7.514   1.242
  436   1HB   LYS  63          1HB       LYS  63 -10.175   6.977   4.221
  437   2HB   LYS  63          2HB       LYS  63 -11.497   7.582   3.208
  438   1HG   LYS  63          1HG       LYS  63 -10.144   4.853   3.052
  439   2HG   LYS  63          2HG       LYS  63 -11.770   5.217   3.640
  440   1HD   LYS  63          1HD       LYS  63 -12.366   6.027   1.334
  441   2HD   LYS  63          2HD       LYS  63 -10.753   5.508   0.777
  442   1HE   LYS  63          1HE       LYS  63 -11.216   3.191   1.476
  443   2HE   LYS  63          2HE       LYS  63 -12.840   3.668   2.020
  444   1HZ   LYS  63          1HZ       LYS  63 -11.816   3.854  -0.726
  445   2HZ   LYS  63          2HZ       LYS  63 -12.866   2.719  -0.156
  446   3HZ   LYS  63          3HZ       LYS  63 -13.326   4.300  -0.233
  447    H    CYS  64           H        CYS  64  -8.304   9.147   0.810
  448    HA   CYS  64           HA       CYS  64  -7.594  11.142   2.718
  449   1HB   CYS  64          1HB       CYS  64  -7.570  11.145  -0.303
  450   2HB   CYS  64          2HB       CYS  64  -6.915  12.449   0.685
  451    H    VAL  65           H        VAL  65  -9.548  11.804   3.775
  452    HA   VAL  65           HA       VAL  65 -10.714  14.113   2.378
  453    HB   VAL  65           HB       VAL  65 -12.995  13.646   3.247
  454   1HG1  VAL  65          1HG1      VAL  65 -12.392  13.341   0.848
  455   2HG1  VAL  65          2HG1      VAL  65 -12.081  11.619   1.172
  456   3HG1  VAL  65          3HG1      VAL  65 -13.707  12.285   1.389
  457   1HG2  VAL  65          1HG2      VAL  65 -12.462  11.860   4.857
  458   2HG2  VAL  65          2HG2      VAL  65 -13.685  11.331   3.697
  459   3HG2  VAL  65          3HG2      VAL  65 -12.011  10.767   3.533
  460    H    SER  66           H        SER  66 -11.428  15.768   3.953
  461    HA   SER  66           HA       SER  66  -9.431  16.142   5.778
  462   1HB   SER  66          1HB       SER  66 -12.182  17.421   5.819
  463   2HB   SER  66          2HB       SER  66 -10.664  18.129   6.411
  464    HG   SER  66           HG       SER  66  -9.875  18.133   4.317
  465    H    ALA  67           H        ALA  67  -9.382  16.444   8.104
  466    HA   ALA  67           HA       ALA  67 -10.158  14.249   9.619
  467   1HB   ALA  67          1HB       ALA  67  -8.427  15.842  10.303
  468   2HB   ALA  67          2HB       ALA  67  -9.663  17.093  10.582
  469   3HB   ALA  67          3HB       ALA  67  -9.633  15.625  11.584
  470    H    GLU  68           H        GLU  68 -11.954  17.207   8.943
  471    HA   GLU  68           HA       GLU  68 -14.173  16.960  10.664
  472   1HB   GLU  68          1HB       GLU  68 -14.119  17.862   7.741
  473   2HB   GLU  68          2HB       GLU  68 -15.372  18.226   8.933
  474   1HG   GLU  68          1HG       GLU  68 -13.717  19.475  10.305
  475   2HG   GLU  68          2HG       GLU  68 -12.451  19.148   9.112
  476    H    ASP  69           H        ASP  69 -13.528  15.444   7.478
  477    HA   ASP  69           HA       ASP  69 -16.067  14.046   7.319
  478   1HB   ASP  69          1HB       ASP  69 -13.450  13.571   5.829
  479   2HB   ASP  69          2HB       ASP  69 -15.012  12.863   5.440
  480    H    CYS  70           H        CYS  70 -12.696  13.218   8.149
  481    HA   CYS  70           HA       CYS  70 -12.702  10.527   8.433
  482   1HB   CYS  70          1HB       CYS  70 -10.719  11.868   8.907
  483   2HB   CYS  70          2HB       CYS  70 -11.504  12.513  10.363
  484    H    GLU  71           H        GLU  71 -14.045  12.641  10.965
  485    HA   GLU  71           HA       GLU  71 -14.716  10.417  12.688
  486   1HB   GLU  71          1HB       GLU  71 -16.007  13.180  12.671
  487   2HB   GLU  71          2HB       GLU  71 -15.925  12.014  13.996
  488   1HG   GLU  71          1HG       GLU  71 -13.674  13.679  12.799
  489   2HG   GLU  71          2HG       GLU  71 -14.286  13.701  14.449
  490    H    LEU  72           H        LEU  72 -16.753  12.479  10.579
  491    HA   LEU  72           HA       LEU  72 -19.190  11.079  10.915
  492   1HB   LEU  72          1HB       LEU  72 -18.062  12.896   8.770
  493   2HB   LEU  72          2HB       LEU  72 -19.629  12.130   8.551
  494    HG   LEU  72           HG       LEU  72 -19.749  14.440   9.397
  495   1HD1  LEU  72          1HD1      LEU  72 -21.598  12.814   9.734
  496   2HD1  LEU  72          2HD1      LEU  72 -20.944  12.426  11.340
  497   3HD1  LEU  72          3HD1      LEU  72 -21.523  14.060  10.990
  498   1HD2  LEU  72          1HD2      LEU  72 -17.799  14.413  10.943
  499   2HD2  LEU  72          2HD2      LEU  72 -19.285  15.000  11.703
  500   3HD2  LEU  72          3HD2      LEU  72 -18.713  13.361  12.051
  501    H    ASP  73           H        ASP  73 -16.459  10.436   8.827
  502    HA   ASP  73           HA       ASP  73 -17.508   8.658   6.945
  503   1HB   ASP  73          1HB       ASP  73 -15.202   9.654   6.931
  504   2HB   ASP  73          2HB       ASP  73 -14.798   8.707   8.322
  505    H    ASN  74           H        ASN  74 -16.984   8.173  10.398
  506    HA   ASN  74           HA       ASN  74 -17.542   5.238  10.089
  507   1HB   ASN  74          1HB       ASN  74 -15.392   6.437  11.859
  508   2HB   ASN  74          2HB       ASN  74 -15.785   4.722  11.626
  509   1HD2  ASN  74          2HD2      ASN  74 -14.204   7.588  10.128
  510   2HD2  ASN  74          1HD2      ASN  74 -13.494   6.653   8.825
  511    H    MET  75           H        MET  75 -17.175   7.916  12.455
  512    HA   MET  75           HA       MET  75 -18.070   8.306  14.477
  513   1HB   MET  75          1HB       MET  75 -20.553   7.042  13.259
  514   2HB   MET  75          2HB       MET  75 -20.508   8.137  14.647
  515   1HG   MET  75          1HG       MET  75 -19.552   9.919  13.259
  516   2HG   MET  75          2HG       MET  75 -19.590   8.872  11.836
  517   1HE   MET  75          1HE       MET  75 -21.664   8.213  10.490
  518   2HE   MET  75          2HE       MET  75 -22.385   7.421  11.913
  519   3HE   MET  75          3HE       MET  75 -23.335   8.589  10.970
  520    H    ASP  76           H        ASP  76 -16.788   5.594  14.064
  521    HA   ASP  76           HA       ASP  76 -18.299   3.767  15.759
  522   1HB   ASP  76          1HB       ASP  76 -16.545   2.207  15.282
  523   2HB   ASP  76          2HB       ASP  76 -17.086   2.973  13.784
  524    H    PHE  77           H        PHE  77 -18.334   5.417  17.471
  525    HA   PHE  77           HA       PHE  77 -17.933   5.755  19.669
  526   1HB   PHE  77          1HB       PHE  77 -15.396   4.105  19.585
  527   2HB   PHE  77          2HB       PHE  77 -16.387   4.534  20.961
  528    HD1  PHE  77           HD1      PHE  77 -18.908   3.700  20.902
  529    HD2  PHE  77           HD2      PHE  77 -15.702   1.969  18.593
  530    HE1  PHE  77           HE1      PHE  77 -20.222   1.615  20.634
  531    HE2  PHE  77           HE2      PHE  77 -17.017  -0.118  18.343
  532    HZ   PHE  77           HZ       PHE  77 -19.281  -0.296  19.351
  533    H    ILE  78           H        ILE  78 -14.972   5.958  17.688
  534    HA   ILE  78           HA       ILE  78 -13.413   7.585  17.433
  535    HB   ILE  78           HB       ILE  78 -15.360   9.440  18.875
  536   1HG1  ILE  78          1HG1      ILE  78 -14.857   9.029  15.890
  537   2HG1  ILE  78          2HG1      ILE  78 -16.235   8.354  16.765
  538   1HG2  ILE  78          1HG2      ILE  78 -13.036  10.323  18.906
  539   2HG2  ILE  78          2HG2      ILE  78 -12.943  10.113  17.157
  540   3HG2  ILE  78          3HG2      ILE  78 -14.081  11.267  17.868
  541   1HD1  ILE  78          1HD1      ILE  78 -16.961  10.642  17.410
  542   2HD1  ILE  78          2HD1      ILE  78 -15.691  11.310  16.360
  543   3HD1  ILE  78          3HD1      ILE  78 -16.983  10.327  15.665
  544    H    TYR  79           H        TYR  79 -12.169   6.147  18.741
  545    HA   TYR  79           HA       TYR  79 -11.635   7.068  21.534
  546   1HB   TYR  79          1HB       TYR  79 -12.016   4.227  20.569
  547   2HB   TYR  79          2HB       TYR  79 -11.290   4.677  22.110
  548    HD1  TYR  79           HD1      TYR  79 -13.594   7.011  22.489
  549    HD2  TYR  79           HD2      TYR  79 -13.419   2.730  21.931
  550    HE1  TYR  79           HE1      TYR  79 -15.506   6.749  23.961
  551    HE2  TYR  79           HE2      TYR  79 -15.306   2.472  23.510
  552    HH   TYR  79           HH       TYR  79 -16.877   5.259  25.077
  553    HA   PRO  80           HA       PRO  80  -7.609   7.240  19.245
  554   1HB   PRO  80          1HB       PRO  80  -7.413   8.531  21.991
  555   2HB   PRO  80          2HB       PRO  80  -6.433   8.910  20.536
  556   1HG   PRO  80          1HG       PRO  80  -8.589  10.437  21.071
  557   2HG   PRO  80          2HG       PRO  80  -8.408   9.795  19.408
  558   1HD   PRO  80          1HD       PRO  80 -10.184   8.794  21.624
  559   2HD   PRO  80          2HD       PRO  80 -10.528   8.918  19.883
  560    H    GLY  81           H        GLY  81  -6.761   5.172  19.289
  561   1HA   GLY  81          1HA       GLY  81  -5.479   3.422  20.083
  562   2HA   GLY  81          2HA       GLY  81  -5.361   4.205  21.664
  563    H    THR  82           H        THR  82  -8.453   3.647  20.112
  564    HA   THR  82           HA       THR  82 -10.278   2.588  20.659
  565    HB   THR  82           HB       THR  82  -9.075   0.893  19.396
  566    HG1  THR  82           HG1      THR  82 -10.929   0.043  19.628
  567   1HG2  THR  82          1HG2      THR  82  -8.302  -0.280  22.100
  568   2HG2  THR  82          2HG2      THR  82  -8.295  -1.174  20.568
  569   3HG2  THR  82          3HG2      THR  82  -7.224   0.212  20.772
  570    H    ARG  83           H        ARG  83 -10.856   0.445  22.315
  571    HA   ARG  83           HA       ARG  83 -11.615  -0.070  24.330
  572   1HB   ARG  83          1HB       ARG  83  -9.194  -0.198  24.805
  573   2HB   ARG  83          2HB       ARG  83  -9.232   1.410  25.533
  574   1HG   ARG  83          1HG       ARG  83 -11.144  -0.770  26.457
  575   2HG   ARG  83          2HG       ARG  83  -9.471  -0.776  27.005
  576   1HD   ARG  83          1HD       ARG  83  -9.649   1.261  28.150
  577   2HD   ARG  83          2HD       ARG  83 -11.150   1.733  27.384
  578    HE   ARG  83           HE       ARG  83 -10.814  -0.016  29.656
  579   1HH1  ARG  83          1HH1      ARG  83 -13.055   0.800  26.963
  580   2HH1  ARG  83          2HH1      ARG  83 -14.438   0.217  27.826
  581   1HH2  ARG  83          1HH2      ARG  83 -12.663  -0.752  30.722
  582   2HH2  ARG  83          2HH2      ARG  83 -14.231  -0.669  29.967
  583    H    ASN  84           H        ASN  84 -10.547   3.357  24.707
  584    HA   ASN  84           HA       ASN  84 -13.147   4.342  25.055
  585   1HB   ASN  84          1HB       ASN  84 -13.208   3.173  27.227
  586   2HB   ASN  84          2HB       ASN  84 -11.762   4.053  27.735
  587   1HD2  ASN  84          2HD2      ASN  84 -15.126   4.636  26.428
  588   2HD2  ASN  84          1HD2      ASN  84 -15.347   6.075  27.413
  589    HA   PRO  85           HA       PRO  85 -10.100   7.814  26.360
  590   1HB   PRO  85          1HB       PRO  85  -7.511   6.739  25.255
  591   2HB   PRO  85          2HB       PRO  85  -7.768   7.775  26.690
  592   1HG   PRO  85          1HG       PRO  85  -7.266   5.137  27.023
  593   2HG   PRO  85          2HG       PRO  85  -8.602   5.885  27.958
  594   1HD   PRO  85          1HD       PRO  85  -8.777   4.441  25.301
  595   2HD   PRO  85          2HD       PRO  85  -9.676   4.056  26.810
  Start of MODEL    4
    1   1H    LYS   1          1H        LYS   1   5.389   1.529  -9.284
    2   2H    LYS   1          2H        LYS   1   5.320   0.593  -7.918
    3   3H    LYS   1          3H        LYS   1   3.946   0.941  -8.771
    4    HA   LYS   1           HA       LYS   1   3.956   2.262  -6.861
    5   1HB   LYS   1          1HB       LYS   1   5.748   3.827  -6.373
    6   2HB   LYS   1          2HB       LYS   1   6.343   2.157  -6.443
    7   1HG   LYS   1          1HG       LYS   1   7.184   2.607  -8.787
    8   2HG   LYS   1          2HG       LYS   1   6.696   4.300  -8.583
    9   1HD   LYS   1          1HD       LYS   1   8.177   4.402  -6.532
   10   2HD   LYS   1          2HD       LYS   1   8.729   2.762  -6.899
   11   1HE   LYS   1          1HE       LYS   1   9.585   3.548  -9.099
   12   2HE   LYS   1          2HE       LYS   1   9.014   5.189  -8.736
   13   1HZ   LYS   1          1HZ       LYS   1  10.484   5.221  -6.858
   14   2HZ   LYS   1          2HZ       LYS   1  11.021   3.702  -7.196
   15   3HZ   LYS   1          3HZ       LYS   1  11.323   4.936  -8.247
   16    H    ALA   2           H        ALA   2   2.988   4.401  -6.930
   17    HA   ALA   2           HA       ALA   2   2.228   5.115  -9.708
   18   1HB   ALA   2          1HB       ALA   2   0.447   4.677  -8.085
   19   2HB   ALA   2          2HB       ALA   2   1.063   5.972  -7.036
   20   3HB   ALA   2          3HB       ALA   2   0.451   6.355  -8.661
   21    H    THR   3           H        THR   3   3.616   6.541 -10.625
   22    HA   THR   3           HA       THR   3   5.052   8.597  -9.116
   23    HB   THR   3           HB       THR   3   5.554   9.229 -11.663
   24    HG1  THR   3           HG1      THR   3   3.798   7.542 -12.238
   25   1HG2  THR   3          1HG2      THR   3   6.491   6.624 -10.394
   26   2HG2  THR   3          2HG2      THR   3   7.297   7.499 -11.710
   27   3HG2  THR   3          3HG2      THR   3   7.190   8.235 -10.100
   28    H    MET   4           H        MET   4   4.784  10.866 -10.647
   29    HA   MET   4           HA       MET   4   2.333  11.935  -9.635
   30   1HB   MET   4          1HB       MET   4   4.536  13.096  -9.753
   31   2HB   MET   4          2HB       MET   4   4.394  13.169 -11.511
   32   1HG   MET   4          1HG       MET   4   2.514  14.666 -11.374
   33   2HG   MET   4          2HG       MET   4   2.264  14.315  -9.663
   34   1HE   MET   4          1HE       MET   4   4.614  16.060 -12.276
   35   2HE   MET   4          2HE       MET   4   5.786  16.870 -11.209
   36   3HE   MET   4          3HE       MET   4   5.786  15.098 -11.337
   37    H    GLN   5           H        GLN   5   1.065  10.271 -10.834
   38    HA   GLN   5           HA       GLN   5   0.088  11.299 -13.481
   39   1HB   GLN   5          1HB       GLN   5  -0.233   9.014 -14.167
   40   2HB   GLN   5          2HB       GLN   5   1.427   9.221 -13.597
   41   1HG   GLN   5          1HG       GLN   5   0.423   8.334 -11.281
   42   2HG   GLN   5          2HG       GLN   5  -0.863   7.709 -12.307
   43   1HE2  GLN   5          2HE2      GLN   5  -0.171   6.192 -14.094
   44   2HE2  GLN   5          1HE2      GLN   5   1.294   5.259 -13.848
   45    H    CYS   6           H        CYS   6  -0.748  10.411 -10.229
   46    HA   CYS   6           HA       CYS   6  -3.448   9.560 -10.722
   47   1HB   CYS   6          1HB       CYS   6  -2.081  10.469  -8.180
   48   2HB   CYS   6          2HB       CYS   6  -3.603   9.572  -8.273
   49    H    GLY   7           H        GLY   7  -3.800  11.600 -12.103
   50   1HA   GLY   7          1HA       GLY   7  -4.399  14.122 -10.813
   51   2HA   GLY   7          2HA       GLY   7  -4.818  13.632 -12.462
   52    H    GLU   8           H        GLU   8  -5.646  12.464  -9.205
   53    HA   GLU   8           HA       GLU   8  -8.548  12.968  -9.625
   54   1HB   GLU   8          1HB       GLU   8  -8.956  10.935  -8.233
   55   2HB   GLU   8          2HB       GLU   8  -8.201  10.572  -9.782
   56   1HG   GLU   8          1HG       GLU   8  -6.060  10.156  -8.824
   57   2HG   GLU   8          2HG       GLU   8  -6.519  10.861  -7.272
   58    H    ASN   9           H        ASN   9  -8.721  12.132  -6.639
   59    HA   ASN   9           HA       ASN   9  -7.829  14.706  -5.539
   60   1HB   ASN   9          1HB       ASN   9  -9.996  13.604  -4.935
   61   2HB   ASN   9          2HB       ASN   9  -9.060  12.380  -4.056
   62   1HD2  ASN   9          2HD2      ASN   9 -10.592  13.455  -2.290
   63   2HD2  ASN   9          1HD2      ASN   9  -9.864  14.820  -1.457
   64    H    GLU  10           H        GLU  10  -5.542  13.508  -6.547
   65    HA   GLU  10           HA       GLU  10  -4.115  12.780  -4.071
   66   1HB   GLU  10          1HB       GLU  10  -4.044  11.223  -6.683
   67   2HB   GLU  10          2HB       GLU  10  -2.830  11.063  -5.410
   68   1HG   GLU  10          1HG       GLU  10  -4.715  10.489  -3.801
   69   2HG   GLU  10          2HG       GLU  10  -5.791  10.370  -5.185
   70    H    LYS  11           H        LYS  11  -1.789  12.922  -4.340
   71    HA   LYS  11           HA       LYS  11  -0.774  14.782  -6.373
   72   1HB   LYS  11          1HB       LYS  11  -1.676  16.115  -4.443
   73   2HB   LYS  11          2HB       LYS  11  -0.577  15.249  -3.354
   74   1HG   LYS  11          1HG       LYS  11   1.366  16.149  -4.660
   75   2HG   LYS  11          2HG       LYS  11   0.242  17.031  -5.702
   76   1HD   LYS  11          1HD       LYS  11   0.722  17.398  -2.707
   77   2HD   LYS  11          2HD       LYS  11   1.214  18.493  -3.995
   78   1HE   LYS  11          1HE       LYS  11  -1.640  17.928  -3.067
   79   2HE   LYS  11          2HE       LYS  11  -0.722  19.421  -2.882
   80   1HZ   LYS  11          1HZ       LYS  11  -0.708  19.642  -5.266
   81   2HZ   LYS  11          2HZ       LYS  11  -1.590  18.258  -5.433
   82   3HZ   LYS  11          3HZ       LYS  11  -2.249  19.568  -4.685
   83    H    TYR  12           H        TYR  12   1.554  14.566  -6.489
   84    HA   TYR  12           HA       TYR  12   2.630  11.975  -5.736
   85   1HB   TYR  12          1HB       TYR  12   3.237  13.084  -7.791
   86   2HB   TYR  12          2HB       TYR  12   3.886  14.464  -6.910
   87    HD1  TYR  12           HD1      TYR  12   4.305  10.737  -7.319
   88    HD2  TYR  12           HD2      TYR  12   6.173  14.488  -6.288
   89    HE1  TYR  12           HE1      TYR  12   6.535   9.671  -7.462
   90    HE2  TYR  12           HE2      TYR  12   8.400  13.415  -6.441
   91    HH   TYR  12           HH       TYR  12   8.843  10.031  -7.481
   92    H    ASP  13           H        ASP  13   3.589  11.478  -3.796
   93    HA   ASP  13           HA       ASP  13   4.665  13.703  -2.120
   94   1HB   ASP  13          1HB       ASP  13   2.744  12.740  -1.023
   95   2HB   ASP  13          2HB       ASP  13   3.358  11.087  -1.290
   96    H    SER  14           H        SER  14   6.552  13.244  -1.018
   97    HA   SER  14           HA       SER  14   8.470  11.400  -2.240
   98   1HB   SER  14          1HB       SER  14  10.011  12.576  -0.631
   99   2HB   SER  14          2HB       SER  14   9.216  13.645  -1.802
  100    HG   SER  14           HG       SER  14   9.010  14.556   0.252
  101    H    CYS  15           H        CYS  15   8.369  12.141   1.149
  102    HA   CYS  15           HA       CYS  15   8.911   9.430   1.902
  103   1HB   CYS  15          1HB       CYS  15   9.644  11.466   3.145
  104   2HB   CYS  15          2HB       CYS  15   7.963  11.750   3.622
  105    H    GLY  16           H        GLY  16   6.788   8.520   0.670
  106   1HA   GLY  16          1HA       GLY  16   5.295   7.355   2.726
  107   2HA   GLY  16          2HA       GLY  16   4.385   8.801   2.272
  108    H    SER  17           H        SER  17   5.189   5.538   1.445
  109    HA   SER  17           HA       SER  17   3.379   5.581  -0.928
  110   1HB   SER  17          1HB       SER  17   4.675   3.325   0.606
  111   2HB   SER  17          2HB       SER  17   3.716   3.147  -0.872
  112    HG   SER  17           HG       SER  17   5.787   5.038  -0.914
  113    H    LYS  18           H        LYS  18   1.932   6.824   0.539
  114    HA   LYS  18           HA       LYS  18   0.127   7.115   1.873
  115   1HB   LYS  18          1HB       LYS  18  -0.369   4.116   1.588
  116   2HB   LYS  18          2HB       LYS  18  -1.408   5.282   2.386
  117   1HG   LYS  18          1HG       LYS  18  -2.387   5.034   0.307
  118   2HG   LYS  18          2HG       LYS  18  -1.586   6.599   0.264
  119   1HD   LYS  18          1HD       LYS  18  -1.342   5.459  -1.856
  120   2HD   LYS  18          2HD       LYS  18   0.250   5.589  -1.127
  121   1HE   LYS  18          1HE       LYS  18   0.188   3.240  -0.429
  122   2HE   LYS  18          2HE       LYS  18  -1.503   3.093  -0.946
  123   1HZ   LYS  18          1HZ       LYS  18   0.745   3.720  -2.724
  124   2HZ   LYS  18          2HZ       LYS  18   0.069   2.222  -2.541
  125   3HZ   LYS  18          3HZ       LYS  18  -0.817   3.462  -3.172
  126    H    GLU  19           H        GLU  19   2.183   7.535   3.125
  127    HA   GLU  19           HA       GLU  19   2.803   5.845   5.391
  128   1HB   GLU  19          1HB       GLU  19   3.662   8.476   4.307
  129   2HB   GLU  19          2HB       GLU  19   3.659   8.467   6.034
  130   1HG   GLU  19          1HG       GLU  19   5.015   6.219   4.523
  131   2HG   GLU  19          2HG       GLU  19   5.822   7.763   4.909
  132    H    CYS  20           H        CYS  20   2.770   6.983   7.595
  133    HA   CYS  20           HA       CYS  20   0.101   7.325   8.578
  134   1HB   CYS  20          1HB       CYS  20   1.731   6.508  10.023
  135   2HB   CYS  20          2HB       CYS  20   2.865   7.825   9.677
  136    H    ASP  21           H        ASP  21   2.257   9.472   6.989
  137    HA   ASP  21           HA       ASP  21   1.667  12.045   7.721
  138   1HB   ASP  21          1HB       ASP  21   2.999  11.027   5.680
  139   2HB   ASP  21          2HB       ASP  21   1.475  11.112   4.820
  140    H    LYS  22           H        LYS  22  -0.255  12.971   8.201
  141    HA   LYS  22           HA       LYS  22  -2.487  13.273   8.430
  142   1HB   LYS  22          1HB       LYS  22  -2.206  13.285   5.413
  143   2HB   LYS  22          2HB       LYS  22  -3.520  14.033   6.322
  144   1HG   LYS  22          1HG       LYS  22  -1.913  15.559   7.452
  145   2HG   LYS  22          2HG       LYS  22  -0.574  14.751   6.635
  146   1HD   LYS  22          1HD       LYS  22  -0.751  16.521   5.290
  147   2HD   LYS  22          2HD       LYS  22  -1.780  15.395   4.415
  148   1HE   LYS  22          1HE       LYS  22  -2.721  17.596   6.348
  149   2HE   LYS  22          2HE       LYS  22  -2.730  17.703   4.584
  150   1HZ   LYS  22          1HZ       LYS  22  -4.245  15.806   4.578
  151   2HZ   LYS  22          2HZ       LYS  22  -4.307  15.857   6.222
  152   3HZ   LYS  22          3HZ       LYS  22  -4.869  17.127   5.339
  153    H    LYS  23           H        LYS  23  -2.021  10.434   8.651
  154    HA   LYS  23           HA       LYS  23  -3.836   8.967   7.040
  155   1HB   LYS  23          1HB       LYS  23  -3.422   7.097   8.468
  156   2HB   LYS  23          2HB       LYS  23  -1.982   7.955   7.978
  157   1HG   LYS  23          1HG       LYS  23  -1.613   7.337  10.232
  158   2HG   LYS  23          2HG       LYS  23  -1.906   9.066  10.250
  159   1HD   LYS  23          1HD       LYS  23  -2.983   8.080  12.120
  160   2HD   LYS  23          2HD       LYS  23  -4.170   8.749  11.014
  161   1HE   LYS  23          1HE       LYS  23  -4.907   6.592  11.957
  162   2HE   LYS  23          2HE       LYS  23  -4.746   6.474  10.205
  163   1HZ   LYS  23          1HZ       LYS  23  -2.749   5.570  12.162
  164   2HZ   LYS  23          2HZ       LYS  23  -3.792   4.603  11.327
  165   3HZ   LYS  23          3HZ       LYS  23  -2.623   5.437  10.522
  166    H    CYS  24           H        CYS  24  -5.019  11.246   9.056
  167    HA   CYS  24           HA       CYS  24  -7.685  10.360   9.020
  168   1HB   CYS  24          1HB       CYS  24  -7.404   8.565  10.525
  169   2HB   CYS  24          2HB       CYS  24  -6.156   9.417  11.431
  170    H    LYS  25           H        LYS  25  -5.798  11.605  11.733
  171    HA   LYS  25           HA       LYS  25  -5.980  13.271  13.110
  172   1HB   LYS  25          1HB       LYS  25  -4.982  14.546  11.327
  173   2HB   LYS  25          2HB       LYS  25  -6.585  14.932  10.655
  174   1HG   LYS  25          1HG       LYS  25  -5.502  16.770  11.954
  175   2HG   LYS  25          2HG       LYS  25  -7.134  16.351  12.485
  176   1HD   LYS  25          1HD       LYS  25  -6.312  15.121  14.390
  177   2HD   LYS  25          2HD       LYS  25  -4.628  15.254  13.855
  178   1HE   LYS  25          1HE       LYS  25  -6.440  17.591  14.654
  179   2HE   LYS  25          2HE       LYS  25  -5.272  16.808  15.726
  180   1HZ   LYS  25          1HZ       LYS  25  -4.597  18.191  13.226
  181   2HZ   LYS  25          2HZ       LYS  25  -4.383  18.776  14.748
  182   3HZ   LYS  25          3HZ       LYS  25  -3.521  17.467  14.247
  183    H    TYR  26           H        TYR  26  -7.652  12.685  14.438
  184    HA   TYR  26           HA       TYR  26 -10.426  13.045  13.745
  185   1HB   TYR  26          1HB       TYR  26  -9.138  12.790  16.501
  186   2HB   TYR  26          2HB       TYR  26 -10.846  12.729  16.132
  187    HD1  TYR  26           HD1      TYR  26  -7.579  11.004  15.712
  188    HD2  TYR  26           HD2      TYR  26 -11.858  10.654  15.383
  189    HE1  TYR  26           HE1      TYR  26  -7.363   8.568  15.407
  190    HE2  TYR  26           HE2      TYR  26 -11.659   8.196  15.201
  191    HH   TYR  26           HH       TYR  26 -10.045   6.430  15.754
  192    H    ASP  27           H        ASP  27  -8.511  14.741  16.247
  193    HA   ASP  27           HA       ASP  27  -8.936  17.405  15.648
  194   1HB   ASP  27          1HB       ASP  27 -11.316  17.270  15.682
  195   2HB   ASP  27          2HB       ASP  27 -11.335  16.173  17.065
  196    H    GLY  28           H        GLY  28 -10.015  15.904  18.659
  197   1HA   GLY  28          1HA       GLY  28  -7.552  16.845  20.079
  198   2HA   GLY  28          2HA       GLY  28  -9.164  16.634  20.775
  199    H    VAL  29           H        VAL  29  -9.979  14.145  20.020
  200    HA   VAL  29           HA       VAL  29  -8.302  12.466  21.692
  201    HB   VAL  29           HB       VAL  29 -10.875  11.901  20.188
  202   1HG1  VAL  29          1HG1      VAL  29  -9.470  10.373  22.432
  203   2HG1  VAL  29          2HG1      VAL  29 -11.117  10.054  21.851
  204   3HG1  VAL  29          3HG1      VAL  29  -9.744   9.768  20.785
  205   1HG2  VAL  29          1HG2      VAL  29 -11.101  13.698  21.922
  206   2HG2  VAL  29          2HG2      VAL  29 -11.952  12.221  22.384
  207   3HG2  VAL  29          3HG2      VAL  29 -10.383  12.606  23.117
  208    H    GLU  30           H        GLU  30  -6.455  12.839  20.191
  209    HA   GLU  30           HA       GLU  30  -6.357  11.305  17.722
  210   1HB   GLU  30          1HB       GLU  30  -4.091  12.390  19.451
  211   2HB   GLU  30          2HB       GLU  30  -3.948  11.752  17.808
  212   1HG   GLU  30          1HG       GLU  30  -5.463  14.262  18.664
  213   2HG   GLU  30          2HG       GLU  30  -3.982  14.179  17.710
  214    H    GLU  31           H        GLU  31  -7.242   9.334  18.400
  215    HA   GLU  31           HA       GLU  31  -6.279   7.495  20.234
  216   1HB   GLU  31          1HB       GLU  31  -7.043   6.847  17.345
  217   2HB   GLU  31          2HB       GLU  31  -6.996   5.739  18.724
  218   1HG   GLU  31          1HG       GLU  31  -8.682   7.371  19.855
  219   2HG   GLU  31          2HG       GLU  31  -8.919   8.055  18.247
  220    H    GLU  32           H        GLU  32  -4.799   8.444  17.158
  221    HA   GLU  32           HA       GLU  32  -2.448   6.707  17.560
  222   1HB   GLU  32          1HB       GLU  32  -1.450   7.917  15.703
  223   2HB   GLU  32          2HB       GLU  32  -2.952   7.100  15.285
  224   1HG   GLU  32          1HG       GLU  32  -2.717  10.119  15.727
  225   2HG   GLU  32          2HG       GLU  32  -2.598   9.304  14.183
  226    H    ASP  33           H        ASP  33  -2.024   7.268  19.706
  227    HA   ASP  33           HA       ASP  33  -1.700   9.912  20.665
  228   1HB   ASP  33          1HB       ASP  33  -0.851   8.896  22.675
  229   2HB   ASP  33          2HB       ASP  33  -2.279   8.039  22.071
  230    H    ASP  34           H        ASP  34  -0.505  10.707  18.950
  231    HA   ASP  34           HA       ASP  34   2.274  11.306  19.247
  232   1HB   ASP  34          1HB       ASP  34   2.654   8.974  18.521
  233   2HB   ASP  34          2HB       ASP  34   1.558   9.204  17.147
  234    H    GLU  35           H        GLU  35  -0.619  10.987  17.278
  235    HA   GLU  35           HA       GLU  35  -1.729  12.313  15.954
  236   1HB   GLU  35          1HB       GLU  35  -0.631  14.334  17.127
  237   2HB   GLU  35          2HB       GLU  35   0.465  14.398  15.753
  238   1HG   GLU  35          1HG       GLU  35  -2.215  14.115  14.684
  239   2HG   GLU  35          2HG       GLU  35  -2.336  15.253  16.022
  240    H    GLU  36           H        GLU  36  -0.055  13.760  13.696
  241    HA   GLU  36           HA       GLU  36   0.707  11.231  12.277
  242   1HB   GLU  36          1HB       GLU  36  -1.216  13.388  11.322
  243   2HB   GLU  36          2HB       GLU  36  -0.712  11.939  10.426
  244   1HG   GLU  36          1HG       GLU  36  -1.642  10.491  12.227
  245   2HG   GLU  36          2HG       GLU  36  -2.184  11.921  13.121
  246    HA   PRO  37           HA       PRO  37   3.642  14.817  11.468
  247   1HB   PRO  37          1HB       PRO  37   5.832  14.108  12.894
  248   2HB   PRO  37          2HB       PRO  37   4.419  14.854  13.691
  249   1HG   PRO  37          1HG       PRO  37   4.964  11.869  13.415
  250   2HG   PRO  37          2HG       PRO  37   4.710  12.777  14.942
  251   1HD   PRO  37          1HD       PRO  37   2.663  11.522  13.719
  252   2HD   PRO  37          2HD       PRO  37   2.455  13.165  14.405
  253    H    ASN  38           H        ASN  38   3.426  11.481  10.856
  254    HA   ASN  38           HA       ASN  38   4.223  10.149   9.246
  255   1HB   ASN  38          1HB       ASN  38   3.998  12.116   7.784
  256   2HB   ASN  38          2HB       ASN  38   5.660  12.596   8.110
  257   1HD2  ASN  38          2HD2      ASN  38   5.095  12.323   5.545
  258   2HD2  ASN  38          1HD2      ASN  38   5.808  10.843   4.908
  259    H    VAL  39           H        VAL  39   7.010  12.313   9.840
  260    HA   VAL  39           HA       VAL  39   8.946  10.432   9.295
  261    HB   VAL  39           HB       VAL  39   9.135  12.910  11.030
  262   1HG1  VAL  39          1HG1      VAL  39  11.362  11.165   9.879
  263   2HG1  VAL  39          2HG1      VAL  39  11.583  12.781  10.579
  264   3HG1  VAL  39          3HG1      VAL  39  11.047  11.448  11.605
  265   1HG2  VAL  39          1HG2      VAL  39   9.858  12.334   8.131
  266   2HG2  VAL  39          2HG2      VAL  39   8.478  13.302   8.690
  267   3HG2  VAL  39          3HG2      VAL  39  10.125  13.861   8.992
  268    HA   PRO  40           HA       PRO  40   9.641   8.871  13.675
  269   1HB   PRO  40          1HB       PRO  40   8.171   9.617  15.835
  270   2HB   PRO  40          2HB       PRO  40   9.541  10.591  15.227
  271   1HG   PRO  40          1HG       PRO  40   6.602  10.965  14.635
  272   2HG   PRO  40          2HG       PRO  40   7.755  12.207  15.197
  273   1HD   PRO  40          1HD       PRO  40   7.201  11.975  12.543
  274   2HD   PRO  40          2HD       PRO  40   8.866  12.275  13.118
  275    H    CYS  41           H        CYS  41   6.252   9.484  12.799
  276    HA   CYS  41           HA       CYS  41   5.032   7.292  14.116
  277   1HB   CYS  41          1HB       CYS  41   3.879   9.279  13.047
  278   2HB   CYS  41          2HB       CYS  41   4.212   8.539  11.478
  279    H    LEU  42           H        LEU  42   6.478   7.630  10.917
  280    HA   LEU  42           HA       LEU  42   7.162   6.236   9.334
  281   1HB   LEU  42          1HB       LEU  42   8.892   6.391  11.057
  282   2HB   LEU  42          2HB       LEU  42   8.302   4.911  11.805
  283    HG   LEU  42           HG       LEU  42   8.974   3.615   9.797
  284   1HD1  LEU  42          1HD1      LEU  42   9.886   6.315   8.709
  285   2HD1  LEU  42          2HD1      LEU  42  10.364   4.742   8.038
  286   3HD1  LEU  42          3HD1      LEU  42   8.672   5.230   7.992
  287   1HD2  LEU  42          1HD2      LEU  42  10.580   3.993  11.628
  288   2HD2  LEU  42          2HD2      LEU  42  11.390   3.861  10.058
  289   3HD2  LEU  42          3HD2      LEU  42  11.170   5.456  10.812
  290    H    VAL  43           H        VAL  43   5.282   5.301   8.483
  291    HA   VAL  43           HA       VAL  43   4.577   2.511   9.146
  292    HB   VAL  43           HB       VAL  43   3.743   4.293   6.804
  293   1HG1  VAL  43          1HG1      VAL  43   2.658   1.617   7.781
  294   2HG1  VAL  43          2HG1      VAL  43   1.692   2.753   6.821
  295   3HG1  VAL  43          3HG1      VAL  43   3.133   2.060   6.122
  296   1HG2  VAL  43          1HG2      VAL  43   3.090   5.186   9.036
  297   2HG2  VAL  43          2HG2      VAL  43   1.673   4.630   8.136
  298   3HG2  VAL  43          3HG2      VAL  43   2.342   3.635   9.444
  299    H    ARG  44           H        ARG  44   7.338   2.836   8.716
  300    HA   ARG  44           HA       ARG  44   9.148   2.167   7.612
  301   1HB   ARG  44          1HB       ARG  44   7.187   0.167   6.417
  302   2HB   ARG  44          2HB       ARG  44   8.913   0.179   6.092
  303   1HG   ARG  44          1HG       ARG  44   8.555  -1.420   7.740
  304   2HG   ARG  44          2HG       ARG  44   9.414  -0.087   8.506
  305   1HD   ARG  44          1HD       ARG  44   6.378  -0.307   8.671
  306   2HD   ARG  44          2HD       ARG  44   7.377  -1.317   9.704
  307    HE   ARG  44           HE       ARG  44   6.836   1.493  10.050
  308   1HH1  ARG  44          1HH1      ARG  44   9.305  -0.962  10.666
  309   2HH1  ARG  44          2HH1      ARG  44   9.949  -0.134  12.060
  310   1HH2  ARG  44          1HH2      ARG  44   7.655   2.571  11.726
  311   2HH2  ARG  44          2HH2      ARG  44   8.971   1.953  12.712
  312    H    VAL  45           H        VAL  45   6.675   2.081   5.015
  313    HA   VAL  45           HA       VAL  45   8.656   2.704   3.024
  314    HB   VAL  45           HB       VAL  45   6.763   2.584   1.425
  315   1HG1  VAL  45          1HG1      VAL  45   8.151   0.647   1.993
  316   2HG1  VAL  45          2HG1      VAL  45   7.084   0.249   3.357
  317   3HG1  VAL  45          3HG1      VAL  45   6.473   0.167   1.692
  318   1HG2  VAL  45          1HG2      VAL  45   4.885   3.250   3.042
  319   2HG2  VAL  45          2HG2      VAL  45   4.592   1.723   2.187
  320   3HG2  VAL  45          3HG2      VAL  45   5.109   1.695   3.861
  321    H    CYS  46           H        CYS  46   9.271   4.673   4.204
  322    HA   CYS  46           HA       CYS  46   7.996   7.219   3.506
  323   1HB   CYS  46          1HB       CYS  46   9.619   6.866   5.392
  324   2HB   CYS  46          2HB       CYS  46  10.844   6.431   4.181
  325    H    HIS  47           H        HIS  47   7.652   6.018   1.283
  326    HA   HIS  47           HA       HIS  47   9.990   6.365  -0.553
  327   1HB   HIS  47          1HB       HIS  47   9.868   4.067  -0.069
  328   2HB   HIS  47          2HB       HIS  47   8.105   4.069  -0.038
  329    HD1  HIS  47           HD1      HIS  47   6.826   3.676  -2.241
  330    HD2  HIS  47           HD2      HIS  47  10.991   4.096  -2.623
  331    HE1  HIS  47           HE1      HIS  47   7.388   2.976  -4.593
  332    H    GLN  48           H        GLN  48   9.573   7.576  -2.119
  333    HA   GLN  48           HA       GLN  48   7.567   9.127  -2.843
  334   1HB   GLN  48          1HB       GLN  48   8.429   9.426  -4.967
  335   2HB   GLN  48          2HB       GLN  48   9.780   8.986  -3.936
  336   1HG   GLN  48          1HG       GLN  48  10.318   7.647  -5.662
  337   2HG   GLN  48          2HG       GLN  48   9.195   6.505  -4.935
  338   1HE2  GLN  48          2HE2      GLN  48   6.998   6.368  -5.982
  339   2HE2  GLN  48          1HE2      GLN  48   6.787   6.929  -7.636
  340    H    ASP  49           H        ASP  49   5.483   9.132  -3.573
  341    HA   ASP  49           HA       ASP  49   4.496   7.178  -5.400
  342   1HB   ASP  49          1HB       ASP  49   4.607   5.835  -3.139
  343   2HB   ASP  49          2HB       ASP  49   3.382   6.979  -2.581
  344    H    CYS  50           H        CYS  50   2.270   7.716  -6.024
  345    HA   CYS  50           HA       CYS  50   1.353  10.355  -5.229
  346   1HB   CYS  50          1HB       CYS  50  -0.223  10.228  -6.820
  347   2HB   CYS  50          2HB       CYS  50   0.903   9.037  -7.475
  348    H    VAL  51           H        VAL  51  -0.219  10.916  -3.744
  349    HA   VAL  51           HA       VAL  51  -1.631   8.793  -2.235
  350    HB   VAL  51           HB       VAL  51  -0.968   9.861  -0.100
  351   1HG1  VAL  51          1HG1      VAL  51   0.301   7.888  -0.941
  352   2HG1  VAL  51          2HG1      VAL  51   1.522   8.989  -1.612
  353   3HG1  VAL  51          3HG1      VAL  51   1.226   8.951   0.136
  354   1HG2  VAL  51          1HG2      VAL  51   0.998  11.463  -1.790
  355   2HG2  VAL  51          2HG2      VAL  51  -0.380  12.123  -0.894
  356   3HG2  VAL  51          3HG2      VAL  51   0.973  11.393  -0.014
  357    H    CYS  52           H        CYS  52  -3.272   9.788  -0.859
  358    HA   CYS  52           HA       CYS  52  -5.137  11.560  -1.856
  359   1HB   CYS  52          1HB       CYS  52  -5.525  10.245   0.068
  360   2HB   CYS  52          2HB       CYS  52  -4.160  11.005   0.912
  361    H    GLU  53           H        GLU  53  -5.363  13.631  -2.241
  362    HA   GLU  53           HA       GLU  53  -3.309  15.376  -2.566
  363   1HB   GLU  53          1HB       GLU  53  -5.622  15.672  -3.396
  364   2HB   GLU  53          2HB       GLU  53  -6.149  16.113  -1.762
  365   1HG   GLU  53          1HG       GLU  53  -4.590  18.092  -1.852
  366   2HG   GLU  53          2HG       GLU  53  -4.147  17.623  -3.505
  367    H    GLU  54           H        GLU  54  -1.926  16.412  -1.287
  368    HA   GLU  54           HA       GLU  54  -1.869  16.245   1.527
  369   1HB   GLU  54          1HB       GLU  54  -0.416  18.136  -0.372
  370   2HB   GLU  54          2HB       GLU  54  -0.005  17.894   1.327
  371   1HG   GLU  54          1HG       GLU  54   0.038  15.710  -0.816
  372   2HG   GLU  54          2HG       GLU  54   1.450  16.554  -0.168
  373    H    GLY  55           H        GLY  55  -3.921  16.876   2.120
  374   1HA   GLY  55          1HA       GLY  55  -4.332  19.433   3.282
  375   2HA   GLY  55          2HA       GLY  55  -5.123  19.391   1.686
  376    H    PHE  56           H        PHE  56  -5.828  16.711   1.445
  377    HA   PHE  56           HA       PHE  56  -8.015  16.369   3.404
  378   1HB   PHE  56          1HB       PHE  56  -7.057  15.028   0.880
  379   2HB   PHE  56          2HB       PHE  56  -8.264  14.274   1.929
  380    HD1  PHE  56           HD1      PHE  56  -7.608  17.352  -0.150
  381    HD2  PHE  56           HD2      PHE  56 -10.524  14.653   1.517
  382    HE1  PHE  56           HE1      PHE  56  -9.338  18.275  -1.652
  383    HE2  PHE  56           HE2      PHE  56 -12.233  15.546   0.003
  384    HZ   PHE  56           HZ       PHE  56 -11.672  17.422  -1.552
  385    H    TYR  57           H        TYR  57  -8.068  14.408   4.618
  386    HA   TYR  57           HA       TYR  57  -5.433  13.259   5.339
  387   1HB   TYR  57          1HB       TYR  57  -8.137  13.261   6.743
  388   2HB   TYR  57          2HB       TYR  57  -6.735  12.342   7.279
  389    HD1  TYR  57           HD1      TYR  57  -7.982  15.814   6.648
  390    HD2  TYR  57           HD2      TYR  57  -4.974  13.374   8.546
  391    HE1  TYR  57           HE1      TYR  57  -6.934  17.841   7.562
  392    HE2  TYR  57           HE2      TYR  57  -3.821  15.434   9.329
  393    HH   TYR  57           HH       TYR  57  -5.139  18.699   8.743
  394    H    ARG  58           H        ARG  58  -5.109  11.086   5.134
  395    HA   ARG  58           HA       ARG  58  -6.946   9.646   3.283
  396   1HB   ARG  58          1HB       ARG  58  -5.059   8.019   3.100
  397   2HB   ARG  58          2HB       ARG  58  -4.832   9.594   2.397
  398   1HG   ARG  58          1HG       ARG  58  -3.735   9.649   5.073
  399   2HG   ARG  58          2HG       ARG  58  -3.177   8.189   4.271
  400   1HD   ARG  58          1HD       ARG  58  -1.615   9.970   3.861
  401   2HD   ARG  58          2HD       ARG  58  -2.439   9.604   2.341
  402    HE   ARG  58           HE       ARG  58  -3.857  11.682   3.728
  403   1HH1  ARG  58          1HH1      ARG  58  -0.779  11.187   2.110
  404   2HH1  ARG  58          2HH1      ARG  58  -0.758  12.752   1.334
  405   1HH2  ARG  58          1HH2      ARG  58  -3.853  13.803   2.728
  406   2HH2  ARG  58          2HH2      ARG  58  -2.711  14.033   1.428
  407    H    ASN  59           H        ASN  59  -8.557   9.414   4.901
  408    HA   ASN  59           HA       ASN  59  -7.971   8.248   7.469
  409   1HB   ASN  59          1HB       ASN  59  -9.929   9.691   6.982
  410   2HB   ASN  59          2HB       ASN  59 -10.624   8.369   6.005
  411   1HD2  ASN  59          2HD2      ASN  59 -12.437   8.938   7.745
  412   2HD2  ASN  59          1HD2      ASN  59 -12.322   7.966   9.195
  413    H    LYS  60           H        LYS  60  -8.060   6.160   8.131
  414    HA   LYS  60           HA       LYS  60  -7.542   3.945   7.869
  415   1HB   LYS  60          1HB       LYS  60  -9.677   2.659   7.442
  416   2HB   LYS  60          2HB       LYS  60  -9.647   3.853   8.727
  417   1HG   LYS  60          1HG       LYS  60 -10.886   5.480   7.269
  418   2HG   LYS  60          2HG       LYS  60 -11.003   4.275   6.016
  419   1HD   LYS  60          1HD       LYS  60 -12.959   3.750   6.999
  420   2HD   LYS  60          2HD       LYS  60 -11.977   2.838   8.146
  421   1HE   LYS  60          1HE       LYS  60 -13.079   5.677   8.444
  422   2HE   LYS  60          2HE       LYS  60 -13.551   4.238   9.357
  423   1HZ   LYS  60          1HZ       LYS  60 -11.294   4.200  10.248
  424   2HZ   LYS  60          2HZ       LYS  60 -10.972   5.638   9.497
  425   3HZ   LYS  60          3HZ       LYS  60 -12.149   5.549  10.653
  426    H    ASP  61           H        ASP  61  -9.672   3.266   5.249
  427    HA   ASP  61           HA       ASP  61  -7.458   2.021   3.809
  428   1HB   ASP  61          1HB       ASP  61  -9.602   0.859   4.105
  429   2HB   ASP  61          2HB       ASP  61 -10.446   2.151   3.234
  430    H    ASP  62           H        ASP  62  -6.597   4.341   3.681
  431    HA   ASP  62           HA       ASP  62  -6.163   6.271   2.619
  432   1HB   ASP  62          1HB       ASP  62  -5.450   6.045   0.304
  433   2HB   ASP  62          2HB       ASP  62  -4.929   4.674   1.284
  434    H    LYS  63           H        LYS  63  -8.850   6.280   3.294
  435    HA   LYS  63           HA       LYS  63 -10.376   7.285   1.003
  436   1HB   LYS  63          1HB       LYS  63 -10.954   7.295   3.988
  437   2HB   LYS  63          2HB       LYS  63 -12.099   7.760   2.732
  438   1HG   LYS  63          1HG       LYS  63 -10.815   5.000   2.842
  439   2HG   LYS  63          2HG       LYS  63 -12.300   5.398   3.702
  440   1HD   LYS  63          1HD       LYS  63 -13.497   5.894   1.712
  441   2HD   LYS  63          2HD       LYS  63 -12.045   5.857   0.700
  442   1HE   LYS  63          1HE       LYS  63 -12.980   3.404   2.236
  443   2HE   LYS  63          2HE       LYS  63 -13.559   3.786   0.606
  444   1HZ   LYS  63          1HZ       LYS  63 -10.713   3.499   1.276
  445   2HZ   LYS  63          2HZ       LYS  63 -11.642   2.305   0.632
  446   3HZ   LYS  63          3HZ       LYS  63 -11.373   3.694  -0.213
  447    H    CYS  64           H        CYS  64  -9.395   9.075   0.175
  448    HA   CYS  64           HA       CYS  64  -8.414  11.263   1.663
  449   1HB   CYS  64          1HB       CYS  64  -8.302  10.660  -0.948
  450   2HB   CYS  64          2HB       CYS  64  -9.617  11.795  -1.043
  451    H    VAL  65           H        VAL  65  -9.658  11.945   3.312
  452    HA   VAL  65           HA       VAL  65 -12.256  13.291   2.658
  453    HB   VAL  65           HB       VAL  65 -13.142  12.493   4.786
  454   1HG1  VAL  65          1HG1      VAL  65 -13.584  11.184   2.745
  455   2HG1  VAL  65          2HG1      VAL  65 -12.184  10.154   3.105
  456   3HG1  VAL  65          3HG1      VAL  65 -13.568  10.183   4.208
  457   1HG2  VAL  65          1HG2      VAL  65 -10.549  10.897   5.022
  458   2HG2  VAL  65          2HG2      VAL  65 -11.076  12.194   6.094
  459   3HG2  VAL  65          3HG2      VAL  65 -11.971  10.671   6.036
  460    H    SER  66           H        SER  66 -12.814  14.605   4.855
  461    HA   SER  66           HA       SER  66 -10.466  16.351   5.402
  462   1HB   SER  66          1HB       SER  66 -12.648  17.423   4.927
  463   2HB   SER  66          2HB       SER  66 -13.395  16.485   6.246
  464    HG   SER  66           HG       SER  66 -12.787  18.634   6.863
  465    H    ALA  67           H        ALA  67  -9.911  16.751   7.638
  466    HA   ALA  67           HA       ALA  67  -9.572  14.647   9.471
  467   1HB   ALA  67          1HB       ALA  67  -9.912  17.658   9.877
  468   2HB   ALA  67          2HB       ALA  67  -9.413  16.549  11.161
  469   3HB   ALA  67          3HB       ALA  67  -8.388  16.755   9.732
  470    H    GLU  68           H        GLU  68 -12.204  16.934   9.037
  471    HA   GLU  68           HA       GLU  68 -13.849  16.498  11.233
  472   1HB   GLU  68          1HB       GLU  68 -14.649  16.943   8.328
  473   2HB   GLU  68          2HB       GLU  68 -15.672  17.249   9.736
  474   1HG   GLU  68          1HG       GLU  68 -14.225  19.032  10.511
  475   2HG   GLU  68          2HG       GLU  68 -12.987  18.680   9.304
  476    H    ASP  69           H        ASP  69 -13.639  14.528   8.225
  477    HA   ASP  69           HA       ASP  69 -15.910  12.828   8.814
  478   1HB   ASP  69          1HB       ASP  69 -15.021  12.920   6.544
  479   2HB   ASP  69          2HB       ASP  69 -13.423  12.406   7.117
  480    H    CYS  70           H        CYS  70 -12.378  12.703   9.461
  481    HA   CYS  70           HA       CYS  70 -12.571  10.076  10.618
  482   1HB   CYS  70          1HB       CYS  70 -10.417  11.138   9.676
  483   2HB   CYS  70          2HB       CYS  70 -10.326  11.974  11.243
  484    H    GLU  71           H        GLU  71 -12.748  13.404  11.911
  485    HA   GLU  71           HA       GLU  71 -12.787  12.783  14.658
  486   1HB   GLU  71          1HB       GLU  71 -12.945  15.124  13.565
  487   2HB   GLU  71          2HB       GLU  71 -14.670  14.817  13.401
  488   1HG   GLU  71          1HG       GLU  71 -14.809  14.375  15.874
  489   2HG   GLU  71          2HG       GLU  71 -13.087  14.758  16.005
  490    H    LEU  72           H        LEU  72 -15.533  13.014  12.370
  491    HA   LEU  72           HA       LEU  72 -17.576  12.076  14.061
  492   1HB   LEU  72          1HB       LEU  72 -17.185  12.190  11.090
  493   2HB   LEU  72          2HB       LEU  72 -18.434  11.109  11.711
  494    HG   LEU  72           HG       LEU  72 -19.490  12.930  12.959
  495   1HD1  LEU  72          1HD1      LEU  72 -17.518  14.423  13.327
  496   2HD1  LEU  72          2HD1      LEU  72 -17.497  14.785  11.586
  497   3HD1  LEU  72          3HD1      LEU  72 -18.876  15.272  12.583
  498   1HD2  LEU  72          1HD2      LEU  72 -20.219  12.391  10.668
  499   2HD2  LEU  72          2HD2      LEU  72 -20.398  14.123  11.001
  500   3HD2  LEU  72          3HD2      LEU  72 -19.041  13.546  10.009
  501    H    ASP  73           H        ASP  73 -15.562  10.170  11.847
  502    HA   ASP  73           HA       ASP  73 -15.836   7.858  11.458
  503   1HB   ASP  73          1HB       ASP  73 -13.583   8.458  11.966
  504   2HB   ASP  73          2HB       ASP  73 -13.879   8.381  13.716
  505    H    ASN  74           H        ASN  74 -15.466   7.819  15.050
  506    HA   ASN  74           HA       ASN  74 -17.108   5.388  14.982
  507   1HB   ASN  74          1HB       ASN  74 -16.230   4.778  17.034
  508   2HB   ASN  74          2HB       ASN  74 -14.894   5.345  16.013
  509   1HD2  ASN  74          2HD2      ASN  74 -15.406   5.209  19.089
  510   2HD2  ASN  74          1HD2      ASN  74 -15.000   6.803  19.666
  511    H    MET  75           H        MET  75 -16.948   8.432  16.905
  512    HA   MET  75           HA       MET  75 -19.910   8.425  17.232
  513   1HB   MET  75          1HB       MET  75 -17.928   8.393  19.551
  514   2HB   MET  75          2HB       MET  75 -19.680   8.590  19.690
  515   1HG   MET  75          1HG       MET  75 -19.964   6.317  18.664
  516   2HG   MET  75          2HG       MET  75 -18.216   6.083  18.833
  517   1HE   MET  75          1HE       MET  75 -16.955   6.031  21.184
  518   2HE   MET  75          2HE       MET  75 -17.693   7.569  21.703
  519   3HE   MET  75          3HE       MET  75 -17.794   6.137  22.746
  520    H    ASP  76           H        ASP  76 -17.517  10.262  16.156
  521    HA   ASP  76           HA       ASP  76 -16.875  12.433  16.184
  522   1HB   ASP  76          1HB       ASP  76 -19.162  13.059  15.766
  523   2HB   ASP  76          2HB       ASP  76 -19.555  13.016  17.489
  524    H    PHE  77           H        PHE  77 -18.501  12.118  19.327
  525    HA   PHE  77           HA       PHE  77 -16.223  13.188  20.848
  526   1HB   PHE  77          1HB       PHE  77 -18.703  11.704  21.819
  527   2HB   PHE  77          2HB       PHE  77 -17.612  12.696  22.772
  528    HD1  PHE  77           HD1      PHE  77 -20.383  12.656  20.315
  529    HD2  PHE  77           HD2      PHE  77 -17.803  15.179  22.693
  530    HE1  PHE  77           HE1      PHE  77 -21.876  14.582  19.897
  531    HE2  PHE  77           HE2      PHE  77 -19.406  17.054  22.399
  532    HZ   PHE  77           HZ       PHE  77 -21.397  16.783  20.951
  533    H    ILE  78           H        ILE  78 -14.905  11.532  19.549
  534    HA   ILE  78           HA       ILE  78 -15.183   8.912  19.415
  535    HB   ILE  78           HB       ILE  78 -12.594  10.379  19.983
  536   1HG1  ILE  78          1HG1      ILE  78 -12.925   9.637  17.214
  537   2HG1  ILE  78          2HG1      ILE  78 -14.419  10.396  17.724
  538   1HG2  ILE  78          1HG2      ILE  78 -12.135   7.992  20.257
  539   2HG2  ILE  78          2HG2      ILE  78 -12.867   7.648  18.678
  540   3HG2  ILE  78          3HG2      ILE  78 -11.391   8.621  18.786
  541   1HD1  ILE  78          1HD1      ILE  78 -13.059  12.294  18.704
  542   2HD1  ILE  78          2HD1      ILE  78 -11.625  11.558  17.961
  543   3HD1  ILE  78          3HD1      ILE  78 -12.972  12.140  16.943
  544    H    TYR  79           H        TYR  79 -13.807  10.462  22.208
  545    HA   TYR  79           HA       TYR  79 -14.770   8.463  24.032
  546   1HB   TYR  79          1HB       TYR  79 -11.836   9.332  24.083
  547   2HB   TYR  79          2HB       TYR  79 -12.613   8.283  25.258
  548    HD1  TYR  79           HD1      TYR  79 -13.982   6.211  23.906
  549    HD2  TYR  79           HD2      TYR  79 -10.238   8.087  22.891
  550    HE1  TYR  79           HE1      TYR  79 -13.362   4.242  22.533
  551    HE2  TYR  79           HE2      TYR  79  -9.593   6.088  21.592
  552    HH   TYR  79           HH       TYR  79 -10.453   4.213  20.484
  553    HA   PRO  80           HA       PRO  80 -15.564  12.284  26.212
  554   1HB   PRO  80          1HB       PRO  80 -13.640  11.489  28.411
  555   2HB   PRO  80          2HB       PRO  80 -15.265  12.224  28.555
  556   1HG   PRO  80          1HG       PRO  80 -14.997   9.555  28.900
  557   2HG   PRO  80          2HG       PRO  80 -16.311  10.158  27.843
  558   1HD   PRO  80          1HD       PRO  80 -13.589   9.124  27.035
  559   2HD   PRO  80          2HD       PRO  80 -15.186   8.674  26.361
  560    H    GLY  81           H        GLY  81 -14.747  13.977  25.059
  561   1HA   GLY  81          1HA       GLY  81 -12.501  15.501  25.450
  562   2HA   GLY  81          2HA       GLY  81 -11.970  14.182  24.380
  563    H    THR  82           H        THR  82 -11.752  16.019  22.812
  564    HA   THR  82           HA       THR  82 -12.368  17.382  21.160
  565    HB   THR  82           HB       THR  82 -14.028  16.764  19.591
  566    HG1  THR  82           HG1      THR  82 -15.160  15.234  21.682
  567   1HG2  THR  82          1HG2      THR  82 -12.049  15.214  19.800
  568   2HG2  THR  82          2HG2      THR  82 -13.085  14.109  20.742
  569   3HG2  THR  82          3HG2      THR  82 -13.505  14.511  19.069
  570    H    ARG  83           H        ARG  83 -15.707  17.423  21.128
  571    HA   ARG  83           HA       ARG  83 -15.781  20.081  22.416
  572   1HB   ARG  83          1HB       ARG  83 -17.988  18.452  21.094
  573   2HB   ARG  83          2HB       ARG  83 -18.046  20.172  21.521
  574   1HG   ARG  83          1HG       ARG  83 -16.188  20.595  19.887
  575   2HG   ARG  83          2HG       ARG  83 -16.193  18.875  19.462
  576   1HD   ARG  83          1HD       ARG  83 -18.675  19.143  18.851
  577   2HD   ARG  83          2HD       ARG  83 -18.437  20.879  19.043
  578    HE   ARG  83           HE       ARG  83 -17.259  20.968  17.069
  579   1HH1  ARG  83          1HH1      ARG  83 -17.616  17.561  18.014
  580   2HH1  ARG  83          2HH1      ARG  83 -16.989  16.939  16.520
  581   1HH2  ARG  83          1HH2      ARG  83 -16.343  20.146  15.141
  582   2HH2  ARG  83          2HH2      ARG  83 -16.101  18.425  14.953
  583    H    ASN  84           H        ASN  84 -15.062  18.376  24.374
  584    HA   ASN  84           HA       ASN  84 -17.104  16.748  25.435
  585   1HB   ASN  84          1HB       ASN  84 -14.635  16.616  25.918
  586   2HB   ASN  84          2HB       ASN  84 -14.838  17.930  27.078
  587   1HD2  ASN  84          2HD2      ASN  84 -16.466  17.486  28.967
  588   2HD2  ASN  84          1HD2      ASN  84 -16.617  15.807  29.429
  589    HA   PRO  85           HA       PRO  85 -19.770  19.820  27.483
  590   1HB   PRO  85          1HB       PRO  85 -20.075  17.463  29.366
  591   2HB   PRO  85          2HB       PRO  85 -21.338  18.598  28.801
  592   1HG   PRO  85          1HG       PRO  85 -21.109  16.174  27.619
  593   2HG   PRO  85          2HG       PRO  85 -21.285  17.630  26.592
  594   1HD   PRO  85          1HD       PRO  85 -18.754  16.114  27.256
  595   2HD   PRO  85          2HD       PRO  85 -19.311  16.780  25.689
  Start of MODEL    5
    1   1H    LYS   1          1H        LYS   1   2.623  18.010  -6.955
    2   2H    LYS   1          2H        LYS   1   2.341  19.470  -7.685
    3   3H    LYS   1          3H        LYS   1   1.090  18.599  -7.045
    4    HA   LYS   1           HA       LYS   1   1.014  18.368  -9.357
    5   1HB   LYS   1          1HB       LYS   1   2.892  17.346 -10.586
    6   2HB   LYS   1          2HB       LYS   1   3.326  18.906  -9.876
    7   1HG   LYS   1          1HG       LYS   1   4.558  17.811  -8.066
    8   2HG   LYS   1          2HG       LYS   1   4.001  16.213  -8.607
    9   1HD   LYS   1          1HD       LYS   1   5.194  16.459 -10.731
   10   2HD   LYS   1          2HD       LYS   1   5.695  18.103 -10.297
   11   1HE   LYS   1          1HE       LYS   1   7.510  16.462  -9.953
   12   2HE   LYS   1          2HE       LYS   1   7.049  17.240  -8.429
   13   1HZ   LYS   1          1HZ       LYS   1   6.062  14.609  -9.305
   14   2HZ   LYS   1          2HZ       LYS   1   7.340  14.835  -8.278
   15   3HZ   LYS   1          3HZ       LYS   1   5.828  15.320  -7.845
   16    H    ALA   2           H        ALA   2   0.672  16.275 -10.490
   17    HA   ALA   2           HA       ALA   2   0.276  13.993  -8.616
   18   1HB   ALA   2          1HB       ALA   2  -0.678  14.467 -11.473
   19   2HB   ALA   2          2HB       ALA   2  -1.019  13.032 -10.484
   20   3HB   ALA   2          3HB       ALA   2  -1.660  14.614  -9.997
   21    H    THR   3           H        THR   3   1.655  12.186  -8.817
   22    HA   THR   3           HA       THR   3   3.036  11.624 -11.266
   23    HB   THR   3           HB       THR   3   4.778  12.060  -8.800
   24    HG1  THR   3           HG1      THR   3   3.977  13.883 -10.751
   25   1HG2  THR   3          1HG2      THR   3   5.447  11.824 -11.772
   26   2HG2  THR   3          2HG2      THR   3   6.612  12.082 -10.460
   27   3HG2  THR   3          3HG2      THR   3   5.720  10.559 -10.554
   28    H    MET   4           H        MET   4   3.909   9.363 -11.051
   29    HA   MET   4           HA       MET   4   3.520   7.209 -10.546
   30   1HB   MET   4          1HB       MET   4   3.111   8.013  -7.625
   31   2HB   MET   4          2HB       MET   4   3.440   6.408  -8.283
   32   1HG   MET   4          1HG       MET   4   5.502   7.003  -7.547
   33   2HG   MET   4          2HG       MET   4   5.594   7.405  -9.263
   34   1HE   MET   4          1HE       MET   4   7.772   8.281  -7.346
   35   2HE   MET   4          2HE       MET   4   7.711   8.847  -9.034
   36   3HE   MET   4          3HE       MET   4   7.981  10.013  -7.719
   37    H    GLN   5           H        GLN   5   1.510   6.189  -8.561
   38    HA   GLN   5           HA       GLN   5  -0.510   6.030 -10.503
   39   1HB   GLN   5          1HB       GLN   5  -0.054   4.211  -8.978
   40   2HB   GLN   5          2HB       GLN   5  -0.473   5.205  -7.576
   41   1HG   GLN   5          1HG       GLN   5  -2.250   3.638  -8.087
   42   2HG   GLN   5          2HG       GLN   5  -2.839   5.279  -8.293
   43   1HE2  GLN   5          2HE2      GLN   5  -2.941   6.122 -10.643
   44   2HE2  GLN   5          1HE2      GLN   5  -3.285   4.908 -11.864
   45    H    CYS   6           H        CYS   6  -0.648   7.585  -7.285
   46    HA   CYS   6           HA       CYS   6  -2.066   9.017  -6.294
   47   1HB   CYS   6          1HB       CYS   6  -2.614  10.054  -9.101
   48   2HB   CYS   6          2HB       CYS   6  -3.155  10.810  -7.615
   49    H    GLY   7           H        GLY   7  -3.910   8.233  -9.257
   50   1HA   GLY   7          1HA       GLY   7  -5.876   7.109  -9.561
   51   2HA   GLY   7          2HA       GLY   7  -5.719   6.445  -7.929
   52    H    GLU   8           H        GLU   8  -6.066   8.277  -6.181
   53    HA   GLU   8           HA       GLU   8  -8.759   9.466  -6.747
   54   1HB   GLU   8          1HB       GLU   8  -7.465   8.776  -4.072
   55   2HB   GLU   8          2HB       GLU   8  -9.118   9.360  -4.343
   56   1HG   GLU   8          1HG       GLU   8  -9.510   7.341  -5.828
   57   2HG   GLU   8          2HG       GLU   8  -7.963   6.701  -5.251
   58    H    ASN   9           H        ASN   9  -8.759  11.290  -4.602
   59    HA   ASN   9           HA       ASN   9  -7.538  13.555  -5.873
   60   1HB   ASN   9          1HB       ASN   9  -9.747  13.514  -4.737
   61   2HB   ASN   9          2HB       ASN   9  -8.942  13.328  -3.177
   62   1HD2  ASN   9          2HD2      ASN   9  -7.371  15.101  -2.591
   63   2HD2  ASN   9          1HD2      ASN   9  -7.791  16.751  -3.085
   64    H    GLU  10           H        GLU  10  -5.334  12.503  -5.757
   65    HA   GLU  10           HA       GLU  10  -3.912  13.023  -3.200
   66   1HB   GLU  10          1HB       GLU  10  -3.304  11.009  -5.392
   67   2HB   GLU  10          2HB       GLU  10  -2.445  11.200  -3.873
   68   1HG   GLU  10          1HG       GLU  10  -4.918  10.767  -2.875
   69   2HG   GLU  10          2HG       GLU  10  -5.141   9.983  -4.438
   70    H    LYS  11           H        LYS  11  -1.679  13.578  -3.348
   71    HA   LYS  11           HA       LYS  11  -0.740  14.930  -5.808
   72   1HB   LYS  11          1HB       LYS  11  -1.613  16.714  -4.449
   73   2HB   LYS  11          2HB       LYS  11  -0.887  16.041  -2.974
   74   1HG   LYS  11          1HG       LYS  11   1.341  16.572  -3.779
   75   2HG   LYS  11          2HG       LYS  11   0.693  17.141  -5.331
   76   1HD   LYS  11          1HD       LYS  11  -0.479  18.971  -4.213
   77   2HD   LYS  11          2HD       LYS  11  -0.035  18.349  -2.614
   78   1HE   LYS  11          1HE       LYS  11   1.995  19.266  -4.704
   79   2HE   LYS  11          2HE       LYS  11   1.377  20.281  -3.389
   80   1HZ   LYS  11          1HZ       LYS  11   2.811  17.749  -2.988
   81   2HZ   LYS  11          2HZ       LYS  11   3.456  19.257  -2.840
   82   3HZ   LYS  11          3HZ       LYS  11   2.258  18.778  -1.818
   83    H    TYR  12           H        TYR  12   1.531  14.917  -5.942
   84    HA   TYR  12           HA       TYR  12   2.945  12.672  -5.069
   85   1HB   TYR  12          1HB       TYR  12   3.645  13.902  -6.988
   86   2HB   TYR  12          2HB       TYR  12   3.773  15.403  -6.066
   87    HD1  TYR  12           HD1      TYR  12   5.319  12.025  -6.482
   88    HD2  TYR  12           HD2      TYR  12   5.726  15.981  -4.823
   89    HE1  TYR  12           HE1      TYR  12   7.643  11.509  -5.809
   90    HE2  TYR  12           HE2      TYR  12   7.993  15.416  -4.031
   91    HH   TYR  12           HH       TYR  12   9.361  13.583  -3.539
   92    H    ASP  13           H        ASP  13   4.353  12.266  -3.300
   93    HA   ASP  13           HA       ASP  13   5.233  14.459  -1.627
   94   1HB   ASP  13          1HB       ASP  13   2.923  13.859  -0.764
   95   2HB   ASP  13          2HB       ASP  13   3.560  12.283  -0.312
   96    H    SER  14           H        SER  14   7.047  13.883  -0.374
   97    HA   SER  14           HA       SER  14   8.562  11.746  -1.691
   98   1HB   SER  14          1HB       SER  14   9.549  13.982   0.080
   99   2HB   SER  14          2HB       SER  14  10.506  12.992  -1.033
  100    HG   SER  14           HG       SER  14   9.784  15.147  -1.782
  101    H    CYS  15           H        CYS  15   6.902  10.593   0.532
  102    HA   CYS  15           HA       CYS  15   8.999   8.967   1.568
  103   1HB   CYS  15          1HB       CYS  15   9.497  10.863   3.118
  104   2HB   CYS  15          2HB       CYS  15   7.820  10.834   3.649
  105    H    GLY  16           H        GLY  16   7.352   7.574   0.564
  106   1HA   GLY  16          1HA       GLY  16   6.354   5.621   1.746
  107   2HA   GLY  16          2HA       GLY  16   5.206   6.736   2.483
  108    H    SER  17           H        SER  17   4.242   4.630   0.988
  109    HA   SER  17           HA       SER  17   3.576   5.450  -1.712
  110   1HB   SER  17          1HB       SER  17   2.014   3.526  -1.536
  111   2HB   SER  17          2HB       SER  17   3.702   3.131  -1.168
  112    HG   SER  17           HG       SER  17   2.415   2.241   0.441
  113    H    LYS  18           H        LYS  18   1.044   4.519   0.425
  114    HA   LYS  18           HA       LYS  18  -0.321   7.208   0.271
  115   1HB   LYS  18          1HB       LYS  18  -1.211   4.401   1.097
  116   2HB   LYS  18          2HB       LYS  18  -2.145   5.851   1.479
  117   1HG   LYS  18          1HG       LYS  18  -2.900   4.591  -0.542
  118   2HG   LYS  18          2HG       LYS  18  -2.637   6.329  -0.764
  119   1HD   LYS  18          1HD       LYS  18  -0.591   5.945  -1.993
  120   2HD   LYS  18          2HD       LYS  18  -0.592   4.217  -1.563
  121   1HE   LYS  18          1HE       LYS  18  -1.320   4.621  -3.895
  122   2HE   LYS  18          2HE       LYS  18  -2.563   3.810  -2.925
  123   1HZ   LYS  18          1HZ       LYS  18  -2.517   6.698  -3.487
  124   2HZ   LYS  18          2HZ       LYS  18  -3.426   5.586  -4.296
  125   3HZ   LYS  18          3HZ       LYS  18  -3.697   5.854  -2.696
  126    H    GLU  19           H        GLU  19   1.552   7.918   1.291
  127    HA   GLU  19           HA       GLU  19   2.818   7.266   3.495
  128   1HB   GLU  19          1HB       GLU  19   1.815  10.110   3.095
  129   2HB   GLU  19          2HB       GLU  19   3.261   9.570   3.979
  130   1HG   GLU  19          1HG       GLU  19   4.054   8.595   1.749
  131   2HG   GLU  19          2HG       GLU  19   2.775   9.530   0.969
  132    H    CYS  20           H        CYS  20   2.495   6.859   5.569
  133    HA   CYS  20           HA       CYS  20   0.104   6.943   7.028
  134   1HB   CYS  20          1HB       CYS  20   2.080   5.710   7.741
  135   2HB   CYS  20          2HB       CYS  20   2.972   7.213   8.005
  136    H    ASP  21           H        ASP  21   2.440   9.452   6.339
  137    HA   ASP  21           HA       ASP  21   1.963  11.665   7.747
  138   1HB   ASP  21          1HB       ASP  21   3.172  11.400   5.487
  139   2HB   ASP  21          2HB       ASP  21   1.609  11.605   4.709
  140    H    LYS  22           H        LYS  22  -0.368  10.488   5.255
  141    HA   LYS  22           HA       LYS  22  -2.294  12.608   6.093
  142   1HB   LYS  22          1HB       LYS  22  -2.316  10.745   3.709
  143   2HB   LYS  22          2HB       LYS  22  -3.445  12.067   4.003
  144   1HG   LYS  22          1HG       LYS  22  -0.477  12.366   3.435
  145   2HG   LYS  22          2HG       LYS  22  -1.839  12.781   2.380
  146   1HD   LYS  22          1HD       LYS  22  -2.627  14.416   4.155
  147   2HD   LYS  22          2HD       LYS  22  -1.069  14.169   4.969
  148   1HE   LYS  22          1HE       LYS  22  -1.562  15.299   2.182
  149   2HE   LYS  22          2HE       LYS  22  -0.896  16.137   3.596
  150   1HZ   LYS  22          1HZ       LYS  22   0.991  14.653   3.479
  151   2HZ   LYS  22          2HZ       LYS  22   0.387  13.952   2.116
  152   3HZ   LYS  22          3HZ       LYS  22   0.826  15.537   2.096
  153    H    LYS  23           H        LYS  23  -1.748   9.805   7.560
  154    HA   LYS  23           HA       LYS  23  -4.175   8.373   7.119
  155   1HB   LYS  23          1HB       LYS  23  -3.628   7.085   9.064
  156   2HB   LYS  23          2HB       LYS  23  -2.184   7.397   8.116
  157   1HG   LYS  23          1HG       LYS  23  -1.347   7.745  10.178
  158   2HG   LYS  23          2HG       LYS  23  -1.827   9.411   9.832
  159   1HD   LYS  23          1HD       LYS  23  -3.799   9.209  11.181
  160   2HD   LYS  23          2HD       LYS  23  -3.598   7.463  11.386
  161   1HE   LYS  23          1HE       LYS  23  -1.677   9.610  12.415
  162   2HE   LYS  23          2HE       LYS  23  -2.932   8.812  13.377
  163   1HZ   LYS  23          1HZ       LYS  23  -1.846   6.719  12.939
  164   2HZ   LYS  23          2HZ       LYS  23  -0.640   7.484  12.114
  165   3HZ   LYS  23          3HZ       LYS  23  -0.850   7.772  13.720
  166    H    CYS  24           H        CYS  24  -5.951   8.080   8.725
  167    HA   CYS  24           HA       CYS  24  -7.155  10.580   9.424
  168   1HB   CYS  24          1HB       CYS  24  -8.606   8.864   8.897
  169   2HB   CYS  24          2HB       CYS  24  -7.883   7.706  10.027
  170    H    LYS  25           H        LYS  25  -5.606  11.636  10.604
  171    HA   LYS  25           HA       LYS  25  -5.116  10.853  13.427
  172   1HB   LYS  25          1HB       LYS  25  -3.320  11.557  11.685
  173   2HB   LYS  25          2HB       LYS  25  -3.945  13.190  11.860
  174   1HG   LYS  25          1HG       LYS  25  -2.820  11.411  14.070
  175   2HG   LYS  25          2HG       LYS  25  -1.898  12.629  13.222
  176   1HD   LYS  25          1HD       LYS  25  -4.268  13.152  15.083
  177   2HD   LYS  25          2HD       LYS  25  -2.576  13.444  15.404
  178   1HE   LYS  25          1HE       LYS  25  -4.262  14.922  13.336
  179   2HE   LYS  25          2HE       LYS  25  -3.638  15.538  14.870
  180   1HZ   LYS  25          1HZ       LYS  25  -1.409  15.126  14.015
  181   2HZ   LYS  25          2HZ       LYS  25  -2.047  14.718  12.554
  182   3HZ   LYS  25          3HZ       LYS  25  -2.245  16.248  13.131
  183    H    TYR  26           H        TYR  26  -6.358  11.924  14.991
  184    HA   TYR  26           HA       TYR  26  -7.746  14.444  14.284
  185   1HB   TYR  26          1HB       TYR  26  -9.940  13.536  14.749
  186   2HB   TYR  26          2HB       TYR  26  -9.226  12.945  13.271
  187    HD1  TYR  26           HD1      TYR  26  -7.907  10.542  13.586
  188    HD2  TYR  26           HD2      TYR  26 -11.173  11.972  16.008
  189    HE1  TYR  26           HE1      TYR  26  -8.127   8.311  14.590
  190    HE2  TYR  26           HE2      TYR  26 -11.413   9.711  16.978
  191    HH   TYR  26           HH       TYR  26 -10.545   7.585  17.120
  192    H    ASP  27           H        ASP  27  -8.241  11.883  16.720
  193    HA   ASP  27           HA       ASP  27  -8.699  14.039  18.680
  194   1HB   ASP  27          1HB       ASP  27 -10.438  12.370  18.327
  195   2HB   ASP  27          2HB       ASP  27  -9.314  11.066  18.714
  196    H    GLY  28           H        GLY  28  -6.976  14.739  19.768
  197   1HA   GLY  28          1HA       GLY  28  -4.605  13.276  20.295
  198   2HA   GLY  28          2HA       GLY  28  -5.201  14.632  21.262
  199    H    VAL  29           H        VAL  29  -7.459  13.782  22.429
  200    HA   VAL  29           HA       VAL  29  -6.435  11.916  24.435
  201    HB   VAL  29           HB       VAL  29  -9.154  13.269  24.453
  202   1HG1  VAL  29          1HG1      VAL  29  -8.697  11.518  26.209
  203   2HG1  VAL  29          2HG1      VAL  29  -7.240  12.411  26.680
  204   3HG1  VAL  29          3HG1      VAL  29  -8.845  13.137  26.896
  205   1HG2  VAL  29          1HG2      VAL  29  -6.472  14.425  25.283
  206   2HG2  VAL  29          2HG2      VAL  29  -7.609  15.085  24.075
  207   3HG2  VAL  29          3HG2      VAL  29  -8.046  15.083  25.785
  208    H    GLU  30           H        GLU  30  -6.564  10.458  22.305
  209    HA   GLU  30           HA       GLU  30  -8.241   8.283  23.026
  210   1HB   GLU  30          1HB       GLU  30  -9.962   9.649  21.807
  211   2HB   GLU  30          2HB       GLU  30  -8.950   9.567  20.350
  212   1HG   GLU  30          1HG       GLU  30  -9.246   7.102  20.334
  213   2HG   GLU  30          2HG       GLU  30 -10.212   7.213  21.816
  214    H    GLU  31           H        GLU  31  -6.564   9.899  20.297
  215    HA   GLU  31           HA       GLU  31  -5.272   7.583  19.259
  216   1HB   GLU  31          1HB       GLU  31  -5.678   9.780  18.130
  217   2HB   GLU  31          2HB       GLU  31  -4.420  10.514  19.142
  218   1HG   GLU  31          1HG       GLU  31  -2.763   8.931  18.160
  219   2HG   GLU  31          2HG       GLU  31  -4.047   8.227  17.154
  220    H    GLU  32           H        GLU  32  -4.164  10.183  21.486
  221    HA   GLU  32           HA       GLU  32  -2.268  10.382  22.758
  222   1HB   GLU  32          1HB       GLU  32  -3.437   7.756  23.766
  223   2HB   GLU  32          2HB       GLU  32  -2.412   8.873  24.683
  224   1HG   GLU  32          1HG       GLU  32  -4.152  10.658  24.413
  225   2HG   GLU  32          2HG       GLU  32  -5.174   9.478  23.566
  226    H    ASP  33           H        ASP  33  -1.141   9.580  20.446
  227    HA   ASP  33           HA       ASP  33   1.107   7.907  21.291
  228   1HB   ASP  33          1HB       ASP  33  -0.455   6.120  20.875
  229   2HB   ASP  33          2HB       ASP  33  -0.982   6.826  19.351
  230    H    ASP  34           H        ASP  34  -0.274   8.263  18.034
  231    HA   ASP  34           HA       ASP  34   2.278   8.869  16.963
  232   1HB   ASP  34          1HB       ASP  34   0.647   7.695  15.670
  233   2HB   ASP  34          2HB       ASP  34  -0.528   9.008  15.795
  234    H    GLU  35           H        GLU  35  -0.621  10.967  16.891
  235    HA   GLU  35           HA       GLU  35  -0.969  13.139  17.008
  236   1HB   GLU  35          1HB       GLU  35   1.736  13.570  18.301
  237   2HB   GLU  35          2HB       GLU  35   0.268  14.543  18.429
  238   1HG   GLU  35          1HG       GLU  35   0.824  11.799  19.617
  239   2HG   GLU  35          2HG       GLU  35   0.456  13.296  20.463
  240    H    GLU  36           H        GLU  36   2.515  12.949  16.185
  241    HA   GLU  36           HA       GLU  36   2.074  14.745  13.833
  242   1HB   GLU  36          1HB       GLU  36   4.628  13.846  15.222
  243   2HB   GLU  36          2HB       GLU  36   4.531  14.868  13.777
  244   1HG   GLU  36          1HG       GLU  36   3.224  16.559  15.078
  245   2HG   GLU  36          2HG       GLU  36   3.392  15.557  16.529
  246    HA   PRO  37           HA       PRO  37   2.170  10.559  12.108
  247   1HB   PRO  37          1HB       PRO  37   1.045  10.939   9.704
  248   2HB   PRO  37          2HB       PRO  37   0.142  11.165  11.221
  249   1HG   PRO  37          1HG       PRO  37   1.493  13.332   9.576
  250   2HG   PRO  37          2HG       PRO  37  -0.201  13.300  10.150
  251   1HD   PRO  37          1HD       PRO  37   1.782  14.589  11.522
  252   2HD   PRO  37          2HD       PRO  37   0.450  13.743  12.372
  253    H    ASN  38           H        ASN  38   2.893   9.453  10.081
  254    HA   ASN  38           HA       ASN  38   4.484   8.719   8.767
  255   1HB   ASN  38          1HB       ASN  38   4.172  11.310   7.833
  256   2HB   ASN  38          2HB       ASN  38   5.905  11.215   8.081
  257   1HD2  ASN  38          2HD2      ASN  38   6.848  10.730   6.064
  258   2HD2  ASN  38          1HD2      ASN  38   6.177   9.564   4.929
  259    H    VAL  39           H        VAL  39   6.054  11.349  10.640
  260    HA   VAL  39           HA       VAL  39   8.591  10.088  10.552
  261    HB   VAL  39           HB       VAL  39   7.571  12.295  12.367
  262   1HG1  VAL  39          1HG1      VAL  39  10.415  11.280  11.908
  263   2HG1  VAL  39          2HG1      VAL  39   9.979  12.781  12.751
  264   3HG1  VAL  39          3HG1      VAL  39   9.528  11.221  13.446
  265   1HG2  VAL  39          1HG2      VAL  39   9.256  12.300   9.839
  266   2HG2  VAL  39          2HG2      VAL  39   7.570  12.842   9.974
  267   3HG2  VAL  39          3HG2      VAL  39   8.846  13.715  10.828
  268    HA   PRO  40           HA       PRO  40   8.149   8.196  14.902
  269   1HB   PRO  40          1HB       PRO  40   5.800   8.308  16.298
  270   2HB   PRO  40          2HB       PRO  40   7.038   9.594  16.390
  271   1HG   PRO  40          1HG       PRO  40   4.578   9.539  14.607
  272   2HG   PRO  40          2HG       PRO  40   5.098  10.843  15.710
  273   1HD   PRO  40          1HD       PRO  40   5.711  10.936  13.074
  274   2HD   PRO  40          2HD       PRO  40   6.920  11.418  14.307
  275    H    CYS  41           H        CYS  41   5.382   8.283  12.718
  276    HA   CYS  41           HA       CYS  41   4.454   5.610  13.083
  277   1HB   CYS  41          1HB       CYS  41   3.271   7.540  11.976
  278   2HB   CYS  41          2HB       CYS  41   4.329   7.306  10.578
  279    H    LEU  42           H        LEU  42   7.336   6.855  11.583
  280    HA   LEU  42           HA       LEU  42   9.146   5.870  10.807
  281   1HB   LEU  42          1HB       LEU  42   7.863   3.127  11.070
  282   2HB   LEU  42          2HB       LEU  42   9.568   3.523  10.900
  283    HG   LEU  42           HG       LEU  42   7.801   4.128  13.305
  284   1HD1  LEU  42          1HD1      LEU  42   8.438   1.767  13.038
  285   2HD1  LEU  42          2HD1      LEU  42  10.152   2.231  12.940
  286   3HD1  LEU  42          3HD1      LEU  42   9.237   2.501  14.440
  287   1HD2  LEU  42          1HD2      LEU  42  10.757   4.748  12.842
  288   2HD2  LEU  42          2HD2      LEU  42   9.456   5.934  13.100
  289   3HD2  LEU  42          3HD2      LEU  42   9.925   4.849  14.409
  290    H    VAL  43           H        VAL  43   6.342   4.126   9.469
  291    HA   VAL  43           HA       VAL  43   5.701   3.589   7.389
  292    HB   VAL  43           HB       VAL  43   7.808   5.405   6.158
  293   1HG1  VAL  43          1HG1      VAL  43   5.161   4.350   5.127
  294   2HG1  VAL  43          2HG1      VAL  43   6.237   5.497   4.300
  295   3HG1  VAL  43          3HG1      VAL  43   6.791   3.854   4.617
  296   1HG2  VAL  43          1HG2      VAL  43   4.962   6.093   7.033
  297   2HG2  VAL  43          2HG2      VAL  43   6.449   6.797   7.709
  298   3HG2  VAL  43          3HG2      VAL  43   6.016   7.110   6.027
  299    H    ARG  44           H        ARG  44   9.264   3.928   7.432
  300    HA   ARG  44           HA       ARG  44  10.941   2.491   7.090
  301   1HB   ARG  44          1HB       ARG  44   9.254   0.755   8.176
  302   2HB   ARG  44          2HB       ARG  44   9.199   0.082   6.545
  303   1HG   ARG  44          1HG       ARG  44  11.661   0.524   8.298
  304   2HG   ARG  44          2HG       ARG  44  10.872  -1.020   7.973
  305   1HD   ARG  44          1HD       ARG  44  12.362   0.706   5.949
  306   2HD   ARG  44          2HD       ARG  44  12.906  -0.796   6.661
  307    HE   ARG  44           HE       ARG  44  10.886  -1.900   5.646
  308   1HH1  ARG  44          1HH1      ARG  44  12.091   0.995   3.971
  309   2HH1  ARG  44          2HH1      ARG  44  12.227   0.189   2.434
  310   1HH2  ARG  44          1HH2      ARG  44  10.819  -2.841   3.602
  311   2HH2  ARG  44          2HH2      ARG  44  11.309  -1.949   2.189
  312    H    VAL  45           H        VAL  45   8.200   1.607   4.955
  313    HA   VAL  45           HA       VAL  45   9.841   1.584   2.534
  314    HB   VAL  45           HB       VAL  45   7.691   1.276   1.378
  315   1HG1  VAL  45          1HG1      VAL  45   8.932  -0.644   2.260
  316   2HG1  VAL  45          2HG1      VAL  45   8.054  -0.533   3.801
  317   3HG1  VAL  45          3HG1      VAL  45   7.186  -0.930   2.306
  318   1HG2  VAL  45          1HG2      VAL  45   6.147   2.583   2.830
  319   2HG2  VAL  45          2HG2      VAL  45   5.609   0.918   2.615
  320   3HG2  VAL  45          3HG2      VAL  45   6.372   1.405   4.133
  321    H    CYS  46           H        CYS  46  10.524   3.901   3.610
  322    HA   CYS  46           HA       CYS  46   8.822   6.157   2.888
  323   1HB   CYS  46          1HB       CYS  46  10.362   6.134   4.842
  324   2HB   CYS  46          2HB       CYS  46  11.721   6.003   3.716
  325    H    HIS  47           H        HIS  47   8.800   4.991   0.586
  326    HA   HIS  47           HA       HIS  47  10.890   6.247  -1.152
  327   1HB   HIS  47          1HB       HIS  47  10.149   4.872  -2.909
  328   2HB   HIS  47          2HB       HIS  47  10.380   3.809  -1.520
  329    HD1  HIS  47           HD1      HIS  47   7.529   5.460  -3.567
  330    HD2  HIS  47           HD2      HIS  47   8.206   2.461  -0.685
  331    HE1  HIS  47           HE1      HIS  47   5.375   4.128  -3.378
  332    H    GLN  48           H        GLN  48  10.269   8.060  -2.230
  333    HA   GLN  48           HA       GLN  48   7.938   9.507  -1.816
  334   1HB   GLN  48          1HB       GLN  48   8.482  10.707  -3.814
  335   2HB   GLN  48          2HB       GLN  48   9.985  10.361  -2.956
  336   1HG   GLN  48          1HG       GLN  48   8.929   8.856  -5.397
  337   2HG   GLN  48          2HG       GLN  48  10.165  10.114  -5.422
  338   1HE2  GLN  48          2HE2      GLN  48  10.411   7.317  -6.354
  339   2HE2  GLN  48          1HE2      GLN  48  11.722   6.645  -5.402
  340    H    ASP  49           H        ASP  49   5.939   9.790  -2.922
  341    HA   ASP  49           HA       ASP  49   5.190   8.228  -5.190
  342   1HB   ASP  49          1HB       ASP  49   5.166   6.528  -3.185
  343   2HB   ASP  49          2HB       ASP  49   3.726   7.403  -2.685
  344    H    CYS  50           H        CYS  50   2.267   8.208  -4.051
  345    HA   CYS  50           HA       CYS  50   1.729  11.110  -4.012
  346   1HB   CYS  50          1HB       CYS  50   1.479  10.040  -6.306
  347   2HB   CYS  50          2HB       CYS  50   0.147   9.085  -5.648
  348    H    VAL  51           H        VAL  51   0.024  11.641  -2.623
  349    HA   VAL  51           HA       VAL  51  -1.571   9.503  -1.372
  350    HB   VAL  51           HB       VAL  51   0.553   9.595  -0.090
  351   1HG1  VAL  51          1HG1      VAL  51   1.144  11.970  -0.463
  352   2HG1  VAL  51          2HG1      VAL  51  -0.217  12.479   0.550
  353   3HG1  VAL  51          3HG1      VAL  51   1.125  11.567   1.260
  354   1HG2  VAL  51          1HG2      VAL  51  -1.582   8.989   1.027
  355   2HG2  VAL  51          2HG2      VAL  51  -0.434   9.779   2.125
  356   3HG2  VAL  51          3HG2      VAL  51  -1.808  10.681   1.481
  357    H    CYS  52           H        CYS  52  -3.354  10.522  -0.079
  358    HA   CYS  52           HA       CYS  52  -4.911  12.304  -1.322
  359   1HB   CYS  52          1HB       CYS  52  -4.573  12.186   1.678
  360   2HB   CYS  52          2HB       CYS  52  -5.931  12.908   0.815
  361    H    GLU  53           H        GLU  53  -5.102  14.445  -1.754
  362    HA   GLU  53           HA       GLU  53  -2.904  16.147  -1.681
  363   1HB   GLU  53          1HB       GLU  53  -5.870  16.789  -1.697
  364   2HB   GLU  53          2HB       GLU  53  -4.632  18.035  -1.880
  365   1HG   GLU  53          1HG       GLU  53  -3.742  16.881  -3.878
  366   2HG   GLU  53          2HG       GLU  53  -5.019  15.669  -3.763
  367    H    GLU  54           H        GLU  54  -2.276  17.956  -0.428
  368    HA   GLU  54           HA       GLU  54  -2.314  17.672   2.372
  369   1HB   GLU  54          1HB       GLU  54  -1.848  20.129   0.636
  370   2HB   GLU  54          2HB       GLU  54  -1.480  20.038   2.364
  371   1HG   GLU  54          1HG       GLU  54   0.138  18.248   2.009
  372   2HG   GLU  54          2HG       GLU  54  -0.278  18.126   0.295
  373    H    GLY  55           H        GLY  55  -3.870  18.019   3.847
  374   1HA   GLY  55          1HA       GLY  55  -5.577  19.363   4.875
  375   2HA   GLY  55          2HA       GLY  55  -6.134  19.904   3.289
  376    H    PHE  56           H        PHE  56  -5.652  16.931   2.398
  377    HA   PHE  56           HA       PHE  56  -8.257  15.828   3.304
  378   1HB   PHE  56          1HB       PHE  56  -6.626  15.192   0.823
  379   2HB   PHE  56          2HB       PHE  56  -8.183  14.522   1.263
  380    HD1  PHE  56           HD1      PHE  56  -6.530  17.865   0.524
  381    HD2  PHE  56           HD2      PHE  56 -10.107  15.462   0.266
  382    HE1  PHE  56           HE1      PHE  56  -7.514  19.490  -1.035
  383    HE2  PHE  56           HE2      PHE  56 -11.076  17.089  -1.311
  384    HZ   PHE  56           HZ       PHE  56  -9.780  19.102  -1.986
  385    H    TYR  57           H        TYR  57  -8.219  13.548   3.886
  386    HA   TYR  57           HA       TYR  57  -5.529  12.514   4.682
  387   1HB   TYR  57          1HB       TYR  57  -8.100  12.700   6.290
  388   2HB   TYR  57          2HB       TYR  57  -6.676  11.786   6.781
  389    HD1  TYR  57           HD1      TYR  57  -8.009  15.217   6.196
  390    HD2  TYR  57           HD2      TYR  57  -4.645  12.891   7.569
  391    HE1  TYR  57           HE1      TYR  57  -6.880  17.282   6.950
  392    HE2  TYR  57           HE2      TYR  57  -3.535  14.959   8.347
  393    HH   TYR  57           HH       TYR  57  -5.034  18.185   7.980
  394    H    ARG  58           H        ARG  58  -5.272  10.299   4.517
  395    HA   ARG  58           HA       ARG  58  -7.263   8.851   2.894
  396   1HB   ARG  58          1HB       ARG  58  -5.706   6.971   2.922
  397   2HB   ARG  58          2HB       ARG  58  -5.079   8.428   2.202
  398   1HG   ARG  58          1HG       ARG  58  -3.221   7.949   3.249
  399   2HG   ARG  58          2HG       ARG  58  -3.958   8.712   4.643
  400   1HD   ARG  58          1HD       ARG  58  -2.810   6.570   5.102
  401   2HD   ARG  58          2HD       ARG  58  -4.479   6.519   5.606
  402    HE   ARG  58           HE       ARG  58  -3.217   5.208   3.232
  403   1HH1  ARG  58          1HH1      ARG  58  -6.173   5.553   5.173
  404   2HH1  ARG  58          2HH1      ARG  58  -6.710   3.913   4.905
  405   1HH2  ARG  58          1HH2      ARG  58  -4.100   3.253   2.550
  406   2HH2  ARG  58          2HH2      ARG  58  -5.597   2.655   3.201
  407    H    ASN  59           H        ASN  59  -8.881   9.333   4.589
  408    HA   ASN  59           HA       ASN  59  -8.783   7.697   6.978
  409   1HB   ASN  59          1HB       ASN  59 -10.260   9.692   6.778
  410   2HB   ASN  59          2HB       ASN  59 -11.227   8.842   5.565
  411   1HD2  ASN  59          2HD2      ASN  59 -13.078   9.159   7.108
  412   2HD2  ASN  59          1HD2      ASN  59 -13.217   8.043   8.456
  413    H    LYS  60           H        LYS  60 -10.005   5.807   7.367
  414    HA   LYS  60           HA       LYS  60 -10.058   3.573   7.041
  415   1HB   LYS  60          1HB       LYS  60 -11.911   4.328   4.744
  416   2HB   LYS  60          2HB       LYS  60 -11.900   2.820   5.654
  417   1HG   LYS  60          1HG       LYS  60 -12.649   5.619   6.601
  418   2HG   LYS  60          2HG       LYS  60 -13.727   4.254   6.359
  419   1HD   LYS  60          1HD       LYS  60 -11.592   4.492   8.538
  420   2HD   LYS  60          2HD       LYS  60 -13.333   4.661   8.733
  421   1HE   LYS  60          1HE       LYS  60 -13.653   2.293   7.991
  422   2HE   LYS  60          2HE       LYS  60 -11.892   2.103   7.886
  423   1HZ   LYS  60          1HZ       LYS  60 -13.392   2.775  10.313
  424   2HZ   LYS  60          2HZ       LYS  60 -12.736   1.309   9.948
  425   3HZ   LYS  60          3HZ       LYS  60 -11.756   2.606  10.210
  426    H    ASP  61           H        ASP  61 -10.349   4.223   3.578
  427    HA   ASP  61           HA       ASP  61  -7.654   3.205   3.050
  428   1HB   ASP  61          1HB       ASP  61  -9.010   1.149   2.927
  429   2HB   ASP  61          2HB       ASP  61 -10.121   1.949   1.797
  430    H    ASP  62           H        ASP  62  -7.045   5.154   2.269
  431    HA   ASP  62           HA       ASP  62  -7.073   7.151   1.139
  432   1HB   ASP  62          1HB       ASP  62  -7.726   5.170  -1.065
  433   2HB   ASP  62          2HB       ASP  62  -7.143   6.820  -1.332
  434    H    LYS  63           H        LYS  63  -9.659   6.798   2.452
  435    HA   LYS  63           HA       LYS  63 -11.545   7.975   0.513
  436   1HB   LYS  63          1HB       LYS  63 -11.744   7.828   3.537
  437   2HB   LYS  63          2HB       LYS  63 -13.020   8.258   2.399
  438   1HG   LYS  63          1HG       LYS  63 -11.639   5.560   2.651
  439   2HG   LYS  63          2HG       LYS  63 -13.276   5.955   3.194
  440   1HD   LYS  63          1HD       LYS  63 -13.887   6.444   0.790
  441   2HD   LYS  63          2HD       LYS  63 -12.269   5.895   0.303
  442   1HE   LYS  63          1HE       LYS  63 -14.370   4.184   1.691
  443   2HE   LYS  63          2HE       LYS  63 -13.884   4.115  -0.012
  444   1HZ   LYS  63          1HZ       LYS  63 -11.628   3.609   0.786
  445   2HZ   LYS  63          2HZ       LYS  63 -12.226   3.466   2.311
  446   3HZ   LYS  63          3HZ       LYS  63 -12.748   2.441   1.132
  447    H    CYS  64           H        CYS  64  -9.893   9.465  -0.213
  448    HA   CYS  64           HA       CYS  64  -8.698  11.429   1.442
  449   1HB   CYS  64          1HB       CYS  64  -9.213  11.553  -1.548
  450   2HB   CYS  64          2HB       CYS  64  -8.146  12.610  -0.627
  451    H    VAL  65           H        VAL  65 -10.577  12.001   2.726
  452    HA   VAL  65           HA       VAL  65 -11.767  14.536   1.675
  453    HB   VAL  65           HB       VAL  65 -13.659  14.122   3.305
  454   1HG1  VAL  65          1HG1      VAL  65 -13.934  13.940   0.864
  455   2HG1  VAL  65          2HG1      VAL  65 -13.433  12.238   0.921
  456   3HG1  VAL  65          3HG1      VAL  65 -14.933  12.752   1.717
  457   1HG2  VAL  65          1HG2      VAL  65 -12.514  12.172   4.511
  458   2HG2  VAL  65          2HG2      VAL  65 -14.202  11.911   4.002
  459   3HG2  VAL  65          3HG2      VAL  65 -12.889  11.188   3.081
  460    H    SER  66           H        SER  66 -12.399  15.962   3.741
  461    HA   SER  66           HA       SER  66  -9.802  16.540   4.794
  462   1HB   SER  66          1HB       SER  66 -11.210  18.431   5.863
  463   2HB   SER  66          2HB       SER  66 -11.091  18.350   4.096
  464    HG   SER  66           HG       SER  66 -13.273  18.597   4.767
  465    H    ALA  67           H        ALA  67  -9.426  17.107   7.040
  466    HA   ALA  67           HA       ALA  67  -9.487  15.023   8.803
  467   1HB   ALA  67          1HB       ALA  67  -8.125  17.078   9.089
  468   2HB   ALA  67          2HB       ALA  67  -9.584  17.980   9.551
  469   3HB   ALA  67          3HB       ALA  67  -8.994  16.647  10.566
  470    H    GLU  68           H        GLU  68 -11.899  17.581   8.511
  471    HA   GLU  68           HA       GLU  68 -13.678  17.200  10.516
  472   1HB   GLU  68          1HB       GLU  68 -14.621  17.422   7.634
  473   2HB   GLU  68          2HB       GLU  68 -15.357  18.082   9.101
  474   1HG   GLU  68          1HG       GLU  68 -12.843  19.032   7.659
  475   2HG   GLU  68          2HG       GLU  68 -14.340  19.911   7.941
  476    H    ASP  69           H        ASP  69 -13.420  15.053   7.642
  477    HA   ASP  69           HA       ASP  69 -15.728  13.430   8.382
  478   1HB   ASP  69          1HB       ASP  69 -15.013  13.506   6.064
  479   2HB   ASP  69          2HB       ASP  69 -13.385  12.961   6.505
  480    H    CYS  70           H        CYS  70 -12.185  12.980   8.541
  481    HA   CYS  70           HA       CYS  70 -12.092  10.465   9.807
  482   1HB   CYS  70          1HB       CYS  70 -10.101  11.356   8.895
  483   2HB   CYS  70          2HB       CYS  70 -10.281  12.884   9.757
  484    H    GLU  71           H        GLU  71 -12.154  13.695  11.284
  485    HA   GLU  71           HA       GLU  71 -12.094  13.144  14.007
  486   1HB   GLU  71          1HB       GLU  71 -13.539  15.256  12.381
  487   2HB   GLU  71          2HB       GLU  71 -13.501  15.299  14.141
  488   1HG   GLU  71          1HG       GLU  71 -11.140  15.587  14.223
  489   2HG   GLU  71          2HG       GLU  71 -10.928  15.130  12.533
  490    H    LEU  72           H        LEU  72 -14.876  12.695  11.771
  491    HA   LEU  72           HA       LEU  72 -16.950  12.662  13.570
  492   1HB   LEU  72          1HB       LEU  72 -16.787  12.558  11.013
  493   2HB   LEU  72          2HB       LEU  72 -16.649  10.802  11.197
  494    HG   LEU  72           HG       LEU  72 -18.759  11.679  10.532
  495   1HD1  LEU  72          1HD1      LEU  72 -18.626   9.515  11.834
  496   2HD1  LEU  72          2HD1      LEU  72 -19.166  10.416  13.270
  497   3HD1  LEU  72          3HD1      LEU  72 -20.216  10.300  11.854
  498   1HD2  LEU  72          1HD2      LEU  72 -18.762  13.809  11.801
  499   2HD2  LEU  72          2HD2      LEU  72 -20.291  12.921  11.939
  500   3HD2  LEU  72          3HD2      LEU  72 -19.145  12.909  13.288
  501    H    ASP  73           H        ASP  73 -14.404  10.265  13.028
  502    HA   ASP  73           HA       ASP  73 -15.434   7.960  14.195
  503   1HB   ASP  73          1HB       ASP  73 -13.196   8.146  13.198
  504   2HB   ASP  73          2HB       ASP  73 -12.668   9.181  14.531
  505    H    ASN  74           H        ASN  74 -14.365  10.935  15.864
  506    HA   ASN  74           HA       ASN  74 -15.250   9.735  18.483
  507   1HB   ASN  74          1HB       ASN  74 -12.894  10.278  18.565
  508   2HB   ASN  74          2HB       ASN  74 -13.207  11.917  17.973
  509   1HD2  ASN  74          2HD2      ASN  74 -13.563   9.677  20.738
  510   2HD2  ASN  74          1HD2      ASN  74 -13.970  10.927  21.901
  511    H    MET  75           H        MET  75 -15.039  12.834  16.701
  512    HA   MET  75           HA       MET  75 -16.100  14.794  16.952
  513   1HB   MET  75          1HB       MET  75 -17.519  13.231  15.563
  514   2HB   MET  75          2HB       MET  75 -18.582  13.051  16.946
  515   1HG   MET  75          1HG       MET  75 -19.343  14.663  15.202
  516   2HG   MET  75          2HG       MET  75 -19.276  15.348  16.812
  517   1HE   MET  75          1HE       MET  75 -17.377  15.149  13.328
  518   2HE   MET  75          2HE       MET  75 -16.121  16.380  13.571
  519   3HE   MET  75          3HE       MET  75 -16.073  14.874  14.510
  520    H    ASP  76           H        ASP  76 -15.680  13.369  19.713
  521    HA   ASP  76           HA       ASP  76 -17.835  14.714  21.260
  522   1HB   ASP  76          1HB       ASP  76 -17.478  12.284  21.537
  523   2HB   ASP  76          2HB       ASP  76 -15.843  12.576  22.124
  524    H    PHE  77           H        PHE  77 -14.341  14.026  21.783
  525    HA   PHE  77           HA       PHE  77 -14.099  16.737  23.049
  526   1HB   PHE  77          1HB       PHE  77 -11.835  15.373  23.803
  527   2HB   PHE  77          2HB       PHE  77 -13.279  15.629  24.746
  528    HD1  PHE  77           HD1      PHE  77 -15.002  13.896  25.031
  529    HD2  PHE  77           HD2      PHE  77 -11.250  13.080  23.054
  530    HE1  PHE  77           HE1      PHE  77 -15.385  11.461  25.290
  531    HE2  PHE  77           HE2      PHE  77 -11.650  10.660  23.310
  532    HZ   PHE  77           HZ       PHE  77 -13.703   9.838  24.437
  533    H    ILE  78           H        ILE  78 -11.903  14.473  21.400
  534    HA   ILE  78           HA       ILE  78 -10.402  14.687  19.802
  535    HB   ILE  78           HB       ILE  78 -11.915  17.113  18.823
  536   1HG1  ILE  78          1HG1      ILE  78 -12.243  14.103  18.517
  537   2HG1  ILE  78          2HG1      ILE  78 -13.465  15.311  18.941
  538   1HG2  ILE  78          1HG2      ILE  78  -9.573  16.818  17.902
  539   2HG2  ILE  78          2HG2      ILE  78 -10.085  15.224  17.311
  540   3HG2  ILE  78          3HG2      ILE  78 -10.852  16.701  16.709
  541   1HD1  ILE  78          1HD1      ILE  78 -13.232  16.223  16.591
  542   2HD1  ILE  78          2HD1      ILE  78 -12.193  14.822  16.222
  543   3HD1  ILE  78          3HD1      ILE  78 -13.867  14.574  16.693
  544    H    TYR  79           H        TYR  79 -10.941  17.986  20.783
  545    HA   TYR  79           HA       TYR  79  -9.518  19.412  21.997
  546   1HB   TYR  79          1HB       TYR  79  -7.237  18.176  20.374
  547   2HB   TYR  79          2HB       TYR  79  -7.108  19.654  21.285
  548    HD1  TYR  79           HD1      TYR  79  -8.443  19.034  23.888
  549    HD2  TYR  79           HD2      TYR  79  -5.575  16.917  21.460
  550    HE1  TYR  79           HE1      TYR  79  -7.289  18.275  25.917
  551    HE2  TYR  79           HE2      TYR  79  -4.412  16.156  23.515
  552    HH   TYR  79           HH       TYR  79  -5.493  17.110  26.782
  553    HA   PRO  80           HA       PRO  80 -10.121  21.948  18.360
  554   1HB   PRO  80          1HB       PRO  80  -9.567  24.436  19.283
  555   2HB   PRO  80          2HB       PRO  80 -10.929  23.484  19.924
  556   1HG   PRO  80          1HG       PRO  80  -8.140  23.695  21.107
  557   2HG   PRO  80          2HG       PRO  80  -9.695  23.996  21.938
  558   1HD   PRO  80          1HD       PRO  80  -8.428  21.578  22.072
  559   2HD   PRO  80          2HD       PRO  80 -10.212  21.687  21.988
  560    H    GLY  81           H        GLY  81  -7.933  20.413  18.058
  561   1HA   GLY  81          1HA       GLY  81  -5.680  22.223  17.210
  562   2HA   GLY  81          2HA       GLY  81  -5.532  20.504  17.609
  563    H    THR  82           H        THR  82  -7.292  19.085  16.363
  564    HA   THR  82           HA       THR  82  -6.959  19.502  13.493
  565    HB   THR  82           HB       THR  82  -8.257  17.251  13.632
  566    HG1  THR  82           HG1      THR  82  -7.973  16.497  15.967
  567   1HG2  THR  82          1HG2      THR  82  -5.620  17.567  15.168
  568   2HG2  THR  82          2HG2      THR  82  -6.235  16.059  14.484
  569   3HG2  THR  82          3HG2      THR  82  -5.785  17.387  13.409
  570    H    ARG  83           H        ARG  83  -9.700  18.899  15.704
  571    HA   ARG  83           HA       ARG  83 -11.658  20.055  13.882
  572   1HB   ARG  83          1HB       ARG  83 -12.175  18.231  15.478
  573   2HB   ARG  83          2HB       ARG  83 -11.940  19.348  16.831
  574   1HG   ARG  83          1HG       ARG  83 -13.851  20.702  16.083
  575   2HG   ARG  83          2HG       ARG  83 -13.941  19.801  14.562
  576   1HD   ARG  83          1HD       ARG  83 -15.700  19.162  16.134
  577   2HD   ARG  83          2HD       ARG  83 -14.657  17.791  15.721
  578    HE   ARG  83           HE       ARG  83 -13.572  18.907  18.054
  579   1HH1  ARG  83          1HH1      ARG  83 -16.627  17.408  17.091
  580   2HH1  ARG  83          2HH1      ARG  83 -17.082  16.930  18.697
  581   1HH2  ARG  83          1HH2      ARG  83 -14.055  18.092  20.176
  582   2HH2  ARG  83          2HH2      ARG  83 -15.642  17.460  20.504
  583    H    ASN  84           H        ASN  84 -10.271  22.035  13.621
  584    HA   ASN  84           HA       ASN  84 -11.500  24.229  15.072
  585   1HB   ASN  84          1HB       ASN  84  -9.963  23.829  16.764
  586   2HB   ASN  84          2HB       ASN  84  -8.619  23.536  15.677
  587   1HD2  ASN  84          2HD2      ASN  84  -7.738  25.087  17.397
  588   2HD2  ASN  84          1HD2      ASN  84  -7.849  26.805  17.008
  589    HA   PRO  85           HA       PRO  85  -9.085  26.183  11.487
  590   1HB   PRO  85          1HB       PRO  85  -7.181  24.795  10.085
  591   2HB   PRO  85          2HB       PRO  85  -6.813  25.720  11.569
  592   1HG   PRO  85          1HG       PRO  85  -7.399  22.746  11.361
  593   2HG   PRO  85          2HG       PRO  85  -6.005  23.527  12.168
  594   1HD   PRO  85          1HD       PRO  85  -8.174  22.786  13.570
  595   2HD   PRO  85          2HD       PRO  85  -7.380  24.349  13.921
  Start of MODEL    6
    1   1H    LYS   1          1H        LYS   1   2.292   3.003  -5.129
    2   2H    LYS   1          2H        LYS   1   2.519   1.546  -5.871
    3   3H    LYS   1          3H        LYS   1   3.409   1.943  -4.540
    4    HA   LYS   1           HA       LYS   1   4.475   3.714  -5.708
    5   1HB   LYS   1          1HB       LYS   1   4.621   1.042  -7.147
    6   2HB   LYS   1          2HB       LYS   1   5.791   2.364  -7.308
    7   1HG   LYS   1          1HG       LYS   1   6.345   2.206  -4.907
    8   2HG   LYS   1          2HG       LYS   1   5.185   0.869  -4.721
    9   1HD   LYS   1          1HD       LYS   1   6.439  -0.477  -6.379
   10   2HD   LYS   1          2HD       LYS   1   7.575   0.858  -6.621
   11   1HE   LYS   1          1HE       LYS   1   8.543  -0.843  -5.155
   12   2HE   LYS   1          2HE       LYS   1   8.334   0.680  -4.276
   13   1HZ   LYS   1          1HZ       LYS   1   6.462  -1.589  -4.157
   14   2HZ   LYS   1          2HZ       LYS   1   7.642  -1.284  -3.047
   15   3HZ   LYS   1          3HZ       LYS   1   6.413  -0.213  -3.239
   16    H    ALA   2           H        ALA   2   2.225   4.742  -6.362
   17    HA   ALA   2           HA       ALA   2   1.380   4.334  -9.110
   18   1HB   ALA   2          1HB       ALA   2  -0.135   5.014  -7.256
   19   2HB   ALA   2          2HB       ALA   2   0.735   6.563  -7.150
   20   3HB   ALA   2          3HB       ALA   2  -0.180   6.151  -8.614
   21    H    THR   3           H        THR   3   3.859   4.670  -9.658
   22    HA   THR   3           HA       THR   3   5.203   7.099  -9.571
   23    HB   THR   3           HB       THR   3   6.495   5.858 -11.512
   24    HG1  THR   3           HG1      THR   3   4.472   4.465 -11.752
   25   1HG2  THR   3          1HG2      THR   3   6.112   4.635  -8.740
   26   2HG2  THR   3          2HG2      THR   3   7.460   4.309  -9.846
   27   3HG2  THR   3          3HG2      THR   3   7.249   5.934  -9.165
   28    H    MET   4           H        MET   4   3.359   8.477 -10.179
   29    HA   MET   4           HA       MET   4   2.599  10.168 -11.452
   30   1HB   MET   4          1HB       MET   4   4.907  10.131 -12.540
   31   2HB   MET   4          2HB       MET   4   4.167   9.233 -13.876
   32   1HG   MET   4          1HG       MET   4   2.535  11.088 -14.184
   33   2HG   MET   4          2HG       MET   4   3.297  11.974 -12.861
   34   1HE   MET   4          1HE       MET   4   5.717  13.009 -12.971
   35   2HE   MET   4          2HE       MET   4   6.474  11.479 -13.488
   36   3HE   MET   4          3HE       MET   4   6.750  12.963 -14.420
   37    H    GLN   5           H        GLN   5   1.279   7.863 -10.899
   38    HA   GLN   5           HA       GLN   5  -0.428   7.412 -13.346
   39   1HB   GLN   5          1HB       GLN   5   0.141   5.699 -10.913
   40   2HB   GLN   5          2HB       GLN   5  -1.339   5.519 -11.857
   41   1HG   GLN   5          1HG       GLN   5   0.237   3.914 -12.640
   42   2HG   GLN   5          2HG       GLN   5  -0.029   5.105 -13.913
   43   1HE2  GLN   5          2HE2      GLN   5   1.758   6.650 -14.396
   44   2HE2  GLN   5          1HE2      GLN   5   3.367   6.280 -13.811
   45    H    CYS   6           H        CYS   6  -0.628   8.019  -9.786
   46    HA   CYS   6           HA       CYS   6  -3.505   8.348 -10.026
   47   1HB   CYS   6          1HB       CYS   6  -3.577   8.479  -7.729
   48   2HB   CYS   6          2HB       CYS   6  -2.219   7.385  -7.989
   49    H    GLY   7           H        GLY   7  -4.672  10.217  -9.191
   50   1HA   GLY   7          1HA       GLY   7  -3.533  12.764  -8.672
   51   2HA   GLY   7          2HA       GLY   7  -4.039  12.696 -10.370
   52    H    GLU   8           H        GLU   8  -5.201  11.949  -7.064
   53    HA   GLU   8           HA       GLU   8  -7.913  12.995  -7.790
   54   1HB   GLU   8          1HB       GLU   8  -7.816  10.457  -7.736
   55   2HB   GLU   8          2HB       GLU   8  -7.423  10.569  -6.028
   56   1HG   GLU   8          1HG       GLU   8  -9.737  12.212  -6.347
   57   2HG   GLU   8          2HG       GLU   8  -9.999  10.884  -7.471
   58    H    ASN   9           H        ASN   9  -8.271  12.072  -4.694
   59    HA   ASN   9           HA       ASN   9  -7.704  14.596  -3.477
   60   1HB   ASN   9          1HB       ASN   9  -8.087  11.803  -2.293
   61   2HB   ASN   9          2HB       ASN   9  -7.933  13.267  -1.328
   62   1HD2  ASN   9          2HD2      ASN   9 -10.145  12.275  -0.573
   63   2HD2  ASN   9          1HD2      ASN   9 -11.530  12.889  -1.458
   64    H    GLU  10           H        GLU  10  -5.709  11.991  -4.433
   65    HA   GLU  10           HA       GLU  10  -3.386  12.938  -2.891
   66   1HB   GLU  10          1HB       GLU  10  -4.014  10.129  -3.874
   67   2HB   GLU  10          2HB       GLU  10  -2.761  10.573  -2.688
   68   1HG   GLU  10          1HG       GLU  10  -4.863  11.144  -1.188
   69   2HG   GLU  10          2HG       GLU  10  -5.799  10.333  -2.442
   70    H    LYS  11           H        LYS  11  -1.477  13.050  -4.082
   71    HA   LYS  11           HA       LYS  11  -1.767  12.784  -7.048
   72   1HB   LYS  11          1HB       LYS  11  -0.567  14.783  -7.361
   73   2HB   LYS  11          2HB       LYS  11  -1.799  15.167  -6.141
   74   1HG   LYS  11          1HG       LYS  11  -0.077  14.915  -4.353
   75   2HG   LYS  11          2HG       LYS  11   1.154  14.570  -5.583
   76   1HD   LYS  11          1HD       LYS  11   0.767  16.759  -6.650
   77   2HD   LYS  11          2HD       LYS  11  -0.431  17.153  -5.401
   78   1HE   LYS  11          1HE       LYS  11   1.376  16.819  -3.655
   79   2HE   LYS  11          2HE       LYS  11   2.542  16.570  -4.967
   80   1HZ   LYS  11          1HZ       LYS  11   2.029  18.777  -5.738
   81   2HZ   LYS  11          2HZ       LYS  11   0.948  18.993  -4.512
   82   3HZ   LYS  11          3HZ       LYS  11   2.551  18.809  -4.174
   83    H    TYR  12           H        TYR  12   0.211  12.134  -8.148
   84    HA   TYR  12           HA       TYR  12   1.872  10.305  -6.713
   85   1HB   TYR  12          1HB       TYR  12   1.713  10.065  -9.071
   86   2HB   TYR  12          2HB       TYR  12   2.177  11.747  -9.349
   87    HD1  TYR  12           HD1      TYR  12   3.623   8.832  -7.411
   88    HD2  TYR  12           HD2      TYR  12   4.336  12.042 -10.207
   89    HE1  TYR  12           HE1      TYR  12   6.038   8.413  -7.281
   90    HE2  TYR  12           HE2      TYR  12   6.762  11.555 -10.133
   91    HH   TYR  12           HH       TYR  12   8.149   9.159  -7.894
   92    H    ASP  13           H        ASP  13   3.593  10.663  -5.360
   93    HA   ASP  13           HA       ASP  13   5.385  12.869  -5.831
   94   1HB   ASP  13          1HB       ASP  13   3.402  13.769  -4.351
   95   2HB   ASP  13          2HB       ASP  13   4.147  12.805  -3.077
   96    H    SER  14           H        SER  14   6.292  12.528  -2.939
   97    HA   SER  14           HA       SER  14   8.156  10.406  -3.591
   98   1HB   SER  14          1HB       SER  14   9.429  11.447  -1.722
   99   2HB   SER  14          2HB       SER  14   9.015  12.567  -3.026
  100    HG   SER  14           HG       SER  14   7.467  13.508  -1.775
  101    H    CYS  15           H        CYS  15   7.581  11.183  -0.338
  102    HA   CYS  15           HA       CYS  15   8.075   8.666   0.584
  103   1HB   CYS  15          1HB       CYS  15   8.252  10.922   1.724
  104   2HB   CYS  15          2HB       CYS  15   6.565  10.712   2.206
  105    H    GLY  16           H        GLY  16   6.437   7.392  -0.854
  106   1HA   GLY  16          1HA       GLY  16   5.071   5.518  -0.459
  107   2HA   GLY  16          2HA       GLY  16   4.953   6.010   1.233
  108    H    SER  17           H        SER  17   2.666   5.234   0.839
  109    HA   SER  17           HA       SER  17   0.881   6.993  -0.568
  110   1HB   SER  17          1HB       SER  17   0.101   5.099   1.668
  111   2HB   SER  17          2HB       SER  17  -0.795   5.541   0.205
  112    HG   SER  17           HG       SER  17   1.074   4.455  -0.912
  113    H    LYS  18           H        LYS  18   2.395   8.746   0.834
  114    HA   LYS  18           HA       LYS  18   2.656  10.204   2.546
  115   1HB   LYS  18          1HB       LYS  18   0.488  10.942   1.556
  116   2HB   LYS  18          2HB       LYS  18  -0.390  10.043   2.796
  117   1HG   LYS  18          1HG       LYS  18   0.595  11.399   4.534
  118   2HG   LYS  18          2HG       LYS  18   1.669  12.230   3.366
  119   1HD   LYS  18          1HD       LYS  18  -0.558  12.922   2.227
  120   2HD   LYS  18          2HD       LYS  18  -1.335  12.417   3.749
  121   1HE   LYS  18          1HE       LYS  18   0.697  14.639   3.304
  122   2HE   LYS  18          2HE       LYS  18  -0.988  14.772   3.840
  123   1HZ   LYS  18          1HZ       LYS  18  -0.291  13.457   5.800
  124   2HZ   LYS  18          2HZ       LYS  18   1.273  13.653   5.332
  125   3HZ   LYS  18          3HZ       LYS  18   0.373  14.970   5.715
  126    H    GLU  19           H        GLU  19   3.510   7.966   3.299
  127    HA   GLU  19           HA       GLU  19   2.417   6.107   4.791
  128   1HB   GLU  19          1HB       GLU  19   4.596   5.829   5.973
  129   2HB   GLU  19          2HB       GLU  19   4.647   5.848   4.205
  130   1HG   GLU  19          1HG       GLU  19   5.579   8.067   4.190
  131   2HG   GLU  19          2HG       GLU  19   5.310   8.282   5.921
  132    H    CYS  20           H        CYS  20   0.690   6.765   6.071
  133    HA   CYS  20           HA       CYS  20  -0.469   7.419   7.898
  134   1HB   CYS  20          1HB       CYS  20   0.591   5.366   8.654
  135   2HB   CYS  20          2HB       CYS  20   1.955   6.274   9.313
  136    H    ASP  21           H        ASP  21   1.103   9.446   6.653
  137    HA   ASP  21           HA       ASP  21   1.901  11.231   8.876
  138   1HB   ASP  21          1HB       ASP  21   3.283  10.881   6.684
  139   2HB   ASP  21          2HB       ASP  21   2.071  11.877   5.919
  140    H    LYS  22           H        LYS  22   0.490  12.896   9.462
  141    HA   LYS  22           HA       LYS  22  -1.653  13.468   9.990
  142   1HB   LYS  22          1HB       LYS  22  -1.537  14.423   7.124
  143   2HB   LYS  22          2HB       LYS  22  -2.511  15.081   8.441
  144   1HG   LYS  22          1HG       LYS  22  -0.493  15.685   9.718
  145   2HG   LYS  22          2HG       LYS  22   0.540  15.003   8.443
  146   1HD   LYS  22          1HD       LYS  22  -0.298  16.571   6.818
  147   2HD   LYS  22          2HD       LYS  22  -1.447  17.243   7.988
  148   1HE   LYS  22          1HE       LYS  22   0.528  18.709   7.748
  149   2HE   LYS  22          2HE       LYS  22   0.410  18.062   9.395
  150   1HZ   LYS  22          1HZ       LYS  22   2.138  16.947   7.294
  151   2HZ   LYS  22          2HZ       LYS  22   2.633  17.982   8.480
  152   3HZ   LYS  22          3HZ       LYS  22   2.072  16.488   8.881
  153    H    LYS  23           H        LYS  23  -2.073  10.992   9.981
  154    HA   LYS  23           HA       LYS  23  -4.154  10.189   8.089
  155   1HB   LYS  23          1HB       LYS  23  -4.325   8.184   9.209
  156   2HB   LYS  23          2HB       LYS  23  -2.608   8.568   9.257
  157   1HG   LYS  23          1HG       LYS  23  -4.645   8.777  11.525
  158   2HG   LYS  23          2HG       LYS  23  -3.334   7.611  11.330
  159   1HD   LYS  23          1HD       LYS  23  -1.702   9.594  11.471
  160   2HD   LYS  23          2HD       LYS  23  -3.102  10.585  11.969
  161   1HE   LYS  23          1HE       LYS  23  -3.530   8.880  13.810
  162   2HE   LYS  23          2HE       LYS  23  -2.067   8.011  13.301
  163   1HZ   LYS  23          1HZ       LYS  23  -0.838  10.053  13.794
  164   2HZ   LYS  23          2HZ       LYS  23  -2.230  10.717  14.380
  165   3HZ   LYS  23          3HZ       LYS  23  -1.580   9.393  15.116
  166    H    CYS  24           H        CYS  24  -6.379   9.530   9.216
  167    HA   CYS  24           HA       CYS  24  -7.766  11.774   9.465
  168   1HB   CYS  24          1HB       CYS  24  -8.352   9.048  10.032
  169   2HB   CYS  24          2HB       CYS  24  -9.237  10.101  11.141
  170    H    LYS  25           H        LYS  25  -7.499  13.531  10.597
  171    HA   LYS  25           HA       LYS  25  -6.222  13.449  13.172
  172   1HB   LYS  25          1HB       LYS  25  -7.114  15.553  11.242
  173   2HB   LYS  25          2HB       LYS  25  -6.668  16.052  12.873
  174   1HG   LYS  25          1HG       LYS  25  -4.890  14.495  10.954
  175   2HG   LYS  25          2HG       LYS  25  -4.776  16.225  11.285
  176   1HD   LYS  25          1HD       LYS  25  -4.110  13.894  13.121
  177   2HD   LYS  25          2HD       LYS  25  -3.056  15.154  12.505
  178   1HE   LYS  25          1HE       LYS  25  -5.280  15.533  14.570
  179   2HE   LYS  25          2HE       LYS  25  -3.547  15.556  14.879
  180   1HZ   LYS  25          1HZ       LYS  25  -4.950  17.489  13.190
  181   2HZ   LYS  25          2HZ       LYS  25  -4.438  17.738  14.736
  182   3HZ   LYS  25          3HZ       LYS  25  -3.335  17.483  13.538
  183    H    TYR  26           H        TYR  26  -7.394  12.674  14.739
  184    HA   TYR  26           HA       TYR  26  -9.995  13.827  15.547
  185   1HB   TYR  26          1HB       TYR  26  -8.267  11.957  17.177
  186   2HB   TYR  26          2HB       TYR  26 -10.013  12.093  17.163
  187    HD1  TYR  26           HD1      TYR  26 -11.090  11.515  14.700
  188    HD2  TYR  26           HD2      TYR  26  -7.278  10.123  16.167
  189    HE1  TYR  26           HE1      TYR  26 -11.113   9.693  13.041
  190    HE2  TYR  26           HE2      TYR  26  -7.272   8.344  14.473
  191    HH   TYR  26           HH       TYR  26  -8.405   7.412  12.660
  192    H    ASP  27           H        ASP  27  -6.557  13.903  16.222
  193    HA   ASP  27           HA       ASP  27  -5.191  15.139  17.513
  194   1HB   ASP  27          1HB       ASP  27  -7.568  16.883  18.268
  195   2HB   ASP  27          2HB       ASP  27  -5.878  17.160  18.687
  196    H    GLY  28           H        GLY  28  -6.791  16.132  20.206
  197   1HA   GLY  28          1HA       GLY  28  -6.724  15.282  22.330
  198   2HA   GLY  28          2HA       GLY  28  -7.788  14.062  21.629
  199    H    VAL  29           H        VAL  29  -6.911  12.046  21.164
  200    HA   VAL  29           HA       VAL  29  -4.811  11.226  23.003
  201    HB   VAL  29           HB       VAL  29  -5.202   8.953  22.117
  202   1HG1  VAL  29          1HG1      VAL  29  -6.462   9.873  24.036
  203   2HG1  VAL  29          2HG1      VAL  29  -7.732  10.438  22.932
  204   3HG1  VAL  29          3HG1      VAL  29  -7.401   8.699  23.106
  205   1HG2  VAL  29          1HG2      VAL  29  -5.885   9.527  19.786
  206   2HG2  VAL  29          2HG2      VAL  29  -7.044   8.481  20.620
  207   3HG2  VAL  29          3HG2      VAL  29  -7.408  10.201  20.409
  208    H    GLU  30           H        GLU  30  -4.820  12.163  19.642
  209    HA   GLU  30           HA       GLU  30  -2.230  10.945  19.017
  210   1HB   GLU  30          1HB       GLU  30  -3.696  13.271  17.710
  211   2HB   GLU  30          2HB       GLU  30  -2.341  12.364  17.032
  212   1HG   GLU  30          1HG       GLU  30  -3.725  10.333  16.897
  213   2HG   GLU  30          2HG       GLU  30  -5.093  11.182  17.635
  214    H    GLU  31           H        GLU  31  -1.832  12.045  21.478
  215    HA   GLU  31           HA       GLU  31  -1.096  13.749  22.801
  216   1HB   GLU  31          1HB       GLU  31   0.943  14.047  20.572
  217   2HB   GLU  31          2HB       GLU  31   1.178  14.418  22.281
  218   1HG   GLU  31          1HG       GLU  31   0.765  11.639  21.072
  219   2HG   GLU  31          2HG       GLU  31   2.256  12.299  21.739
  220    H    GLU  32           H        GLU  32  -3.226  14.698  21.397
  221    HA   GLU  32           HA       GLU  32  -4.265  16.462  20.425
  222   1HB   GLU  32          1HB       GLU  32  -2.425  18.125  22.171
  223   2HB   GLU  32          2HB       GLU  32  -4.099  18.463  21.692
  224   1HG   GLU  32          1HG       GLU  32  -4.838  16.475  23.038
  225   2HG   GLU  32          2HG       GLU  32  -3.174  16.259  23.592
  226    H    ASP  33           H        ASP  33  -1.927  15.637  18.812
  227    HA   ASP  33           HA       ASP  33  -1.425  18.152  17.310
  228   1HB   ASP  33          1HB       ASP  33   0.260  18.200  19.067
  229   2HB   ASP  33          2HB       ASP  33   0.709  16.520  18.748
  230    H    ASP  34           H        ASP  34  -0.541  14.695  17.600
  231    HA   ASP  34           HA       ASP  34  -0.136  13.067  16.126
  232   1HB   ASP  34          1HB       ASP  34  -2.182  13.666  14.903
  233   2HB   ASP  34          2HB       ASP  34  -1.266  14.834  13.928
  234    H    GLU  35           H        GLU  35   2.012  13.638  16.807
  235    HA   GLU  35           HA       GLU  35   3.751  15.144  15.015
  236   1HB   GLU  35          1HB       GLU  35   5.548  14.372  16.508
  237   2HB   GLU  35          2HB       GLU  35   4.272  15.265  17.327
  238   1HG   GLU  35          1HG       GLU  35   4.234  12.217  17.320
  239   2HG   GLU  35          2HG       GLU  35   5.283  13.115  18.417
  240    H    GLU  36           H        GLU  36   2.640  13.573  13.341
  241    HA   GLU  36           HA       GLU  36   2.840  11.825  11.842
  242   1HB   GLU  36          1HB       GLU  36   5.625  13.002  11.727
  243   2HB   GLU  36          2HB       GLU  36   4.671  12.344  10.407
  244   1HG   GLU  36          1HG       GLU  36   4.213  14.942  11.955
  245   2HG   GLU  36          2HG       GLU  36   4.733  14.771  10.282
  246    HA   PRO  37           HA       PRO  37   5.270   8.752  14.310
  247   1HB   PRO  37          1HB       PRO  37   3.302   6.962  14.942
  248   2HB   PRO  37          2HB       PRO  37   3.447   8.540  15.753
  249   1HG   PRO  37          1HG       PRO  37   1.676   7.850  13.383
  250   2HG   PRO  37          2HG       PRO  37   1.172   8.569  14.944
  251   1HD   PRO  37          1HD       PRO  37   1.714  10.104  12.768
  252   2HD   PRO  37          2HD       PRO  37   2.192  10.642  14.410
  253    H    ASN  38           H        ASN  38   5.531   8.984  11.549
  254    HA   ASN  38           HA       ASN  38   4.325   7.089   9.891
  255   1HB   ASN  38          1HB       ASN  38   7.217   7.936   9.477
  256   2HB   ASN  38          2HB       ASN  38   5.991   7.554   8.273
  257   1HD2  ASN  38          2HD2      ASN  38   4.044   9.183   8.260
  258   2HD2  ASN  38          1HD2      ASN  38   4.506  10.877   8.513
  259    H    VAL  39           H        VAL  39   7.534   6.804  11.410
  260    HA   VAL  39           HA       VAL  39   8.101   4.228  10.431
  261    HB   VAL  39           HB       VAL  39   9.265   5.726  12.807
  262   1HG1  VAL  39          1HG1      VAL  39  10.319   3.247  11.379
  263   2HG1  VAL  39          2HG1      VAL  39  11.184   4.194  12.602
  264   3HG1  VAL  39          3HG1      VAL  39   9.732   3.298  13.057
  265   1HG2  VAL  39          1HG2      VAL  39  10.206   5.356   9.936
  266   2HG2  VAL  39          2HG2      VAL  39   9.572   6.858  10.639
  267   3HG2  VAL  39          3HG2      VAL  39  11.098   6.187  11.225
  268    HA   PRO  40           HA       PRO  40   6.685   2.209  14.503
  269   1HB   PRO  40          1HB       PRO  40   4.950   3.562  16.192
  270   2HB   PRO  40          2HB       PRO  40   6.723   3.471  16.387
  271   1HG   PRO  40          1HG       PRO  40   5.115   5.663  15.087
  272   2HG   PRO  40          2HG       PRO  40   6.433   5.841  16.278
  273   1HD   PRO  40          1HD       PRO  40   6.924   6.182  13.661
  274   2HD   PRO  40          2HD       PRO  40   8.073   5.251  14.663
  275    H    CYS  41           H        CYS  41   4.414   4.526  12.915
  276    HA   CYS  41           HA       CYS  41   2.145   2.753  13.086
  277   1HB   CYS  41          1HB       CYS  41   2.055   5.248  12.940
  278   2HB   CYS  41          2HB       CYS  41   2.642   5.115  11.274
  279    H    LEU  42           H        LEU  42   4.158   1.171  12.078
  280    HA   LEU  42           HA       LEU  42   4.496  -0.485  10.626
  281   1HB   LEU  42          1HB       LEU  42   1.752   0.263   9.553
  282   2HB   LEU  42          2HB       LEU  42   2.648  -1.194   9.176
  283    HG   LEU  42           HG       LEU  42   1.002  -1.750  10.738
  284   1HD1  LEU  42          1HD1      LEU  42   3.231  -2.847  11.006
  285   2HD1  LEU  42          2HD1      LEU  42   3.603  -1.702  12.317
  286   3HD1  LEU  42          3HD1      LEU  42   2.252  -2.832  12.484
  287   1HD2  LEU  42          1HD2      LEU  42   0.670   0.519  11.767
  288   2HD2  LEU  42          2HD2      LEU  42   0.638  -0.848  12.894
  289   3HD2  LEU  42          3HD2      LEU  42   2.069   0.181  12.820
  290    H    VAL  43           H        VAL  43   3.295   2.288   8.659
  291    HA   VAL  43           HA       VAL  43   4.488   1.088   6.288
  292    HB   VAL  43           HB       VAL  43   3.658   3.257   5.216
  293   1HG1  VAL  43          1HG1      VAL  43   1.719   1.303   6.516
  294   2HG1  VAL  43          2HG1      VAL  43   1.355   2.370   5.144
  295   3HG1  VAL  43          3HG1      VAL  43   2.560   1.084   4.967
  296   1HG2  VAL  43          1HG2      VAL  43   3.337   4.510   7.444
  297   2HG2  VAL  43          2HG2      VAL  43   1.945   4.486   6.333
  298   3HG2  VAL  43          3HG2      VAL  43   1.951   3.436   7.734
  299    H    ARG  44           H        ARG  44   6.663   0.982   7.241
  300    HA   ARG  44           HA       ARG  44   8.325   3.351   7.195
  301   1HB   ARG  44          1HB       ARG  44   8.845   0.370   6.953
  302   2HB   ARG  44          2HB       ARG  44  10.118   1.518   6.560
  303   1HG   ARG  44          1HG       ARG  44  10.471   0.923   8.806
  304   2HG   ARG  44          2HG       ARG  44   9.917   2.596   8.763
  305   1HD   ARG  44          1HD       ARG  44   8.899   1.466  10.608
  306   2HD   ARG  44          2HD       ARG  44   7.615   1.802   9.431
  307    HE   ARG  44           HE       ARG  44   8.537  -0.762   8.833
  308   1HH1  ARG  44          1HH1      ARG  44   7.048   0.877  11.599
  309   2HH1  ARG  44          2HH1      ARG  44   6.429  -0.588  12.313
  310   1HH2  ARG  44          1HH2      ARG  44   7.628  -2.665   9.694
  311   2HH2  ARG  44          2HH2      ARG  44   6.719  -2.632  11.181
  312    H    VAL  45           H        VAL  45   6.657   1.856   4.643
  313    HA   VAL  45           HA       VAL  45   8.603   1.973   2.573
  314    HB   VAL  45           HB       VAL  45   6.624   1.561   1.096
  315   1HG1  VAL  45          1HG1      VAL  45   7.938  -0.261   2.088
  316   2HG1  VAL  45          2HG1      VAL  45   6.897  -0.251   3.528
  317   3HG1  VAL  45          3HG1      VAL  45   6.227  -0.697   1.946
  318   1HG2  VAL  45          1HG2      VAL  45   4.863   2.725   2.520
  319   2HG2  VAL  45          2HG2      VAL  45   4.456   1.081   2.014
  320   3HG2  VAL  45          3HG2      VAL  45   4.990   1.382   3.670
  321    H    CYS  46           H        CYS  46   9.250   4.268   3.228
  322    HA   CYS  46           HA       CYS  46   7.752   6.496   2.198
  323   1HB   CYS  46          1HB       CYS  46   9.553   6.492   3.999
  324   2HB   CYS  46          2HB       CYS  46  10.730   6.277   2.700
  325    H    HIS  47           H        HIS  47   7.554   4.892   0.071
  326    HA   HIS  47           HA       HIS  47   9.778   5.550  -1.825
  327   1HB   HIS  47          1HB       HIS  47   9.118   3.579  -3.056
  328   2HB   HIS  47          2HB       HIS  47   9.607   3.219  -1.402
  329    HD1  HIS  47           HD1      HIS  47   5.984   4.270  -2.185
  330    HD2  HIS  47           HD2      HIS  47   8.332   0.861  -1.471
  331    HE1  HIS  47           HE1      HIS  47   4.374   2.313  -2.017
  332    H    GLN  48           H        GLN  48   9.397   6.612  -3.569
  333    HA   GLN  48           HA       GLN  48   7.653   8.287  -4.536
  334   1HB   GLN  48          1HB       GLN  48   8.034   7.328  -6.852
  335   2HB   GLN  48          2HB       GLN  48   9.463   7.741  -5.914
  336   1HG   GLN  48          1HG       GLN  48   8.393   4.877  -6.048
  337   2HG   GLN  48          2HG       GLN  48   9.459   5.561  -7.275
  338   1HE2  GLN  48          2HE2      GLN  48  10.523   3.420  -6.275
  339   2HE2  GLN  48          1HE2      GLN  48  11.732   3.787  -5.057
  340    H    ASP  49           H        ASP  49   5.407   8.370  -4.271
  341    HA   ASP  49           HA       ASP  49   3.702   6.455  -5.586
  342   1HB   ASP  49          1HB       ASP  49   4.551   5.063  -3.658
  343   2HB   ASP  49          2HB       ASP  49   3.942   6.295  -2.556
  344    H    CYS  50           H        CYS  50   1.348   6.722  -4.537
  345    HA   CYS  50           HA       CYS  50   0.630   9.403  -5.062
  346   1HB   CYS  50          1HB       CYS  50  -0.669   7.221  -5.541
  347   2HB   CYS  50          2HB       CYS  50  -1.192   7.304  -3.855
  348    H    VAL  51           H        VAL  51   1.125  11.006  -3.578
  349    HA   VAL  51           HA       VAL  51   0.736  10.526  -0.679
  350    HB   VAL  51           HB       VAL  51   2.097  12.693  -2.281
  351   1HG1  VAL  51          1HG1      VAL  51   1.768  12.613   0.742
  352   2HG1  VAL  51          2HG1      VAL  51   2.828  13.704  -0.162
  353   3HG1  VAL  51          3HG1      VAL  51   1.082  13.828  -0.361
  354   1HG2  VAL  51          1HG2      VAL  51   3.090  10.634  -0.240
  355   2HG2  VAL  51          2HG2      VAL  51   3.375  10.568  -1.989
  356   3HG2  VAL  51          3HG2      VAL  51   4.113  11.849  -1.010
  357    H    CYS  52           H        CYS  52  -1.041  11.215   0.314
  358    HA   CYS  52           HA       CYS  52  -3.248  12.560  -0.877
  359   1HB   CYS  52          1HB       CYS  52  -3.729  11.185   0.863
  360   2HB   CYS  52          2HB       CYS  52  -2.523  11.855   1.938
  361    H    GLU  53           H        GLU  53  -3.916  14.621  -1.074
  362    HA   GLU  53           HA       GLU  53  -2.037  16.769  -0.483
  363   1HB   GLU  53          1HB       GLU  53  -4.973  16.789  -1.310
  364   2HB   GLU  53          2HB       GLU  53  -3.928  18.214  -1.224
  365   1HG   GLU  53          1HG       GLU  53  -3.429  15.807  -3.065
  366   2HG   GLU  53          2HG       GLU  53  -4.163  17.334  -3.544
  367    H    GLU  54           H        GLU  54  -1.784  17.752   1.375
  368    HA   GLU  54           HA       GLU  54  -2.692  16.748   3.754
  369   1HB   GLU  54          1HB       GLU  54  -1.688  19.603   3.393
  370   2HB   GLU  54          2HB       GLU  54  -1.617  18.594   4.836
  371   1HG   GLU  54          1HG       GLU  54   0.514  18.249   4.137
  372   2HG   GLU  54          2HG       GLU  54  -0.232  16.959   3.191
  373    H    GLY  55           H        GLY  55  -4.620  18.792   1.825
  374   1HA   GLY  55          1HA       GLY  55  -6.223  20.113   3.815
  375   2HA   GLY  55          2HA       GLY  55  -6.713  19.656   2.171
  376    H    PHE  56           H        PHE  56  -6.127  16.793   2.427
  377    HA   PHE  56           HA       PHE  56  -8.493  15.985   4.048
  378   1HB   PHE  56          1HB       PHE  56  -6.824  14.396   2.122
  379   2HB   PHE  56          2HB       PHE  56  -8.390  13.942   2.761
  380    HD1  PHE  56           HD1      PHE  56 -10.438  15.315   1.953
  381    HD2  PHE  56           HD2      PHE  56  -6.543  15.515   0.113
  382    HE1  PHE  56           HE1      PHE  56 -11.470  16.049  -0.180
  383    HE2  PHE  56           HE2      PHE  56  -7.556  16.325  -1.966
  384    HZ   PHE  56           HZ       PHE  56 -10.038  16.579  -2.142
  385    H    TYR  57           H        TYR  57  -8.134  13.723   5.042
  386    HA   TYR  57           HA       TYR  57  -5.435  13.280   6.159
  387   1HB   TYR  57          1HB       TYR  57  -8.051  13.247   7.730
  388   2HB   TYR  57          2HB       TYR  57  -6.409  12.863   8.316
  389    HD1  TYR  57           HD1      TYR  57  -4.735  14.515   8.626
  390    HD2  TYR  57           HD2      TYR  57  -8.750  15.611   7.550
  391    HE1  TYR  57           HE1      TYR  57  -4.009  16.913   8.297
  392    HE2  TYR  57           HE2      TYR  57  -8.039  17.973   7.244
  393    HH   TYR  57           HH       TYR  57  -5.014  18.808   6.557
  394    H    ARG  58           H        ARG  58  -5.000  11.098   6.446
  395    HA   ARG  58           HA       ARG  58  -6.422   9.354   4.673
  396   1HB   ARG  58          1HB       ARG  58  -4.489   8.367   6.757
  397   2HB   ARG  58          2HB       ARG  58  -4.882   7.701   5.174
  398   1HG   ARG  58          1HG       ARG  58  -3.884   9.858   4.178
  399   2HG   ARG  58          2HG       ARG  58  -3.232  10.184   5.800
  400   1HD   ARG  58          1HD       ARG  58  -2.542   8.025   3.823
  401   2HD   ARG  58          2HD       ARG  58  -1.466   9.088   4.740
  402    HE   ARG  58           HE       ARG  58  -2.696   7.536   6.674
  403   1HH1  ARG  58          1HH1      ARG  58  -0.618   6.837   3.865
  404   2HH1  ARG  58          2HH1      ARG  58  -0.435   5.156   4.306
  405   1HH2  ARG  58          1HH2      ARG  58  -2.690   5.246   6.947
  406   2HH2  ARG  58          2HH2      ARG  58  -1.461   4.308   6.166
  407    H    ASN  59           H        ASN  59  -8.558   8.728   5.178
  408    HA   ASN  59           HA       ASN  59  -9.502   8.052   7.756
  409   1HB   ASN  59          1HB       ASN  59 -10.774   8.277   5.469
  410   2HB   ASN  59          2HB       ASN  59 -10.386   6.572   5.265
  411   1HD2  ASN  59          2HD2      ASN  59 -11.965   5.181   6.102
  412   2HD2  ASN  59          1HD2      ASN  59 -13.109   5.670   7.356
  413    H    LYS  60           H        LYS  60  -7.633   6.237   5.434
  414    HA   LYS  60           HA       LYS  60  -6.707   4.499   7.579
  415   1HB   LYS  60          1HB       LYS  60  -6.923   2.407   6.287
  416   2HB   LYS  60          2HB       LYS  60  -8.428   3.090   6.905
  417   1HG   LYS  60          1HG       LYS  60  -8.959   3.966   4.616
  418   2HG   LYS  60          2HG       LYS  60  -7.472   3.204   4.011
  419   1HD   LYS  60          1HD       LYS  60  -9.266   1.763   3.468
  420   2HD   LYS  60          2HD       LYS  60  -8.304   0.986   4.732
  421   1HE   LYS  60          1HE       LYS  60  -9.997   1.599   6.431
  422   2HE   LYS  60          2HE       LYS  60 -10.904   2.528   5.221
  423   1HZ   LYS  60          1HZ       LYS  60 -11.274   0.486   4.041
  424   2HZ   LYS  60          2HZ       LYS  60 -10.418  -0.365   5.165
  425   3HZ   LYS  60          3HZ       LYS  60 -11.827   0.373   5.589
  426    H    ASP  61           H        ASP  61  -6.496   4.969   4.065
  427    HA   ASP  61           HA       ASP  61  -3.630   5.591   4.248
  428   1HB   ASP  61          1HB       ASP  61  -4.775   3.080   2.959
  429   2HB   ASP  61          2HB       ASP  61  -3.247   3.796   2.418
  430    H    ASP  62           H        ASP  62  -5.424   4.272   1.588
  431    HA   ASP  62           HA       ASP  62  -4.751   6.484  -0.144
  432   1HB   ASP  62          1HB       ASP  62  -5.897   5.230  -1.862
  433   2HB   ASP  62          2HB       ASP  62  -4.840   4.144  -0.953
  434    H    LYS  63           H        LYS  63  -7.527   5.395   1.738
  435    HA   LYS  63           HA       LYS  63  -9.412   7.150   0.517
  436   1HB   LYS  63          1HB       LYS  63  -9.544   5.795   3.231
  437   2HB   LYS  63          2HB       LYS  63 -10.902   6.476   2.329
  438   1HG   LYS  63          1HG       LYS  63  -9.240   4.019   1.614
  439   2HG   LYS  63          2HG       LYS  63 -10.924   4.080   2.131
  440   1HD   LYS  63          1HD       LYS  63 -11.495   5.352   0.038
  441   2HD   LYS  63          2HD       LYS  63  -9.808   5.168  -0.494
  442   1HE   LYS  63          1HE       LYS  63 -10.055   2.678  -0.321
  443   2HE   LYS  63          2HE       LYS  63 -11.776   2.906   0.052
  444   1HZ   LYS  63          1HZ       LYS  63 -11.997   4.006  -2.071
  445   2HZ   LYS  63          2HZ       LYS  63 -10.397   3.764  -2.395
  446   3HZ   LYS  63          3HZ       LYS  63 -11.414   2.475  -2.256
  447    H    CYS  64           H        CYS  64  -7.862   9.062   0.613
  448    HA   CYS  64           HA       CYS  64  -7.708  10.366   3.219
  449   1HB   CYS  64          1HB       CYS  64  -6.244  10.724   0.865
  450   2HB   CYS  64          2HB       CYS  64  -7.218  12.177   0.999
  451    H    VAL  65           H        VAL  65  -9.257  11.513   4.155
  452    HA   VAL  65           HA       VAL  65 -11.537  12.564   2.528
  453    HB   VAL  65           HB       VAL  65 -13.017  11.798   4.302
  454   1HG1  VAL  65          1HG1      VAL  65 -12.633  10.326   2.366
  455   2HG1  VAL  65          2HG1      VAL  65 -11.355   9.478   3.261
  456   3HG1  VAL  65          3HG1      VAL  65 -13.029   9.421   3.839
  457   1HG2  VAL  65          1HG2      VAL  65 -10.532  10.484   5.526
  458   2HG2  VAL  65          2HG2      VAL  65 -11.460  11.801   6.239
  459   3HG2  VAL  65          3HG2      VAL  65 -12.197  10.207   6.059
  460    H    SER  66           H        SER  66 -12.826  14.191   3.869
  461    HA   SER  66           HA       SER  66 -11.015  16.184   4.933
  462   1HB   SER  66          1HB       SER  66 -13.118  16.832   3.858
  463   2HB   SER  66          2HB       SER  66 -14.047  15.932   5.086
  464    HG   SER  66           HG       SER  66 -13.797  18.263   5.451
  465    H    ALA  67           H        ALA  67 -10.994  16.996   7.089
  466    HA   ALA  67           HA       ALA  67 -10.896  15.180   9.296
  467   1HB   ALA  67          1HB       ALA  67 -11.380  18.191   9.211
  468   2HB   ALA  67          2HB       ALA  67 -10.975  17.234  10.648
  469   3HB   ALA  67          3HB       ALA  67  -9.800  17.380   9.325
  470    H    GLU  68           H        GLU  68 -13.421  17.109   7.786
  471    HA   GLU  68           HA       GLU  68 -15.510  16.903   9.694
  472   1HB   GLU  68          1HB       GLU  68 -15.651  16.976   6.653
  473   2HB   GLU  68          2HB       GLU  68 -16.950  17.413   7.769
  474   1HG   GLU  68          1HG       GLU  68 -15.699  19.324   8.607
  475   2HG   GLU  68          2HG       GLU  68 -14.245  18.880   7.713
  476    H    ASP  69           H        ASP  69 -14.300  14.636   7.207
  477    HA   ASP  69           HA       ASP  69 -16.515  12.757   7.504
  478   1HB   ASP  69          1HB       ASP  69 -15.074  12.917   5.416
  479   2HB   ASP  69          2HB       ASP  69 -13.744  12.227   6.369
  480    H    CYS  70           H        CYS  70 -13.069  12.963   8.503
  481    HA   CYS  70           HA       CYS  70 -12.751  10.661   9.970
  482   1HB   CYS  70          1HB       CYS  70 -11.769  13.411  10.841
  483   2HB   CYS  70          2HB       CYS  70 -11.136  11.863  11.379
  484    H    GLU  71           H        GLU  71 -14.045  13.728  11.220
  485    HA   GLU  71           HA       GLU  71 -14.634  13.047  13.856
  486   1HB   GLU  71          1HB       GLU  71 -16.058  14.867  11.886
  487   2HB   GLU  71          2HB       GLU  71 -16.448  14.826  13.610
  488   1HG   GLU  71          1HG       GLU  71 -14.334  15.666  14.260
  489   2HG   GLU  71          2HG       GLU  71 -13.578  15.301  12.714
  490    H    LEU  72           H        LEU  72 -16.516  12.215  10.959
  491    HA   LEU  72           HA       LEU  72 -18.750  11.135  12.587
  492   1HB   LEU  72          1HB       LEU  72 -18.276  11.136   9.582
  493   2HB   LEU  72          2HB       LEU  72 -19.750  10.616  10.403
  494    HG   LEU  72           HG       LEU  72 -18.619  13.456  10.486
  495   1HD1  LEU  72          1HD1      LEU  72 -19.376  12.816   8.233
  496   2HD1  LEU  72          2HD1      LEU  72 -20.944  12.300   8.896
  497   3HD1  LEU  72          3HD1      LEU  72 -20.464  14.010   8.961
  498   1HD2  LEU  72          1HD2      LEU  72 -21.261  12.300  11.481
  499   2HD2  LEU  72          2HD2      LEU  72 -19.973  13.014  12.479
  500   3HD2  LEU  72          3HD2      LEU  72 -20.886  14.031  11.363
  501    H    ASP  73           H        ASP  73 -16.233  10.013  10.342
  502    HA   ASP  73           HA       ASP  73 -16.822   7.292  10.234
  503   1HB   ASP  73          1HB       ASP  73 -15.205   8.400   8.760
  504   2HB   ASP  73          2HB       ASP  73 -14.128   8.714  10.122
  505    H    ASN  74           H        ASN  74 -14.660   9.003  12.554
  506    HA   ASN  74           HA       ASN  74 -14.832   6.686  14.417
  507   1HB   ASN  74          1HB       ASN  74 -12.999   6.103  12.949
  508   2HB   ASN  74          2HB       ASN  74 -12.289   7.714  13.117
  509   1HD2  ASN  74          2HD2      ASN  74 -10.321   6.655  13.853
  510   2HD2  ASN  74          1HD2      ASN  74 -10.223   5.997  15.486
  511    H    MET  75           H        MET  75 -15.855   7.946  15.915
  512    HA   MET  75           HA       MET  75 -14.884  10.547  16.769
  513   1HB   MET  75          1HB       MET  75 -16.933   8.612  17.922
  514   2HB   MET  75          2HB       MET  75 -16.621  10.242  18.547
  515   1HG   MET  75          1HG       MET  75 -17.239  11.249  16.437
  516   2HG   MET  75          2HG       MET  75 -17.477   9.663  15.684
  517   1HE   MET  75          1HE       MET  75 -19.542  11.930  15.399
  518   2HE   MET  75          2HE       MET  75 -19.784  10.289  14.750
  519   3HE   MET  75          3HE       MET  75 -21.065  11.063  15.711
  520    H    ASP  76           H        ASP  76 -12.643   9.321  16.868
  521    HA   ASP  76           HA       ASP  76 -12.074   7.850  19.317
  522   1HB   ASP  76          1HB       ASP  76 -10.837   7.442  17.262
  523   2HB   ASP  76          2HB       ASP  76 -10.310   9.129  17.199
  524    H    PHE  77           H        PHE  77 -13.230   9.590  20.552
  525    HA   PHE  77           HA       PHE  77 -13.203  11.077  22.228
  526   1HB   PHE  77          1HB       PHE  77 -10.209  11.416  21.824
  527   2HB   PHE  77          2HB       PHE  77 -11.167  12.035  23.151
  528    HD1  PHE  77           HD1      PHE  77 -12.178  10.513  24.845
  529    HD2  PHE  77           HD2      PHE  77  -9.650   9.013  21.690
  530    HE1  PHE  77           HE1      PHE  77 -12.004   8.333  26.013
  531    HE2  PHE  77           HE2      PHE  77  -9.539   6.816  22.822
  532    HZ   PHE  77           HZ       PHE  77 -10.695   6.475  25.001
  533    H    ILE  78           H        ILE  78 -11.134  12.245  19.567
  534    HA   ILE  78           HA       ILE  78 -11.269  13.960  18.217
  535    HB   ILE  78           HB       ILE  78 -13.912  13.327  18.546
  536   1HG1  ILE  78          1HG1      ILE  78 -14.261  14.911  16.554
  537   2HG1  ILE  78          2HG1      ILE  78 -12.537  15.280  16.689
  538   1HG2  ILE  78          1HG2      ILE  78 -14.208  15.341  20.143
  539   2HG2  ILE  78          2HG2      ILE  78 -14.012  16.347  18.695
  540   3HG2  ILE  78          3HG2      ILE  78 -15.312  15.161  18.776
  541   1HD1  ILE  78          1HD1      ILE  78 -12.156  12.721  16.547
  542   2HD1  ILE  78          2HD1      ILE  78 -13.873  12.603  16.130
  543   3HD1  ILE  78          3HD1      ILE  78 -12.766  13.517  15.085
  544    H    TYR  79           H        TYR  79 -11.944  16.487  18.232
  545    HA   TYR  79           HA       TYR  79  -9.872  17.778  19.320
  546   1HB   TYR  79          1HB       TYR  79 -12.619  18.971  18.935
  547   2HB   TYR  79          2HB       TYR  79 -11.092  19.839  18.890
  548    HD1  TYR  79           HD1      TYR  79  -9.560  17.663  17.169
  549    HD2  TYR  79           HD2      TYR  79 -13.390  19.619  16.765
  550    HE1  TYR  79           HE1      TYR  79  -9.626  17.047  14.798
  551    HE2  TYR  79           HE2      TYR  79 -13.336  19.182  14.334
  552    HH   TYR  79           HH       TYR  79 -12.236  18.010  12.614
  553    HA   PRO  80           HA       PRO  80 -10.766  17.961  23.814
  554   1HB   PRO  80          1HB       PRO  80  -8.166  19.512  23.502
  555   2HB   PRO  80          2HB       PRO  80  -8.637  18.373  24.795
  556   1HG   PRO  80          1HG       PRO  80  -6.995  17.556  22.819
  557   2HG   PRO  80          2HG       PRO  80  -8.369  16.510  23.316
  558   1HD   PRO  80          1HD       PRO  80  -8.225  18.410  20.950
  559   2HD   PRO  80          2HD       PRO  80  -8.774  16.705  20.998
  560    H    GLY  81           H        GLY  81  -9.538  20.505  21.666
  561   1HA   GLY  81          1HA       GLY  81 -11.577  22.440  22.685
  562   2HA   GLY  81          2HA       GLY  81  -9.875  22.923  22.585
  563    H    THR  82           H        THR  82  -8.895  22.003  20.277
  564    HA   THR  82           HA       THR  82 -10.780  22.574  18.057
  565    HB   THR  82           HB       THR  82  -9.167  24.242  17.143
  566    HG1  THR  82           HG1      THR  82  -7.769  23.502  19.455
  567   1HG2  THR  82          1HG2      THR  82 -11.050  25.054  18.573
  568   2HG2  THR  82          2HG2      THR  82  -9.935  25.084  19.959
  569   3HG2  THR  82          3HG2      THR  82  -9.623  26.110  18.554
  570    H    ARG  83           H        ARG  83  -8.719  22.562  16.075
  571    HA   ARG  83           HA       ARG  83  -7.676  19.806  16.211
  572   1HB   ARG  83          1HB       ARG  83  -7.472  22.034  14.130
  573   2HB   ARG  83          2HB       ARG  83  -6.769  20.414  13.958
  574   1HG   ARG  83          1HG       ARG  83  -8.922  19.370  14.157
  575   2HG   ARG  83          2HG       ARG  83  -9.745  20.903  14.467
  576   1HD   ARG  83          1HD       ARG  83 -10.131  20.228  12.155
  577   2HD   ARG  83          2HD       ARG  83  -9.161  21.700  12.212
  578    HE   ARG  83           HE       ARG  83  -7.465  20.618  11.157
  579   1HH1  ARG  83          1HH1      ARG  83  -9.611  18.111  12.521
  580   2HH1  ARG  83          2HH1      ARG  83  -8.624  16.796  11.993
  581   1HH2  ARG  83          1HH2      ARG  83  -6.353  18.929  10.211
  582   2HH2  ARG  83          2HH2      ARG  83  -6.830  17.278  10.454
  583    H    ASN  84           H        ASN  84  -6.833  20.912  18.348
  584    HA   ASN  84           HA       ASN  84  -4.147  21.134  18.706
  585   1HB   ASN  84          1HB       ASN  84  -3.661  23.088  17.552
  586   2HB   ASN  84          2HB       ASN  84  -5.337  23.633  17.521
  587   1HD2  ASN  84          2HD2      ASN  84  -6.257  24.802  19.284
  588   2HD2  ASN  84          1HD2      ASN  84  -5.208  25.524  20.506
  589    HA   PRO  85           HA       PRO  85  -6.150  21.322  22.764
  590   1HB   PRO  85          1HB       PRO  85  -4.237  22.589  24.327
  591   2HB   PRO  85          2HB       PRO  85  -4.171  20.878  23.830
  592   1HG   PRO  85          1HG       PRO  85  -2.815  23.232  22.488
  593   2HG   PRO  85          2HG       PRO  85  -2.088  21.665  22.956
  594   1HD   PRO  85          1HD       PRO  85  -2.875  22.055  20.427
  595   2HD   PRO  85          2HD       PRO  85  -3.276  20.523  21.224
  Start of MODEL    7
    1   1H    LYS   1          1H        LYS   1  -9.387  16.795 -10.332
    2   2H    LYS   1          2H        LYS   1 -10.731  15.854 -10.098
    3   3H    LYS   1          3H        LYS   1 -10.187  16.859  -8.903
    4    HA   LYS   1           HA       LYS   1  -9.602  14.686  -8.337
    5   1HB   LYS   1          1HB       LYS   1  -8.185  13.318  -9.747
    6   2HB   LYS   1          2HB       LYS   1  -9.674  13.746 -10.598
    7   1HG   LYS   1          1HG       LYS   1  -8.367  15.590 -11.773
    8   2HG   LYS   1          2HG       LYS   1  -6.896  14.948 -11.029
    9   1HD   LYS   1          1HD       LYS   1  -8.767  13.472 -12.940
   10   2HD   LYS   1          2HD       LYS   1  -7.167  14.136 -13.313
   11   1HE   LYS   1          1HE       LYS   1  -6.180  12.580 -11.579
   12   2HE   LYS   1          2HE       LYS   1  -7.777  11.821 -11.418
   13   1HZ   LYS   1          1HZ       LYS   1  -7.683  11.276 -13.733
   14   2HZ   LYS   1          2HZ       LYS   1  -6.196  11.974 -13.880
   15   3HZ   LYS   1          3HZ       LYS   1  -6.392  10.644 -12.927
   16    H    ALA   2           H        ALA   2  -7.473  14.100  -7.436
   17    HA   ALA   2           HA       ALA   2  -5.994  16.436  -6.620
   18   1HB   ALA   2          1HB       ALA   2  -5.530  13.465  -6.110
   19   2HB   ALA   2          2HB       ALA   2  -4.693  14.785  -5.279
   20   3HB   ALA   2          3HB       ALA   2  -6.441  14.591  -5.079
   21    H    THR   3           H        THR   3  -5.583  16.776  -9.117
   22    HA   THR   3           HA       THR   3  -4.211  16.812 -10.915
   23    HB   THR   3           HB       THR   3  -1.883  17.294 -10.480
   24    HG1  THR   3           HG1      THR   3  -2.403  16.040  -8.007
   25   1HG2  THR   3          1HG2      THR   3  -3.570  19.023  -9.870
   26   2HG2  THR   3          2HG2      THR   3  -3.569  18.417  -8.197
   27   3HG2  THR   3          3HG2      THR   3  -2.095  19.112  -8.888
   28    H    MET   4           H        MET   4  -1.535  15.039  -9.815
   29    HA   MET   4           HA       MET   4  -2.071  12.768 -11.616
   30   1HB   MET   4          1HB       MET   4   0.211  13.265  -9.663
   31   2HB   MET   4          2HB       MET   4   0.129  12.014 -10.908
   32   1HG   MET   4          1HG       MET   4   1.504  13.619 -11.857
   33   2HG   MET   4          2HG       MET   4  -0.058  13.919 -12.613
   34   1HE   MET   4          1HE       MET   4   2.604  15.092  -9.979
   35   2HE   MET   4          2HE       MET   4   1.937  16.647  -9.432
   36   3HE   MET   4          3HE       MET   4   1.159  15.135  -8.939
   37    H    GLN   5           H        GLN   5  -4.149  12.536 -10.174
   38    HA   GLN   5           HA       GLN   5  -3.928  11.705  -7.518
   39   1HB   GLN   5          1HB       GLN   5  -5.960  12.543  -8.526
   40   2HB   GLN   5          2HB       GLN   5  -6.148  11.068  -9.491
   41   1HG   GLN   5          1HG       GLN   5  -6.494   9.714  -7.540
   42   2HG   GLN   5          2HG       GLN   5  -5.999  11.020  -6.449
   43   1HE2  GLN   5          2HE2      GLN   5  -8.674   9.385  -6.958
   44   2HE2  GLN   5          1HE2      GLN   5  -9.857  10.684  -6.948
   45    H    CYS   6           H        CYS   6  -2.826   9.887  -6.733
   46    HA   CYS   6           HA       CYS   6  -2.221   7.619  -8.392
   47   1HB   CYS   6          1HB       CYS   6  -1.392   6.611  -6.316
   48   2HB   CYS   6          2HB       CYS   6  -0.883   8.288  -6.486
   49    H    GLY   7           H        GLY   7  -4.868   8.335  -6.134
   50   1HA   GLY   7          1HA       GLY   7  -6.445   6.073  -7.027
   51   2HA   GLY   7          2HA       GLY   7  -5.694   5.780  -5.448
   52    H    GLU   8           H        GLU   8  -6.357   7.100  -3.620
   53    HA   GLU   8           HA       GLU   8  -9.114   8.155  -4.065
   54   1HB   GLU   8          1HB       GLU   8  -7.932   7.131  -1.504
   55   2HB   GLU   8          2HB       GLU   8  -9.628   7.387  -1.932
   56   1HG   GLU   8          1HG       GLU   8  -7.782   5.274  -3.180
   57   2HG   GLU   8          2HG       GLU   8  -8.984   4.971  -1.953
   58    H    ASN   9           H        ASN   9  -7.940  10.093  -4.813
   59    HA   ASN   9           HA       ASN   9  -7.611  12.303  -4.585
   60   1HB   ASN   9          1HB       ASN   9  -9.744  11.949  -3.233
   61   2HB   ASN   9          2HB       ASN   9  -8.751  12.084  -1.775
   62   1HD2  ASN   9          2HD2      ASN   9  -9.277  14.091  -0.933
   63   2HD2  ASN   9          1HD2      ASN   9  -9.406  15.562  -1.890
   64    H    GLU  10           H        GLU  10  -5.365  10.782  -4.125
   65    HA   GLU  10           HA       GLU  10  -3.768  12.679  -2.499
   66   1HB   GLU  10          1HB       GLU  10  -3.317   9.667  -2.723
   67   2HB   GLU  10          2HB       GLU  10  -2.199  10.843  -2.021
   68   1HG   GLU  10          1HG       GLU  10  -4.122  11.434  -0.420
   69   2HG   GLU  10          2HG       GLU  10  -4.937   9.981  -1.009
   70    H    LYS  11           H        LYS  11  -1.898  13.345  -3.576
   71    HA   LYS  11           HA       LYS  11  -2.004  12.897  -6.519
   72   1HB   LYS  11          1HB       LYS  11  -0.766  14.931  -6.723
   73   2HB   LYS  11          2HB       LYS  11  -2.239  15.225  -5.787
   74   1HG   LYS  11          1HG       LYS  11  -0.991  15.314  -3.706
   75   2HG   LYS  11          2HG       LYS  11   0.519  14.902  -4.510
   76   1HD   LYS  11          1HD       LYS  11  -1.122  17.405  -5.072
   77   2HD   LYS  11          2HD       LYS  11   0.301  17.320  -4.027
   78   1HE   LYS  11          1HE       LYS  11   0.217  16.900  -7.052
   79   2HE   LYS  11          2HE       LYS  11   0.942  18.235  -6.163
   80   1HZ   LYS  11          1HZ       LYS  11   2.476  16.645  -5.192
   81   2HZ   LYS  11          2HZ       LYS  11   1.859  15.438  -6.135
   82   3HZ   LYS  11          3HZ       LYS  11   2.600  16.725  -6.831
   83    H    TYR  12           H        TYR  12  -0.194  12.091  -7.630
   84    HA   TYR  12           HA       TYR  12   1.792  10.601  -6.384
   85   1HB   TYR  12          1HB       TYR  12   1.347  10.486  -8.780
   86   2HB   TYR  12          2HB       TYR  12   2.027  12.102  -8.998
   87    HD1  TYR  12           HD1      TYR  12   2.845   8.562  -8.246
   88    HD2  TYR  12           HD2      TYR  12   4.434  12.528  -8.830
   89    HE1  TYR  12           HE1      TYR  12   5.147   7.655  -8.183
   90    HE2  TYR  12           HE2      TYR  12   6.726  11.638  -8.669
   91    HH   TYR  12           HH       TYR  12   8.010   9.803  -8.215
   92    H    ASP  13           H        ASP  13   3.558  11.095  -5.192
   93    HA   ASP  13           HA       ASP  13   5.332  13.202  -5.668
   94   1HB   ASP  13          1HB       ASP  13   3.631  14.681  -4.566
   95   2HB   ASP  13          2HB       ASP  13   3.575  13.525  -3.221
   96    H    SER  14           H        SER  14   7.245  12.686  -4.519
   97    HA   SER  14           HA       SER  14   7.373  10.024  -3.758
   98   1HB   SER  14          1HB       SER  14   9.511  12.120  -3.322
   99   2HB   SER  14          2HB       SER  14   9.718  10.387  -3.652
  100    HG   SER  14           HG       SER  14   9.973  11.725  -5.538
  101    H    CYS  15           H        CYS  15   5.731  10.105  -1.926
  102    HA   CYS  15           HA       CYS  15   7.399   9.671   0.356
  103   1HB   CYS  15          1HB       CYS  15   6.098  12.166   0.481
  104   2HB   CYS  15          2HB       CYS  15   5.235  11.147   1.637
  105    H    GLY  16           H        GLY  16   5.946   7.976  -1.343
  106   1HA   GLY  16          1HA       GLY  16   4.781   5.992  -1.110
  107   2HA   GLY  16          2HA       GLY  16   5.543   5.937   0.480
  108    H    SER  17           H        SER  17   2.699   7.628  -1.003
  109    HA   SER  17           HA       SER  17   0.537   7.627  -0.387
  110   1HB   SER  17          1HB       SER  17   1.018   5.423   1.646
  111   2HB   SER  17          2HB       SER  17  -0.466   5.861   0.799
  112    HG   SER  17           HG       SER  17   0.773   5.267  -1.184
  113    H    LYS  18           H        LYS  18   2.199   9.474   0.611
  114    HA   LYS  18           HA       LYS  18   2.789  10.922   2.266
  115   1HB   LYS  18          1HB       LYS  18   0.128  11.040   2.139
  116   2HB   LYS  18          2HB       LYS  18   0.209  10.284   3.721
  117   1HG   LYS  18          1HG       LYS  18   1.718  12.194   4.465
  118   2HG   LYS  18          2HG       LYS  18   1.477  12.928   2.878
  119   1HD   LYS  18          1HD       LYS  18  -0.982  12.969   3.313
  120   2HD   LYS  18          2HD       LYS  18  -0.710  12.292   4.921
  121   1HE   LYS  18          1HE       LYS  18   0.627  14.283   5.542
  122   2HE   LYS  18          2HE       LYS  18   0.463  14.928   3.898
  123   1HZ   LYS  18          1HZ       LYS  18  -1.770  14.461   5.746
  124   2HZ   LYS  18          2HZ       LYS  18  -1.084  15.917   5.398
  125   3HZ   LYS  18          3HZ       LYS  18  -1.885  15.081   4.231
  126    H    GLU  19           H        GLU  19   3.622   8.111   2.654
  127    HA   GLU  19           HA       GLU  19   4.006   6.478   4.096
  128   1HB   GLU  19          1HB       GLU  19   5.540   6.982   5.884
  129   2HB   GLU  19          2HB       GLU  19   5.969   7.789   4.383
  130   1HG   GLU  19          1HG       GLU  19   5.140   9.934   5.249
  131   2HG   GLU  19          2HG       GLU  19   4.511   9.138   6.704
  132    H    CYS  20           H        CYS  20   1.357   7.255   4.282
  133    HA   CYS  20           HA       CYS  20  -0.484   7.408   5.538
  134   1HB   CYS  20          1HB       CYS  20   0.270   4.964   5.695
  135   2HB   CYS  20          2HB       CYS  20   0.819   5.379   7.321
  136    H    ASP  21           H        ASP  21   1.370   9.370   6.185
  137    HA   ASP  21           HA       ASP  21   2.085   9.646   8.846
  138   1HB   ASP  21          1HB       ASP  21   3.153  10.951   7.079
  139   2HB   ASP  21          2HB       ASP  21   1.654  11.772   6.704
  140    H    LYS  22           H        LYS  22  -0.315  11.897   7.410
  141    HA   LYS  22           HA       LYS  22  -1.707  12.054   9.984
  142   1HB   LYS  22          1HB       LYS  22  -2.390  13.371   7.335
  143   2HB   LYS  22          2HB       LYS  22  -3.138  13.641   8.911
  144   1HG   LYS  22          1HG       LYS  22  -0.543  14.075   9.600
  145   2HG   LYS  22          2HG       LYS  22  -0.481  14.584   7.913
  146   1HD   LYS  22          1HD       LYS  22  -2.347  15.605  10.111
  147   2HD   LYS  22          2HD       LYS  22  -0.980  16.474   9.405
  148   1HE   LYS  22          1HE       LYS  22  -2.149  16.545   7.212
  149   2HE   LYS  22          2HE       LYS  22  -3.525  15.665   7.898
  150   1HZ   LYS  22          1HZ       LYS  22  -3.798  17.470   9.454
  151   2HZ   LYS  22          2HZ       LYS  22  -2.588  18.314   8.715
  152   3HZ   LYS  22          3HZ       LYS  22  -3.966  17.938   7.880
  153    H    LYS  23           H        LYS  23  -1.933   9.558   9.731
  154    HA   LYS  23           HA       LYS  23  -4.253   8.710   8.197
  155   1HB   LYS  23          1HB       LYS  23  -4.178   6.692   9.430
  156   2HB   LYS  23          2HB       LYS  23  -2.522   7.186   9.108
  157   1HG   LYS  23          1HG       LYS  23  -2.397   6.418  11.265
  158   2HG   LYS  23          2HG       LYS  23  -2.509   8.163  11.522
  159   1HD   LYS  23          1HD       LYS  23  -4.877   7.944  12.111
  160   2HD   LYS  23          2HD       LYS  23  -4.916   6.256  11.589
  161   1HE   LYS  23          1HE       LYS  23  -3.401   5.654  13.451
  162   2HE   LYS  23          2HE       LYS  23  -3.296   7.358  13.923
  163   1HZ   LYS  23          1HZ       LYS  23  -5.721   7.287  14.198
  164   2HZ   LYS  23          2HZ       LYS  23  -5.683   5.659  13.978
  165   3HZ   LYS  23          3HZ       LYS  23  -4.895   6.343  15.262
  166    H    CYS  24           H        CYS  24  -6.493   8.456   9.118
  167    HA   CYS  24           HA       CYS  24  -7.322  10.708  10.565
  168   1HB   CYS  24          1HB       CYS  24  -8.802   9.422   9.196
  169   2HB   CYS  24          2HB       CYS  24  -8.654   8.008  10.253
  170    H    LYS  25           H        LYS  25  -6.150  11.067  12.457
  171    HA   LYS  25           HA       LYS  25  -6.160   9.260  14.746
  172   1HB   LYS  25          1HB       LYS  25  -5.567  12.198  14.283
  173   2HB   LYS  25          2HB       LYS  25  -5.924  11.649  15.909
  174   1HG   LYS  25          1HG       LYS  25  -3.548  11.667  15.634
  175   2HG   LYS  25          2HG       LYS  25  -4.192  10.069  15.981
  176   1HD   LYS  25          1HD       LYS  25  -2.598   9.574  14.436
  177   2HD   LYS  25          2HD       LYS  25  -4.026   9.663  13.402
  178   1HE   LYS  25          1HE       LYS  25  -1.879  11.816  13.816
  179   2HE   LYS  25          2HE       LYS  25  -2.049  10.757  12.404
  180   1HZ   LYS  25          1HZ       LYS  25  -4.138  11.739  11.950
  181   2HZ   LYS  25          2HZ       LYS  25  -3.994  12.769  13.242
  182   3HZ   LYS  25          3HZ       LYS  25  -2.949  12.883  11.973
  183    H    TYR  26           H        TYR  26  -8.384   8.568  14.323
  184    HA   TYR  26           HA       TYR  26 -10.686   9.857  14.174
  185   1HB   TYR  26          1HB       TYR  26 -10.178   7.522  16.057
  186   2HB   TYR  26          2HB       TYR  26 -11.759   8.015  15.494
  187    HD1  TYR  26           HD1      TYR  26 -12.296   7.972  13.009
  188    HD2  TYR  26           HD2      TYR  26  -8.794   6.095  14.688
  189    HE1  TYR  26           HE1      TYR  26 -11.870   6.832  10.859
  190    HE2  TYR  26           HE2      TYR  26  -8.399   4.925  12.549
  191    HH   TYR  26           HH       TYR  26 -10.184   5.794   9.623
  192    H    ASP  27           H        ASP  27  -9.145   9.331  17.378
  193    HA   ASP  27           HA       ASP  27  -9.455  10.344  19.380
  194   1HB   ASP  27          1HB       ASP  27  -8.583  12.202  17.754
  195   2HB   ASP  27          2HB       ASP  27 -10.213  12.876  17.890
  196    H    GLY  28           H        GLY  28 -11.455  12.640  19.906
  197   1HA   GLY  28          1HA       GLY  28 -13.671  12.915  20.403
  198   2HA   GLY  28          2HA       GLY  28 -13.974  12.003  18.928
  199    H    VAL  29           H        VAL  29 -14.394   9.834  19.040
  200    HA   VAL  29           HA       VAL  29 -15.507   8.789  21.596
  201    HB   VAL  29           HB       VAL  29 -15.663   7.672  18.763
  202   1HG1  VAL  29          1HG1      VAL  29 -17.081   6.845  21.330
  203   2HG1  VAL  29          2HG1      VAL  29 -17.475   6.252  19.702
  204   3HG1  VAL  29          3HG1      VAL  29 -15.902   5.878  20.416
  205   1HG2  VAL  29          1HG2      VAL  29 -17.728   9.171  20.440
  206   2HG2  VAL  29          2HG2      VAL  29 -16.908   9.819  19.006
  207   3HG2  VAL  29          3HG2      VAL  29 -18.014   8.449  18.843
  208    H    GLU  30           H        GLU  30 -12.881   8.303  19.283
  209    HA   GLU  30           HA       GLU  30 -11.778   5.900  20.534
  210   1HB   GLU  30          1HB       GLU  30 -11.365   6.511  18.137
  211   2HB   GLU  30          2HB       GLU  30 -10.566   7.982  18.695
  212   1HG   GLU  30          1HG       GLU  30  -8.950   6.420  19.990
  213   2HG   GLU  30          2HG       GLU  30  -9.634   5.114  19.017
  214    H    GLU  31           H        GLU  31 -12.093   6.783  22.718
  215    HA   GLU  31           HA       GLU  31 -10.719   8.926  23.875
  216   1HB   GLU  31          1HB       GLU  31 -10.943   6.131  25.085
  217   2HB   GLU  31          2HB       GLU  31 -10.725   7.656  25.952
  218   1HG   GLU  31          1HG       GLU  31 -13.210   6.746  24.425
  219   2HG   GLU  31          2HG       GLU  31 -13.026   6.943  26.163
  220    H    GLU  32           H        GLU  32  -9.447   5.890  22.680
  221    HA   GLU  32           HA       GLU  32  -6.737   6.184  23.684
  222   1HB   GLU  32          1HB       GLU  32  -7.818   4.485  21.383
  223   2HB   GLU  32          2HB       GLU  32  -6.258   4.339  22.182
  224   1HG   GLU  32          1HG       GLU  32  -7.591   2.611  23.088
  225   2HG   GLU  32          2HG       GLU  32  -7.466   3.838  24.353
  226    H    ASP  33           H        ASP  33  -7.059   8.610  22.882
  227    HA   ASP  33           HA       ASP  33  -6.648   9.159  20.087
  228   1HB   ASP  33          1HB       ASP  33  -7.621  10.832  21.556
  229   2HB   ASP  33          2HB       ASP  33  -6.171  10.843  22.575
  230    H    ASP  34           H        ASP  34  -4.984   7.696  19.567
  231    HA   ASP  34           HA       ASP  34  -2.459   7.485  20.649
  232   1HB   ASP  34          1HB       ASP  34  -1.700   6.635  18.514
  233   2HB   ASP  34          2HB       ASP  34  -3.336   6.051  18.845
  234    H    GLU  35           H        GLU  35  -3.597  10.137  18.635
  235    HA   GLU  35           HA       GLU  35  -2.763  12.086  17.960
  236   1HB   GLU  35          1HB       GLU  35  -0.667  11.703  20.136
  237   2HB   GLU  35          2HB       GLU  35  -0.919  13.172  19.189
  238   1HG   GLU  35          1HG       GLU  35  -3.269  13.301  19.999
  239   2HG   GLU  35          2HG       GLU  35  -2.978  11.878  21.012
  240    H    GLU  36           H        GLU  36   0.125  10.012  18.481
  241    HA   GLU  36           HA       GLU  36   1.839  11.333  16.797
  242   1HB   GLU  36          1HB       GLU  36   1.736   8.343  17.332
  243   2HB   GLU  36          2HB       GLU  36   3.115   9.227  16.656
  244   1HG   GLU  36          1HG       GLU  36   3.204  10.622  18.742
  245   2HG   GLU  36          2HG       GLU  36   1.930   9.609  19.445
  246    HA   PRO  37           HA       PRO  37   0.129  10.004  12.749
  247   1HB   PRO  37          1HB       PRO  37   1.531  11.664  11.137
  248   2HB   PRO  37          2HB       PRO  37   0.190  12.257  12.161
  249   1HG   PRO  37          1HG       PRO  37   3.172  12.354  12.723
  250   2HG   PRO  37          2HG       PRO  37   1.998  13.696  12.859
  251   1HD   PRO  37          1HD       PRO  37   2.797  12.151  14.985
  252   2HD   PRO  37          2HD       PRO  37   1.148  12.846  14.893
  253    H    ASN  38           H        ASN  38   1.140   8.974  10.871
  254    HA   ASN  38           HA       ASN  38   2.412   7.386   9.932
  255   1HB   ASN  38          1HB       ASN  38   4.143   9.016   9.575
  256   2HB   ASN  38          2HB       ASN  38   4.721   8.871  11.235
  257   1HD2  ASN  38          2HD2      ASN  38   4.094   6.716   8.354
  258   2HD2  ASN  38          1HD2      ASN  38   5.528   5.753   8.658
  259    H    VAL  39           H        VAL  39   3.969   7.718  13.115
  260    HA   VAL  39           HA       VAL  39   4.970   5.306  13.636
  261    HB   VAL  39           HB       VAL  39   3.410   7.046  15.576
  262   1HG1  VAL  39          1HG1      VAL  39   5.365   4.775  16.140
  263   2HG1  VAL  39          2HG1      VAL  39   4.793   5.952  17.339
  264   3HG1  VAL  39          3HG1      VAL  39   3.650   4.828  16.604
  265   1HG2  VAL  39          1HG2      VAL  39   6.381   6.833  14.928
  266   2HG2  VAL  39          2HG2      VAL  39   5.321   8.192  14.502
  267   3HG2  VAL  39          3HG2      VAL  39   5.665   7.846  16.196
  268    HA   PRO  40           HA       PRO  40   0.946   3.069  15.080
  269   1HB   PRO  40          1HB       PRO  40  -1.462   4.030  14.058
  270   2HB   PRO  40          2HB       PRO  40  -0.805   4.412  15.671
  271   1HG   PRO  40          1HG       PRO  40  -0.547   6.100  13.151
  272   2HG   PRO  40          2HG       PRO  40  -1.017   6.627  14.785
  273   1HD   PRO  40          1HD       PRO  40   1.472   6.956  13.964
  274   2HD   PRO  40          2HD       PRO  40   1.183   6.343  15.610
  275    H    CYS  41           H        CYS  41   0.526   4.743  11.933
  276    HA   CYS  41           HA       CYS  41  -0.088   2.172  10.551
  277   1HB   CYS  41          1HB       CYS  41  -1.596   4.196  10.335
  278   2HB   CYS  41          2HB       CYS  41  -0.231   5.051   9.622
  279    H    LEU  42           H        LEU  42   2.354   1.986  11.327
  280    HA   LEU  42           HA       LEU  42   4.298   3.591  10.046
  281   1HB   LEU  42          1HB       LEU  42   5.948   1.884  10.973
  282   2HB   LEU  42          2HB       LEU  42   4.965   2.850  12.043
  283    HG   LEU  42           HG       LEU  42   3.486   0.984  12.550
  284   1HD1  LEU  42          1HD1      LEU  42   5.220  -0.688  10.677
  285   2HD1  LEU  42          2HD1      LEU  42   3.940  -1.295  11.744
  286   3HD1  LEU  42          3HD1      LEU  42   3.520  -0.242  10.388
  287   1HD2  LEU  42          1HD2      LEU  42   5.540   1.292  13.852
  288   2HD2  LEU  42          2HD2      LEU  42   5.090  -0.420  13.740
  289   3HD2  LEU  42          3HD2      LEU  42   6.417   0.214  12.743
  290    H    VAL  43           H        VAL  43   3.196   3.131   7.777
  291    HA   VAL  43           HA       VAL  43   4.499   0.993   6.277
  292    HB   VAL  43           HB       VAL  43   4.007   2.435   4.248
  293   1HG1  VAL  43          1HG1      VAL  43   2.457   0.663   5.077
  294   2HG1  VAL  43          2HG1      VAL  43   1.666   1.853   6.134
  295   3HG1  VAL  43          3HG1      VAL  43   1.576   2.027   4.369
  296   1HG2  VAL  43          1HG2      VAL  43   2.593   4.245   6.233
  297   2HG2  VAL  43          2HG2      VAL  43   4.013   4.638   5.244
  298   3HG2  VAL  43          3HG2      VAL  43   2.468   4.298   4.465
  299    H    ARG  44           H        ARG  44   5.204   4.407   6.902
  300    HA   ARG  44           HA       ARG  44   7.068   5.558   7.218
  301   1HB   ARG  44          1HB       ARG  44   7.616   3.464   8.583
  302   2HB   ARG  44          2HB       ARG  44   8.639   2.965   7.234
  303   1HG   ARG  44          1HG       ARG  44  10.041   3.989   8.839
  304   2HG   ARG  44          2HG       ARG  44   9.930   5.134   7.497
  305   1HD   ARG  44          1HD       ARG  44   8.317   6.504   8.784
  306   2HD   ARG  44          2HD       ARG  44   8.283   5.275  10.071
  307    HE   ARG  44           HE       ARG  44  10.963   6.130   9.612
  308   1HH1  ARG  44          1HH1      ARG  44   7.900   7.319  10.974
  309   2HH1  ARG  44          2HH1      ARG  44   8.675   8.435  12.063
  310   1HH2  ARG  44          1HH2      ARG  44  11.964   7.586  11.046
  311   2HH2  ARG  44          2HH2      ARG  44  11.015   8.589  12.109
  312    H    VAL  45           H        VAL  45   7.670   3.057   4.751
  313    HA   VAL  45           HA       VAL  45   9.886   4.272   3.578
  314    HB   VAL  45           HB       VAL  45   9.439   2.752   1.656
  315   1HG1  VAL  45          1HG1      VAL  45  10.767   2.084   3.622
  316   2HG1  VAL  45          2HG1      VAL  45   9.298   1.501   4.432
  317   3HG1  VAL  45          3HG1      VAL  45   9.868   0.716   2.948
  318   1HG2  VAL  45          1HG2      VAL  45   6.920   2.620   1.748
  319   2HG2  VAL  45          2HG2      VAL  45   7.715   1.049   1.800
  320   3HG2  VAL  45          3HG2      VAL  45   7.051   1.746   3.280
  321    H    CYS  46           H        CYS  46   9.229   6.543   3.519
  322    HA   CYS  46           HA       CYS  46   7.632   7.521   1.359
  323   1HB   CYS  46          1HB       CYS  46   9.922   8.748   2.904
  324   2HB   CYS  46          2HB       CYS  46   9.255   9.507   1.467
  325    H    HIS  47           H        HIS  47   8.234   5.882  -0.142
  326    HA   HIS  47           HA       HIS  47  10.688   6.411  -1.728
  327   1HB   HIS  47          1HB       HIS  47  10.130   4.464  -2.987
  328   2HB   HIS  47          2HB       HIS  47  10.133   4.085  -1.271
  329    HD1  HIS  47           HD1      HIS  47   7.175   4.456  -0.371
  330    HD2  HIS  47           HD2      HIS  47   8.316   3.191  -4.225
  331    HE1  HIS  47           HE1      HIS  47   5.050   3.731  -1.584
  332    H    GLN  48           H        GLN  48   8.157   5.562  -3.665
  333    HA   GLN  48           HA       GLN  48   7.884   8.243  -4.851
  334   1HB   GLN  48          1HB       GLN  48   7.196   5.470  -5.903
  335   2HB   GLN  48          2HB       GLN  48   7.019   7.012  -6.770
  336   1HG   GLN  48          1HG       GLN  48   9.528   7.353  -6.359
  337   2HG   GLN  48          2HG       GLN  48   9.552   5.684  -5.754
  338   1HE2  GLN  48          2HE2      GLN  48   8.155   7.468  -8.614
  339   2HE2  GLN  48          1HE2      GLN  48   8.719   6.275  -9.779
  340    H    ASP  49           H        ASP  49   5.414   6.197  -5.674
  341    HA   ASP  49           HA       ASP  49   3.264   6.597  -5.832
  342   1HB   ASP  49          1HB       ASP  49   3.608   4.867  -4.042
  343   2HB   ASP  49          2HB       ASP  49   3.355   6.130  -2.835
  344    H    CYS  50           H        CYS  50   1.749   7.734  -3.235
  345    HA   CYS  50           HA       CYS  50   1.923  10.538  -4.156
  346   1HB   CYS  50          1HB       CYS  50  -0.626  10.444  -3.702
  347   2HB   CYS  50          2HB       CYS  50   0.015   9.567  -5.071
  348    H    VAL  51           H        VAL  51   0.687  12.038  -2.799
  349    HA   VAL  51           HA       VAL  51   0.750  11.492   0.081
  350    HB   VAL  51           HB       VAL  51   1.746  13.612   0.633
  351   1HG1  VAL  51          1HG1      VAL  51   3.306  11.742   0.237
  352   2HG1  VAL  51          2HG1      VAL  51   3.543  12.270  -1.427
  353   3HG1  VAL  51          3HG1      VAL  51   4.036  13.323  -0.089
  354   1HG2  VAL  51          1HG2      VAL  51   1.706  14.195  -2.339
  355   2HG2  VAL  51          2HG2      VAL  51   0.992  15.119  -1.016
  356   3HG2  VAL  51          3HG2      VAL  51   2.744  15.080  -1.194
  357    H    CYS  52           H        CYS  52  -0.697  13.099   1.215
  358    HA   CYS  52           HA       CYS  52  -3.091  13.511  -0.410
  359   1HB   CYS  52          1HB       CYS  52  -2.664  14.421   2.454
  360   2HB   CYS  52          2HB       CYS  52  -4.154  14.279   1.533
  361    H    GLU  53           H        GLU  53  -4.158  15.512  -0.685
  362    HA   GLU  53           HA       GLU  53  -2.362  17.853  -0.961
  363   1HB   GLU  53          1HB       GLU  53  -5.294  17.515  -1.711
  364   2HB   GLU  53          2HB       GLU  53  -4.244  18.879  -2.119
  365   1HG   GLU  53          1HG       GLU  53  -2.713  17.252  -3.312
  366   2HG   GLU  53          2HG       GLU  53  -3.947  16.001  -3.091
  367    H    GLU  54           H        GLU  54  -3.282  19.919  -0.228
  368    HA   GLU  54           HA       GLU  54  -3.531  21.267   1.639
  369   1HB   GLU  54          1HB       GLU  54  -6.255  20.188   0.910
  370   2HB   GLU  54          2HB       GLU  54  -5.963  21.723   1.742
  371   1HG   GLU  54          1HG       GLU  54  -4.695  22.539  -0.239
  372   2HG   GLU  54          2HG       GLU  54  -5.040  21.019  -1.087
  373    H    GLY  55           H        GLY  55  -2.554  19.080   2.898
  374   1HA   GLY  55          1HA       GLY  55  -2.434  18.037   4.927
  375   2HA   GLY  55          2HA       GLY  55  -3.251  19.477   5.554
  376    H    PHE  56           H        PHE  56  -4.719  17.109   3.266
  377    HA   PHE  56           HA       PHE  56  -6.953  16.642   5.033
  378   1HB   PHE  56          1HB       PHE  56  -5.912  14.956   2.755
  379   2HB   PHE  56          2HB       PHE  56  -7.523  14.855   3.445
  380    HD1  PHE  56           HD1      PHE  56  -7.605  18.183   3.427
  381    HD2  PHE  56           HD2      PHE  56  -6.822  15.082   0.517
  382    HE1  PHE  56           HE1      PHE  56  -8.636  19.559   1.659
  383    HE2  PHE  56           HE2      PHE  56  -7.574  16.575  -1.266
  384    HZ   PHE  56           HZ       PHE  56  -8.571  18.804  -0.707
  385    H    TYR  57           H        TYR  57  -7.592  14.526   5.960
  386    HA   TYR  57           HA       TYR  57  -5.263  12.964   6.953
  387   1HB   TYR  57          1HB       TYR  57  -8.100  13.233   8.010
  388   2HB   TYR  57          2HB       TYR  57  -6.891  12.119   8.630
  389    HD1  TYR  57           HD1      TYR  57  -7.535  15.763   8.059
  390    HD2  TYR  57           HD2      TYR  57  -5.207  12.818  10.152
  391    HE1  TYR  57           HE1      TYR  57  -6.788  17.517   9.584
  392    HE2  TYR  57           HE2      TYR  57  -4.385  14.626  11.707
  393    HH   TYR  57           HH       TYR  57  -5.471  17.997  11.473
  394    H    ARG  58           H        ARG  58  -5.299  10.747   6.720
  395    HA   ARG  58           HA       ARG  58  -6.850   9.692   4.457
  396   1HB   ARG  58          1HB       ARG  58  -5.138   7.998   6.283
  397   2HB   ARG  58          2HB       ARG  58  -5.547   7.780   4.584
  398   1HG   ARG  58          1HG       ARG  58  -4.168   9.859   4.070
  399   2HG   ARG  58          2HG       ARG  58  -3.683   9.900   5.774
  400   1HD   ARG  58          1HD       ARG  58  -1.959   8.798   4.565
  401   2HD   ARG  58          2HD       ARG  58  -2.816   7.568   5.525
  402    HE   ARG  58           HE       ARG  58  -3.466   8.083   2.642
  403   1HH1  ARG  58          1HH1      ARG  58  -2.222   5.705   5.040
  404   2HH1  ARG  58          2HH1      ARG  58  -2.023   4.481   3.833
  405   1HH2  ARG  58          1HH2      ARG  58  -3.219   6.423   1.148
  406   2HH2  ARG  58          2HH2      ARG  58  -2.631   4.858   1.641
  407    H    ASN  59           H        ASN  59  -8.998   9.390   4.892
  408    HA   ASN  59           HA       ASN  59 -10.068   9.365   7.437
  409   1HB   ASN  59          1HB       ASN  59 -12.169   9.090   6.535
  410   2HB   ASN  59          2HB       ASN  59 -11.228  10.025   5.381
  411   1HD2  ASN  59          2HD2      ASN  59 -13.568   8.943   4.566
  412   2HD2  ASN  59          1HD2      ASN  59 -13.292   7.567   3.502
  413    H    LYS  60           H        LYS  60  -9.565   6.517   5.407
  414    HA   LYS  60           HA       LYS  60  -9.047   4.841   7.733
  415   1HB   LYS  60          1HB       LYS  60 -10.789   3.241   7.424
  416   2HB   LYS  60          2HB       LYS  60 -11.514   4.831   7.682
  417   1HG   LYS  60          1HG       LYS  60 -11.729   4.933   5.076
  418   2HG   LYS  60          2HG       LYS  60 -11.378   3.200   5.126
  419   1HD   LYS  60          1HD       LYS  60 -13.761   4.658   6.328
  420   2HD   LYS  60          2HD       LYS  60 -13.731   3.525   4.991
  421   1HE   LYS  60          1HE       LYS  60 -14.634   2.317   6.774
  422   2HE   LYS  60          2HE       LYS  60 -12.968   1.727   6.679
  423   1HZ   LYS  60          1HZ       LYS  60 -13.852   3.867   8.503
  424   2HZ   LYS  60          2HZ       LYS  60 -13.874   2.275   8.922
  425   3HZ   LYS  60          3HZ       LYS  60 -12.447   3.021   8.566
  426    H    ASP  61           H        ASP  61  -9.708   4.919   4.223
  427    HA   ASP  61           HA       ASP  61  -7.503   2.941   3.749
  428   1HB   ASP  61          1HB       ASP  61  -9.637   1.728   3.791
  429   2HB   ASP  61          2HB       ASP  61 -10.359   2.935   2.703
  430    H    ASP  62           H        ASP  62  -6.245   4.730   3.051
  431    HA   ASP  62           HA       ASP  62  -5.453   6.406   1.848
  432   1HB   ASP  62          1HB       ASP  62  -5.249   4.482   0.270
  433   2HB   ASP  62          2HB       ASP  62  -6.767   4.970  -0.489
  434    H    LYS  63           H        LYS  63  -9.007   6.301   1.584
  435    HA   LYS  63           HA       LYS  63  -9.316   8.536  -0.026
  436   1HB   LYS  63          1HB       LYS  63 -11.297   8.496   2.120
  437   2HB   LYS  63          2HB       LYS  63 -11.486   8.515   0.399
  438   1HG   LYS  63          1HG       LYS  63 -10.950   6.006   2.071
  439   2HG   LYS  63          2HG       LYS  63 -12.507   6.573   1.494
  440   1HD   LYS  63          1HD       LYS  63 -11.749   6.412  -0.873
  441   2HD   LYS  63          2HD       LYS  63 -10.201   5.773  -0.296
  442   1HE   LYS  63          1HE       LYS  63 -11.490   3.900   0.844
  443   2HE   LYS  63          2HE       LYS  63 -12.951   4.505   0.037
  444   1HZ   LYS  63          1HZ       LYS  63 -11.750   4.174  -2.061
  445   2HZ   LYS  63          2HZ       LYS  63 -10.507   3.486  -1.225
  446   3HZ   LYS  63          3HZ       LYS  63 -11.989   2.770  -1.219
  447    H    CYS  64           H        CYS  64  -8.024  10.307   0.275
  448    HA   CYS  64           HA       CYS  64  -7.781  11.406   3.010
  449   1HB   CYS  64          1HB       CYS  64  -5.930  11.117   1.040
  450   2HB   CYS  64          2HB       CYS  64  -6.300  12.824   0.911
  451    H    VAL  65           H        VAL  65  -9.346  12.737   3.671
  452    HA   VAL  65           HA       VAL  65 -10.418  14.828   1.839
  453    HB   VAL  65           HB       VAL  65 -12.762  13.909   2.637
  454   1HG1  VAL  65          1HG1      VAL  65 -12.028  14.116   0.286
  455   2HG1  VAL  65          2HG1      VAL  65 -11.281  12.505   0.386
  456   3HG1  VAL  65          3HG1      VAL  65 -13.030  12.685   0.586
  457   1HG2  VAL  65          1HG2      VAL  65 -11.638  12.040   4.024
  458   2HG2  VAL  65          2HG2      VAL  65 -12.918  11.533   2.886
  459   3HG2  VAL  65          3HG2      VAL  65 -11.225  11.277   2.482
  460    H    SER  66           H        SER  66  -9.406  16.251   3.244
  461    HA   SER  66           HA       SER  66  -9.070  17.536   5.136
  462   1HB   SER  66          1HB       SER  66 -11.220  18.364   4.266
  463   2HB   SER  66          2HB       SER  66 -12.098  17.192   5.260
  464    HG   SER  66           HG       SER  66 -11.940  19.351   6.146
  465    H    ALA  67           H        ALA  67 -10.409  17.644   7.522
  466    HA   ALA  67           HA       ALA  67  -9.701  15.151   9.018
  467   1HB   ALA  67          1HB       ALA  67  -8.982  17.426   9.842
  468   2HB   ALA  67          2HB       ALA  67 -10.689  17.858   9.998
  469   3HB   ALA  67          3HB       ALA  67 -10.017  16.533  10.979
  470    H    GLU  68           H        GLU  68 -12.293  17.166   7.862
  471    HA   GLU  68           HA       GLU  68 -14.328  16.583   9.687
  472   1HB   GLU  68          1HB       GLU  68 -14.471  17.396   6.754
  473   2HB   GLU  68          2HB       GLU  68 -15.767  17.597   7.943
  474   1HG   GLU  68          1HG       GLU  68 -14.498  19.203   9.211
  475   2HG   GLU  68          2HG       GLU  68 -12.991  18.885   8.365
  476    H    ASP  69           H        ASP  69 -13.661  15.074   6.460
  477    HA   ASP  69           HA       ASP  69 -15.768  13.130   6.769
  478   1HB   ASP  69          1HB       ASP  69 -14.791  13.729   4.561
  479   2HB   ASP  69          2HB       ASP  69 -13.288  12.948   5.069
  480    H    CYS  70           H        CYS  70 -12.333  13.242   7.742
  481    HA   CYS  70           HA       CYS  70 -12.085  10.518   8.574
  482   1HB   CYS  70          1HB       CYS  70 -10.047  11.461   8.554
  483   2HB   CYS  70          2HB       CYS  70 -10.605  13.038   9.033
  484    H    GLU  71           H        GLU  71 -13.384  13.393  10.319
  485    HA   GLU  71           HA       GLU  71 -14.010  11.955  12.717
  486   1HB   GLU  71          1HB       GLU  71 -15.403  14.377  11.514
  487   2HB   GLU  71          2HB       GLU  71 -15.660  13.728  13.140
  488   1HG   GLU  71          1HG       GLU  71 -13.347  14.144  13.760
  489   2HG   GLU  71          2HG       GLU  71 -12.974  14.746  12.135
  490    H    LEU  72           H        LEU  72 -16.017  12.556   9.771
  491    HA   LEU  72           HA       LEU  72 -18.357  11.251  10.824
  492   1HB   LEU  72          1HB       LEU  72 -17.453  11.703   7.958
  493   2HB   LEU  72          2HB       LEU  72 -19.054  11.121   8.415
  494    HG   LEU  72           HG       LEU  72 -17.920  13.799   9.347
  495   1HD1  LEU  72          1HD1      LEU  72 -18.095  13.755   6.886
  496   2HD1  LEU  72          2HD1      LEU  72 -19.774  13.188   7.006
  497   3HD1  LEU  72          3HD1      LEU  72 -19.331  14.806   7.594
  498   1HD2  LEU  72          1HD2      LEU  72 -20.757  12.666   9.316
  499   2HD2  LEU  72          2HD2      LEU  72 -19.770  12.968  10.759
  500   3HD2  LEU  72          3HD2      LEU  72 -20.313  14.323   9.772
  501    H    ASP  73           H        ASP  73 -15.972  10.198   8.533
  502    HA   ASP  73           HA       ASP  73 -15.745   8.215   7.418
  503   1HB   ASP  73          1HB       ASP  73 -13.817   8.877   8.713
  504   2HB   ASP  73          2HB       ASP  73 -14.350   7.946  10.108
  505    H    ASN  74           H        ASN  74 -15.772   6.566  10.544
  506    HA   ASN  74           HA       ASN  74 -17.019   4.339   9.154
  507   1HB   ASN  74          1HB       ASN  74 -15.015   4.287  10.752
  508   2HB   ASN  74          2HB       ASN  74 -16.187   4.334  12.065
  509   1HD2  ASN  74          2HD2      ASN  74 -18.023   2.591  11.769
  510   2HD2  ASN  74          1HD2      ASN  74 -17.461   0.998  11.245
  511    H    MET  75           H        MET  75 -18.929   6.145   9.134
  512    HA   MET  75           HA       MET  75 -21.153   6.292   9.283
  513   1HB   MET  75          1HB       MET  75 -21.022   3.654  10.790
  514   2HB   MET  75          2HB       MET  75 -22.461   4.373  10.070
  515   1HG   MET  75          1HG       MET  75 -21.501   4.254   7.843
  516   2HG   MET  75          2HG       MET  75 -19.978   3.617   8.465
  517   1HE   MET  75          1HE       MET  75 -19.594   1.237   9.383
  518   2HE   MET  75          2HE       MET  75 -20.878   1.400  10.608
  519   3HE   MET  75          3HE       MET  75 -20.862  -0.002   9.521
  520    H    ASP  76           H        ASP  76 -20.134   5.067  12.453
  521    HA   ASP  76           HA       ASP  76 -22.009   6.034  14.176
  522   1HB   ASP  76          1HB       ASP  76 -20.191   4.586  14.859
  523   2HB   ASP  76          2HB       ASP  76 -18.987   5.824  14.465
  524    H    PHE  77           H        PHE  77 -19.477   7.962  12.643
  525    HA   PHE  77           HA       PHE  77 -18.934  10.102  12.643
  526   1HB   PHE  77          1HB       PHE  77 -21.287  10.723  12.457
  527   2HB   PHE  77          2HB       PHE  77 -21.459  10.690  14.212
  528    HD1  PHE  77           HD1      PHE  77 -18.257  12.207  13.271
  529    HD2  PHE  77           HD2      PHE  77 -22.503  12.940  13.648
  530    HE1  PHE  77           HE1      PHE  77 -17.822  14.597  13.589
  531    HE2  PHE  77           HE2      PHE  77 -22.039  15.354  13.953
  532    HZ   PHE  77           HZ       PHE  77 -19.694  16.184  13.944
  533    H    ILE  78           H        ILE  78 -17.076   9.973  13.711
  534    HA   ILE  78           HA       ILE  78 -16.891   9.453  16.558
  535    HB   ILE  78           HB       ILE  78 -14.766  10.259  14.518
  536   1HG1  ILE  78          1HG1      ILE  78 -14.151   7.740  14.981
  537   2HG1  ILE  78          2HG1      ILE  78 -15.838   7.557  15.450
  538   1HG2  ILE  78          1HG2      ILE  78 -14.192  10.711  16.924
  539   2HG2  ILE  78          2HG2      ILE  78 -14.526   8.995  17.266
  540   3HG2  ILE  78          3HG2      ILE  78 -13.212   9.460  16.182
  541   1HD1  ILE  78          1HD1      ILE  78 -14.842   8.559  12.736
  542   2HD1  ILE  78          2HD1      ILE  78 -15.277   6.883  13.102
  543   3HD1  ILE  78          3HD1      ILE  78 -16.525   8.126  13.136
  544    H    TYR  79           H        TYR  79 -18.329  11.160  17.158
  545    HA   TYR  79           HA       TYR  79 -18.214  13.821  16.758
  546   1HB   TYR  79          1HB       TYR  79 -18.586  12.695  19.553
  547   2HB   TYR  79          2HB       TYR  79 -19.289  14.157  18.878
  548    HD1  TYR  79           HD1      TYR  79 -20.989  13.896  16.944
  549    HD2  TYR  79           HD2      TYR  79 -19.670  10.616  19.413
  550    HE1  TYR  79           HE1      TYR  79 -22.856  12.495  16.090
  551    HE2  TYR  79           HE2      TYR  79 -21.433   9.167  18.415
  552    HH   TYR  79           HH       TYR  79 -22.692   9.174  16.133
  553    HA   PRO  80           HA       PRO  80 -14.056  14.676  18.487
  554   1HB   PRO  80          1HB       PRO  80 -13.646  17.171  17.536
  555   2HB   PRO  80          2HB       PRO  80 -13.777  15.775  16.431
  556   1HG   PRO  80          1HG       PRO  80 -16.005  17.676  17.238
  557   2HG   PRO  80          2HG       PRO  80 -15.465  17.305  15.579
  558   1HD   PRO  80          1HD       PRO  80 -17.536  15.974  16.721
  559   2HD   PRO  80          2HD       PRO  80 -16.356  15.091  15.702
  560    H    GLY  81           H        GLY  81 -16.119  14.654  20.363
  561   1HA   GLY  81          1HA       GLY  81 -16.627  17.282  21.519
  562   2HA   GLY  81          2HA       GLY  81 -17.110  15.705  22.165
  563    H    THR  82           H        THR  82 -14.587  14.437  22.301
  564    HA   THR  82           HA       THR  82 -13.597  15.509  24.812
  565    HB   THR  82           HB       THR  82 -12.165  13.451  24.650
  566    HG1  THR  82           HG1      THR  82 -12.928  12.115  22.724
  567   1HG2  THR  82          1HG2      THR  82 -14.548  13.299  25.505
  568   2HG2  THR  82          2HG2      THR  82 -15.081  12.872  23.863
  569   3HG2  THR  82          3HG2      THR  82 -13.977  11.807  24.736
  570    H    ARG  83           H        ARG  83 -12.041  14.604  21.729
  571    HA   ARG  83           HA       ARG  83 -10.953  17.230  21.380
  572   1HB   ARG  83          1HB       ARG  83  -9.281  16.182  22.942
  573   2HB   ARG  83          2HB       ARG  83  -9.044  14.889  21.782
  574   1HG   ARG  83          1HG       ARG  83  -7.208  16.340  21.627
  575   2HG   ARG  83          2HG       ARG  83  -8.112  16.612  20.151
  576   1HD   ARG  83          1HD       ARG  83  -8.298  18.378  22.660
  577   2HD   ARG  83          2HD       ARG  83  -7.169  18.649  21.346
  578    HE   ARG  83           HE       ARG  83  -8.875  19.177  19.819
  579   1HH1  ARG  83          1HH1      ARG  83 -10.252  18.802  23.093
  580   2HH1  ARG  83          2HH1      ARG  83 -11.491  19.980  22.807
  581   1HH2  ARG  83          1HH2      ARG  83 -10.562  20.447  19.412
  582   2HH2  ARG  83          2HH2      ARG  83 -11.728  20.913  20.644
  583    H    ASN  84           H        ASN  84 -10.018  17.523  19.282
  584    HA   ASN  84           HA       ASN  84 -11.434  15.905  17.284
  585   1HB   ASN  84          1HB       ASN  84 -10.945  17.787  15.760
  586   2HB   ASN  84          2HB       ASN  84 -11.705  18.339  17.251
  587   1HD2  ASN  84          2HD2      ASN  84  -8.524  18.225  15.485
  588   2HD2  ASN  84          1HD2      ASN  84  -7.867  19.538  16.430
  589    HA   PRO  85           HA       PRO  85  -7.759  13.961  15.525
  590   1HB   PRO  85          1HB       PRO  85  -8.807  15.023  12.889
  591   2HB   PRO  85          2HB       PRO  85  -8.221  13.378  13.263
  592   1HG   PRO  85          1HG       PRO  85 -10.883  13.899  13.081
  593   2HG   PRO  85          2HG       PRO  85 -10.272  12.847  14.383
  594   1HD   PRO  85          1HD       PRO  85 -11.048  15.752  14.556
  595   2HD   PRO  85          2HD       PRO  85 -11.373  14.406  15.692
  Start of MODEL    8
    1   1H    LYS   1          1H        LYS   1   0.049  18.555  -8.005
    2   2H    LYS   1          2H        LYS   1  -0.769  19.309  -6.777
    3   3H    LYS   1          3H        LYS   1  -0.021  17.858  -6.521
    4    HA   LYS   1           HA       LYS   1  -2.309  17.475  -6.684
    5   1HB   LYS   1          1HB       LYS   1  -3.538  18.012  -8.750
    6   2HB   LYS   1          2HB       LYS   1  -2.966  19.450  -7.896
    7   1HG   LYS   1          1HG       LYS   1  -1.093  19.692  -9.492
    8   2HG   LYS   1          2HG       LYS   1  -1.597  18.216 -10.338
    9   1HD   LYS   1          1HD       LYS   1  -3.783  19.272 -10.870
   10   2HD   LYS   1          2HD       LYS   1  -3.260  20.757 -10.047
   11   1HE   LYS   1          1HE       LYS   1  -1.362  20.972 -11.647
   12   2HE   LYS   1          2HE       LYS   1  -1.878  19.483 -12.462
   13   1HZ   LYS   1          1HZ       LYS   1  -3.455  21.950 -12.249
   14   2HZ   LYS   1          2HZ       LYS   1  -2.652  21.425 -13.588
   15   3HZ   LYS   1          3HZ       LYS   1  -3.933  20.568 -13.007
   16    H    ALA   2           H        ALA   2  -3.012  15.525  -7.457
   17    HA   ALA   2           HA       ALA   2  -1.752  13.432  -7.778
   18   1HB   ALA   2          1HB       ALA   2  -4.062  14.133  -9.628
   19   2HB   ALA   2          2HB       ALA   2  -3.471  12.480  -9.390
   20   3HB   ALA   2          3HB       ALA   2  -4.131  13.394  -8.019
   21    H    THR   3           H        THR   3  -2.534  14.659 -11.034
   22    HA   THR   3           HA       THR   3  -1.504  14.594 -12.999
   23    HB   THR   3           HB       THR   3   1.148  14.515 -11.494
   24    HG1  THR   3           HG1      THR   3  -0.031  16.210 -10.726
   25   1HG2  THR   3          1HG2      THR   3   0.360  15.601 -14.233
   26   2HG2  THR   3          2HG2      THR   3   1.951  15.754 -13.465
   27   3HG2  THR   3          3HG2      THR   3   1.352  14.155 -13.941
   28    H    MET   4           H        MET   4   0.555  12.333 -11.064
   29    HA   MET   4           HA       MET   4   0.734  10.529 -13.388
   30   1HB   MET   4          1HB       MET   4   1.953  10.383 -10.606
   31   2HB   MET   4          2HB       MET   4   2.288   9.272 -11.950
   32   1HG   MET   4          1HG       MET   4   2.999  11.257 -13.332
   33   2HG   MET   4          2HG       MET   4   2.889  12.258 -11.880
   34   1HE   MET   4          1HE       MET   4   4.475  11.971  -9.779
   35   2HE   MET   4          2HE       MET   4   4.107  10.231  -9.638
   36   3HE   MET   4          3HE       MET   4   5.796  10.783  -9.699
   37    H    GLN   5           H        GLN   5  -1.711  10.448 -13.187
   38    HA   GLN   5           HA       GLN   5  -3.571   9.268 -12.962
   39   1HB   GLN   5          1HB       GLN   5  -2.068   7.328 -13.582
   40   2HB   GLN   5          2HB       GLN   5  -1.940   6.946 -11.862
   41   1HG   GLN   5          1HG       GLN   5  -4.643   7.117 -12.022
   42   2HG   GLN   5          2HG       GLN   5  -4.301   6.778 -13.716
   43   1HE2  GLN   5          2HE2      GLN   5  -4.159   5.556 -10.366
   44   2HE2  GLN   5          1HE2      GLN   5  -3.828   3.889 -10.818
   45    H    CYS   6           H        CYS   6  -1.719   8.138 -10.060
   46    HA   CYS   6           HA       CYS   6  -2.422   7.780  -7.952
   47   1HB   CYS   6          1HB       CYS   6  -3.813  10.483  -8.187
   48   2HB   CYS   6          2HB       CYS   6  -3.118   9.692  -6.768
   49    H    GLY   7           H        GLY   7  -5.340   9.287  -7.378
   50   1HA   GLY   7          1HA       GLY   7  -7.165   7.623  -8.808
   51   2HA   GLY   7          2HA       GLY   7  -6.867   6.937  -7.198
   52    H    GLU   8           H        GLU   8  -6.864   8.733  -5.405
   53    HA   GLU   8           HA       GLU   8  -9.425  10.205  -5.577
   54   1HB   GLU   8          1HB       GLU   8  -7.415  10.009  -3.281
   55   2HB   GLU   8          2HB       GLU   8  -9.068  10.613  -3.190
   56   1HG   GLU   8          1HG       GLU   8  -8.232   7.740  -3.819
   57   2HG   GLU   8          2HG       GLU   8  -8.867   8.334  -2.293
   58    H    ASN   9           H        ASN   9  -9.018  12.504  -4.233
   59    HA   ASN   9           HA       ASN   9  -7.441  14.196  -5.988
   60   1HB   ASN   9          1HB       ASN   9  -9.457  15.074  -4.936
   61   2HB   ASN   9          2HB       ASN   9  -8.792  14.754  -3.321
   62   1HD2  ASN   9          2HD2      ASN   9  -8.928  17.045  -2.746
   63   2HD2  ASN   9          1HD2      ASN   9  -7.744  18.163  -3.427
   64    H    GLU  10           H        GLU  10  -5.489  12.880  -5.740
   65    HA   GLU  10           HA       GLU  10  -3.972  13.215  -3.202
   66   1HB   GLU  10          1HB       GLU  10  -3.600  11.469  -5.632
   67   2HB   GLU  10          2HB       GLU  10  -2.585  11.394  -4.180
   68   1HG   GLU  10          1HG       GLU  10  -4.489  10.707  -2.813
   69   2HG   GLU  10          2HG       GLU  10  -5.566  10.853  -4.195
   70    H    LYS  11           H        LYS  11  -1.484  13.173  -3.743
   71    HA   LYS  11           HA       LYS  11  -0.608  14.683  -6.063
   72   1HB   LYS  11          1HB       LYS  11   0.566  16.381  -4.708
   73   2HB   LYS  11          2HB       LYS  11  -1.194  16.465  -4.587
   74   1HG   LYS  11          1HG       LYS  11  -0.549  16.828  -2.404
   75   2HG   LYS  11          2HG       LYS  11  -0.959  15.110  -2.390
   76   1HD   LYS  11          1HD       LYS  11   1.561  14.635  -2.576
   77   2HD   LYS  11          2HD       LYS  11   1.823  16.374  -2.474
   78   1HE   LYS  11          1HE       LYS  11   2.140  15.297  -0.311
   79   2HE   LYS  11          2HE       LYS  11   0.739  16.372  -0.222
   80   1HZ   LYS  11          1HZ       LYS  11   0.547  13.486  -0.734
   81   2HZ   LYS  11          2HZ       LYS  11   0.472  14.129   0.776
   82   3HZ   LYS  11          3HZ       LYS  11  -0.687  14.496  -0.331
   83    H    TYR  12           H        TYR  12   1.755  14.481  -6.277
   84    HA   TYR  12           HA       TYR  12   2.670  11.889  -5.430
   85   1HB   TYR  12          1HB       TYR  12   3.313  12.880  -7.557
   86   2HB   TYR  12          2HB       TYR  12   4.148  14.189  -6.721
   87    HD1  TYR  12           HD1      TYR  12   4.067  10.409  -6.851
   88    HD2  TYR  12           HD2      TYR  12   6.472  13.951  -6.326
   89    HE1  TYR  12           HE1      TYR  12   6.119   9.045  -7.049
   90    HE2  TYR  12           HE2      TYR  12   8.526  12.577  -6.526
   91    HH   TYR  12           HH       TYR  12   8.440   9.094  -7.311
   92    H    ASP  13           H        ASP  13   3.413  11.409  -3.421
   93    HA   ASP  13           HA       ASP  13   4.703  13.522  -1.756
   94   1HB   ASP  13          1HB       ASP  13   2.723  12.441  -0.739
   95   2HB   ASP  13          2HB       ASP  13   3.442  10.848  -1.042
   96    H    SER  14           H        SER  14   6.906  13.280  -1.464
   97    HA   SER  14           HA       SER  14   8.321  11.124  -2.776
   98   1HB   SER  14          1HB       SER  14   9.405  13.202  -0.841
   99   2HB   SER  14          2HB       SER  14  10.277  12.343  -2.121
  100    HG   SER  14           HG       SER  14   8.752  13.408  -3.602
  101    H    CYS  15           H        CYS  15   6.613   9.888  -0.948
  102    HA   CYS  15           HA       CYS  15   8.425   8.324   0.613
  103   1HB   CYS  15          1HB       CYS  15   6.295   9.998   1.978
  104   2HB   CYS  15          2HB       CYS  15   6.858   8.478   2.622
  105    H    GLY  16           H        GLY  16   6.966   6.408   1.572
  106   1HA   GLY  16          1HA       GLY  16   5.624   5.472  -0.792
  107   2HA   GLY  16          2HA       GLY  16   6.040   4.590   0.668
  108    H    SER  17           H        SER  17   4.161   3.480   0.613
  109    HA   SER  17           HA       SER  17   1.689   4.005   0.034
  110   1HB   SER  17          1HB       SER  17   2.488   2.147   2.285
  111   2HB   SER  17          2HB       SER  17   1.247   1.910   1.037
  112    HG   SER  17           HG       SER  17   3.207   0.809   0.517
  113    H    LYS  18           H        LYS  18   1.664   6.337   1.183
  114    HA   LYS  18           HA       LYS  18   0.252   7.695   2.239
  115   1HB   LYS  18          1HB       LYS  18  -1.374   5.527   3.551
  116   2HB   LYS  18          2HB       LYS  18  -1.851   7.095   2.916
  117   1HG   LYS  18          1HG       LYS  18  -1.235   4.567   1.332
  118   2HG   LYS  18          2HG       LYS  18  -2.802   5.289   1.676
  119   1HD   LYS  18          1HD       LYS  18  -2.176   7.301   0.355
  120   2HD   LYS  18          2HD       LYS  18  -0.620   6.551  -0.035
  121   1HE   LYS  18          1HE       LYS  18  -1.616   4.788  -1.280
  122   2HE   LYS  18          2HE       LYS  18  -3.248   5.189  -0.727
  123   1HZ   LYS  18          1HZ       LYS  18  -1.573   6.915  -2.412
  124   2HZ   LYS  18          2HZ       LYS  18  -2.817   5.972  -2.937
  125   3HZ   LYS  18          3HZ       LYS  18  -3.111   7.237  -1.925
  126    H    GLU  19           H        GLU  19   0.448   4.956   4.482
  127    HA   GLU  19           HA       GLU  19   0.403   5.020   6.784
  128   1HB   GLU  19          1HB       GLU  19   3.215   5.687   5.824
  129   2HB   GLU  19          2HB       GLU  19   2.879   5.280   7.510
  130   1HG   GLU  19          1HG       GLU  19   2.332   3.494   5.105
  131   2HG   GLU  19          2HG       GLU  19   3.634   3.321   6.292
  132    H    CYS  20           H        CYS  20   2.820   7.528   6.893
  133    HA   CYS  20           HA       CYS  20   1.187   8.787   8.982
  134   1HB   CYS  20          1HB       CYS  20   3.721   8.089   8.981
  135   2HB   CYS  20          2HB       CYS  20   3.940   9.735   8.339
  136    H    ASP  21           H        ASP  21   1.778   9.374   5.616
  137    HA   ASP  21           HA       ASP  21   1.973  12.262   5.833
  138   1HB   ASP  21          1HB       ASP  21   3.036  11.112   3.960
  139   2HB   ASP  21          2HB       ASP  21   1.467  10.533   3.399
  140    H    LYS  22           H        LYS  22   0.321  13.596   6.150
  141    HA   LYS  22           HA       LYS  22  -1.761  14.235   6.784
  142   1HB   LYS  22          1HB       LYS  22  -2.543  12.981   4.117
  143   2HB   LYS  22          2HB       LYS  22  -3.456  14.205   4.990
  144   1HG   LYS  22          1HG       LYS  22  -0.695  14.531   3.732
  145   2HG   LYS  22          2HG       LYS  22  -2.215  15.176   3.134
  146   1HD   LYS  22          1HD       LYS  22  -0.806  15.989   5.735
  147   2HD   LYS  22          2HD       LYS  22  -0.890  16.921   4.250
  148   1HE   LYS  22          1HE       LYS  22  -3.438  16.909   4.476
  149   2HE   LYS  22          2HE       LYS  22  -3.234  16.195   6.077
  150   1HZ   LYS  22          1HZ       LYS  22  -1.956  18.113   6.701
  151   2HZ   LYS  22          2HZ       LYS  22  -2.175  18.789   5.212
  152   3HZ   LYS  22          3HZ       LYS  22  -3.469  18.533   6.200
  153    H    LYS  23           H        LYS  23  -1.024  11.927   8.038
  154    HA   LYS  23           HA       LYS  23  -2.844   9.845   7.990
  155   1HB   LYS  23          1HB       LYS  23  -2.131   9.273  10.155
  156   2HB   LYS  23          2HB       LYS  23  -0.740   9.902   9.287
  157   1HG   LYS  23          1HG       LYS  23  -2.361  11.249  11.487
  158   2HG   LYS  23          2HG       LYS  23  -0.744  10.576  11.607
  159   1HD   LYS  23          1HD       LYS  23   0.028  12.317   9.905
  160   2HD   LYS  23          2HD       LYS  23  -1.561  13.084  10.097
  161   1HE   LYS  23          1HE       LYS  23   0.615  12.682  12.196
  162   2HE   LYS  23          2HE       LYS  23  -0.026  14.212  11.556
  163   1HZ   LYS  23          1HZ       LYS  23  -2.179  13.463  12.542
  164   2HZ   LYS  23          2HZ       LYS  23  -1.327  12.283  13.322
  165   3HZ   LYS  23          3HZ       LYS  23  -1.009  13.869  13.628
  166    H    CYS  24           H        CYS  24  -4.887   9.431   8.856
  167    HA   CYS  24           HA       CYS  24  -6.433  11.752   9.800
  168   1HB   CYS  24          1HB       CYS  24  -7.727  10.358   8.462
  169   2HB   CYS  24          2HB       CYS  24  -7.177   8.891   9.282
  170    H    LYS  25           H        LYS  25  -6.834  12.231  11.806
  171    HA   LYS  25           HA       LYS  25  -5.068  11.562  13.800
  172   1HB   LYS  25          1HB       LYS  25  -7.743  12.992  14.090
  173   2HB   LYS  25          2HB       LYS  25  -6.333  13.147  15.135
  174   1HG   LYS  25          1HG       LYS  25  -6.770  14.237  12.351
  175   2HG   LYS  25          2HG       LYS  25  -6.221  15.040  13.817
  176   1HD   LYS  25          1HD       LYS  25  -4.072  13.623  13.633
  177   2HD   LYS  25          2HD       LYS  25  -4.638  13.124  12.032
  178   1HE   LYS  25          1HE       LYS  25  -3.197  14.958  11.605
  179   2HE   LYS  25          2HE       LYS  25  -4.825  15.617  11.441
  180   1HZ   LYS  25          1HZ       LYS  25  -3.119  15.813  13.837
  181   2HZ   LYS  25          2HZ       LYS  25  -3.377  17.020  12.743
  182   3HZ   LYS  25          3HZ       LYS  25  -4.619  16.473  13.675
  183    H    TYR  26           H        TYR  26  -5.328   9.189  13.824
  184    HA   TYR  26           HA       TYR  26  -7.330   8.195  15.741
  185   1HB   TYR  26          1HB       TYR  26  -4.709   6.924  14.970
  186   2HB   TYR  26          2HB       TYR  26  -6.160   6.114  15.579
  187    HD1  TYR  26           HD1      TYR  26  -8.165   7.583  13.751
  188    HD2  TYR  26           HD2      TYR  26  -4.415   5.615  12.974
  189    HE1  TYR  26           HE1      TYR  26  -8.736   7.472  11.397
  190    HE2  TYR  26           HE2      TYR  26  -5.055   5.335  10.623
  191    HH   TYR  26           HH       TYR  26  -8.183   6.522   9.335
  192    H    ASP  27           H        ASP  27  -4.314   9.841  15.893
  193    HA   ASP  27           HA       ASP  27  -2.836  10.320  17.556
  194   1HB   ASP  27          1HB       ASP  27  -5.573  11.060  18.634
  195   2HB   ASP  27          2HB       ASP  27  -4.058  11.559  19.404
  196    H    GLY  28           H        GLY  28  -4.995   9.642  20.237
  197   1HA   GLY  28          1HA       GLY  28  -2.843   8.311  21.554
  198   2HA   GLY  28          2HA       GLY  28  -4.515   8.379  22.115
  199    H    VAL  29           H        VAL  29  -5.273   7.008  19.385
  200    HA   VAL  29           HA       VAL  29  -5.281   4.326  20.401
  201    HB   VAL  29           HB       VAL  29  -5.669   5.392  17.592
  202   1HG1  VAL  29          1HG1      VAL  29  -6.385   2.678  18.777
  203   2HG1  VAL  29          2HG1      VAL  29  -6.926   3.275  17.196
  204   3HG1  VAL  29          3HG1      VAL  29  -5.207   2.986  17.482
  205   1HG2  VAL  29          1HG2      VAL  29  -7.322   6.304  19.248
  206   2HG2  VAL  29          2HG2      VAL  29  -8.072   5.202  18.093
  207   3HG2  VAL  29          3HG2      VAL  29  -7.709   4.646  19.740
  208    H    GLU  30           H        GLU  30  -2.985   6.121  18.284
  209    HA   GLU  30           HA       GLU  30  -1.094   3.854  18.460
  210   1HB   GLU  30          1HB       GLU  30  -0.906   3.817  15.900
  211   2HB   GLU  30          2HB       GLU  30  -2.283   3.029  16.661
  212   1HG   GLU  30          1HG       GLU  30  -3.061   4.136  14.731
  213   2HG   GLU  30          2HG       GLU  30  -3.728   4.989  16.113
  214    H    GLU  31           H        GLU  31  -1.321   6.885  19.087
  215    HA   GLU  31           HA       GLU  31   0.160   8.440  19.566
  216   1HB   GLU  31          1HB       GLU  31   2.321   6.434  18.817
  217   2HB   GLU  31          2HB       GLU  31   2.472   7.813  19.903
  218   1HG   GLU  31          1HG       GLU  31   0.789   5.317  20.407
  219   2HG   GLU  31          2HG       GLU  31   2.292   5.769  21.201
  220    H    GLU  32           H        GLU  32  -0.494   7.808  16.489
  221    HA   GLU  32           HA       GLU  32   1.795   9.119  15.239
  222   1HB   GLU  32          1HB       GLU  32   0.439   7.122  14.353
  223   2HB   GLU  32          2HB       GLU  32  -0.764   8.335  13.853
  224   1HG   GLU  32          1HG       GLU  32   1.031   9.476  12.538
  225   2HG   GLU  32          2HG       GLU  32   2.183   8.242  13.066
  226    H    ASP  33           H        ASP  33   1.088  10.924  16.918
  227    HA   ASP  33           HA       ASP  33   0.468  13.104  15.178
  228   1HB   ASP  33          1HB       ASP  33  -1.857  12.484  15.704
  229   2HB   ASP  33          2HB       ASP  33  -1.549  12.704  17.425
  230    H    ASP  34           H        ASP  34   0.083  12.886  18.807
  231    HA   ASP  34           HA       ASP  34   1.813  15.113  19.172
  232   1HB   ASP  34          1HB       ASP  34   0.270  14.471  20.907
  233   2HB   ASP  34          2HB       ASP  34   1.036  12.876  21.058
  234    H    GLU  35           H        GLU  35   2.511  11.594  19.594
  235    HA   GLU  35           HA       GLU  35   5.301  12.069  20.141
  236   1HB   GLU  35          1HB       GLU  35   3.895   9.486  19.333
  237   2HB   GLU  35          2HB       GLU  35   5.538   9.651  19.931
  238   1HG   GLU  35          1HG       GLU  35   4.287   8.957  21.800
  239   2HG   GLU  35          2HG       GLU  35   4.626  10.670  22.062
  240    H    GLU  36           H        GLU  36   3.596  10.632  17.300
  241    HA   GLU  36           HA       GLU  36   5.993  11.331  15.615
  242   1HB   GLU  36          1HB       GLU  36   3.966   9.157  15.080
  243   2HB   GLU  36          2HB       GLU  36   5.493   9.466  14.260
  244   1HG   GLU  36          1HG       GLU  36   5.095   8.488  17.124
  245   2HG   GLU  36          2HG       GLU  36   5.722   7.570  15.755
  246    HA   PRO  37           HA       PRO  37   2.590  13.869  13.801
  247   1HB   PRO  37          1HB       PRO  37   3.920  16.261  13.598
  248   2HB   PRO  37          2HB       PRO  37   3.031  15.755  15.058
  249   1HG   PRO  37          1HG       PRO  37   5.989  15.579  14.533
  250   2HG   PRO  37          2HG       PRO  37   5.169  16.120  16.020
  251   1HD   PRO  37          1HD       PRO  37   6.188  13.588  15.717
  252   2HD   PRO  37          2HD       PRO  37   4.731  13.928  16.690
  253    H    ASN  38           H        ASN  38   2.499  14.393  11.637
  254    HA   ASN  38           HA       ASN  38   3.546  12.806   9.824
  255   1HB   ASN  38          1HB       ASN  38   1.735  14.504   9.532
  256   2HB   ASN  38          2HB       ASN  38   2.963  15.730   9.218
  257   1HD2  ASN  38          2HD2      ASN  38   4.612  13.553   7.508
  258   2HD2  ASN  38          1HD2      ASN  38   3.673  13.622   6.035
  259    H    VAL  39           H        VAL  39   5.094  16.001  10.488
  260    HA   VAL  39           HA       VAL  39   6.915  15.775   8.341
  261    HB   VAL  39           HB       VAL  39   6.996  17.587  10.774
  262   1HG1  VAL  39          1HG1      VAL  39   8.649  17.655   8.208
  263   2HG1  VAL  39          2HG1      VAL  39   8.565  18.954   9.416
  264   3HG1  VAL  39          3HG1      VAL  39   9.285  17.399   9.848
  265   1HG2  VAL  39          1HG2      VAL  39   6.117  18.009   7.894
  266   2HG2  VAL  39          2HG2      VAL  39   5.045  17.895   9.304
  267   3HG2  VAL  39          3HG2      VAL  39   6.176  19.246   9.165
  268    HA   PRO  40           HA       PRO  40  10.442  14.226  11.108
  269   1HB   PRO  40          1HB       PRO  40  10.043  13.522  13.730
  270   2HB   PRO  40          2HB       PRO  40  10.492  15.170  13.207
  271   1HG   PRO  40          1HG       PRO  40   7.712  14.113  13.775
  272   2HG   PRO  40          2HG       PRO  40   8.468  15.600  14.426
  273   1HD   PRO  40          1HD       PRO  40   6.838  15.760  12.283
  274   2HD   PRO  40          2HD       PRO  40   8.372  16.673  12.304
  275    H    CYS  41           H        CYS  41   7.170  12.908  11.862
  276    HA   CYS  41           HA       CYS  41   7.809  10.182  12.123
  277   1HB   CYS  41          1HB       CYS  41   5.553  11.173  12.435
  278   2HB   CYS  41          2HB       CYS  41   5.461  11.472  10.691
  279    H    LEU  42           H        LEU  42   7.248  12.142   9.185
  280    HA   LEU  42           HA       LEU  42   7.719  11.848   7.032
  281   1HB   LEU  42          1HB       LEU  42   9.939  12.133   8.264
  282   2HB   LEU  42          2HB       LEU  42  10.174  10.396   8.094
  283    HG   LEU  42           HG       LEU  42  10.152  10.679   5.588
  284   1HD1  LEU  42          1HD1      LEU  42   9.940  13.643   6.282
  285   2HD1  LEU  42          2HD1      LEU  42  10.419  13.005   4.695
  286   3HD1  LEU  42          3HD1      LEU  42   8.795  12.695   5.304
  287   1HD2  LEU  42          1HD2      LEU  42  12.252  10.694   6.875
  288   2HD2  LEU  42          2HD2      LEU  42  12.346  11.755   5.459
  289   3HD2  LEU  42          3HD2      LEU  42  12.120  12.455   7.078
  290    H    VAL  43           H        VAL  43   5.943   9.911   7.863
  291    HA   VAL  43           HA       VAL  43   4.812   8.192   6.949
  292    HB   VAL  43           HB       VAL  43   6.769   8.175   4.672
  293   1HG1  VAL  43          1HG1      VAL  43   3.797   7.604   4.816
  294   2HG1  VAL  43          2HG1      VAL  43   4.744   7.668   3.330
  295   3HG1  VAL  43          3HG1      VAL  43   5.090   6.413   4.511
  296   1HG2  VAL  43          1HG2      VAL  43   4.511  10.098   5.438
  297   2HG2  VAL  43          2HG2      VAL  43   6.160  10.531   4.947
  298   3HG2  VAL  43          3HG2      VAL  43   5.014   9.916   3.758
  299    H    ARG  44           H        ARG  44   8.180   7.572   7.549
  300    HA   ARG  44           HA       ARG  44   9.260   5.812   8.382
  301   1HB   ARG  44          1HB       ARG  44   6.585   4.367   8.542
  302   2HB   ARG  44          2HB       ARG  44   8.114   3.796   9.202
  303   1HG   ARG  44          1HG       ARG  44   8.285   5.647  10.713
  304   2HG   ARG  44          2HG       ARG  44   6.911   6.493   9.998
  305   1HD   ARG  44          1HD       ARG  44   6.595   3.750  11.297
  306   2HD   ARG  44          2HD       ARG  44   6.535   5.256  12.200
  307    HE   ARG  44           HE       ARG  44   4.558   5.909  11.256
  308   1HH1  ARG  44          1HH1      ARG  44   5.536   2.835   9.744
  309   2HH1  ARG  44          2HH1      ARG  44   3.919   2.523   9.139
  310   1HH2  ARG  44          1HH2      ARG  44   2.464   5.397  10.508
  311   2HH2  ARG  44          2HH2      ARG  44   2.230   3.940   9.556
  312    H    VAL  45           H        VAL  45   6.768   4.447   6.184
  313    HA   VAL  45           HA       VAL  45   8.818   2.955   4.680
  314    HB   VAL  45           HB       VAL  45   6.629   1.993   5.133
  315   1HG1  VAL  45          1HG1      VAL  45   5.223   4.081   4.892
  316   2HG1  VAL  45          2HG1      VAL  45   5.359   3.912   3.138
  317   3HG1  VAL  45          3HG1      VAL  45   4.599   2.635   4.083
  318   1HG2  VAL  45          1HG2      VAL  45   7.966   1.242   3.200
  319   2HG2  VAL  45          2HG2      VAL  45   6.222   1.035   2.961
  320   3HG2  VAL  45          3HG2      VAL  45   7.065   2.367   2.158
  321    H    CYS  46           H        CYS  46   9.872   5.314   4.560
  322    HA   CYS  46           HA       CYS  46   8.536   7.064   2.684
  323   1HB   CYS  46          1HB       CYS  46   9.839   7.949   4.577
  324   2HB   CYS  46          2HB       CYS  46  11.310   7.407   3.755
  325    H    HIS  47           H        HIS  47   8.451   5.363   0.921
  326    HA   HIS  47           HA       HIS  47  10.635   6.061  -0.988
  327   1HB   HIS  47          1HB       HIS  47  10.694   3.782  -1.839
  328   2HB   HIS  47          2HB       HIS  47  11.251   3.917  -0.174
  329    HD1  HIS  47           HD1      HIS  47   7.802   3.121  -1.753
  330    HD2  HIS  47           HD2      HIS  47  10.563   1.749   1.095
  331    HE1  HIS  47           HE1      HIS  47   6.824   0.987  -0.796
  332    H    GLN  48           H        GLN  48   8.992   7.656  -1.455
  333    HA   GLN  48           HA       GLN  48   7.406   8.601  -2.685
  334   1HB   GLN  48          1HB       GLN  48   7.986   8.617  -4.911
  335   2HB   GLN  48          2HB       GLN  48   9.443   8.271  -3.993
  336   1HG   GLN  48          1HG       GLN  48   9.797   6.641  -5.499
  337   2HG   GLN  48          2HG       GLN  48   8.600   5.687  -4.633
  338   1HE2  GLN  48          2HE2      GLN  48   6.460   5.515  -5.574
  339   2HE2  GLN  48          1HE2      GLN  48   6.177   5.946  -7.263
  340    H    ASP  49           H        ASP  49   5.264   8.699  -3.005
  341    HA   ASP  49           HA       ASP  49   3.868   6.749  -4.641
  342   1HB   ASP  49          1HB       ASP  49   3.936   5.510  -2.476
  343   2HB   ASP  49          2HB       ASP  49   3.306   6.949  -1.646
  344    H    CYS  50           H        CYS  50   1.545   7.502  -4.929
  345    HA   CYS  50           HA       CYS  50   1.342  10.425  -4.521
  346   1HB   CYS  50          1HB       CYS  50   0.743   9.229  -6.689
  347   2HB   CYS  50          2HB       CYS  50  -0.701   8.641  -5.843
  348    H    VAL  51           H        VAL  51  -0.050  11.327  -2.972
  349    HA   VAL  51           HA       VAL  51  -1.706   9.508  -1.309
  350    HB   VAL  51           HB       VAL  51   0.379  11.429  -0.176
  351   1HG1  VAL  51          1HG1      VAL  51  -1.549   9.457   1.123
  352   2HG1  VAL  51          2HG1      VAL  51  -0.186  10.189   1.971
  353   3HG1  VAL  51          3HG1      VAL  51  -1.473  11.218   1.363
  354   1HG2  VAL  51          1HG2      VAL  51   0.492   8.398  -0.303
  355   2HG2  VAL  51          2HG2      VAL  51   1.581   9.519  -1.125
  356   3HG2  VAL  51          3HG2      VAL  51   1.588   9.427   0.635
  357    H    CYS  52           H        CYS  52  -3.321  10.656  -0.119
  358    HA   CYS  52           HA       CYS  52  -4.880  12.578  -1.178
  359   1HB   CYS  52          1HB       CYS  52  -5.592  11.438   0.696
  360   2HB   CYS  52          2HB       CYS  52  -4.221  11.974   1.688
  361    H    GLU  53           H        GLU  53  -4.893  14.618  -1.720
  362    HA   GLU  53           HA       GLU  53  -2.749  16.349  -1.677
  363   1HB   GLU  53          1HB       GLU  53  -4.711  16.544  -3.120
  364   2HB   GLU  53          2HB       GLU  53  -5.716  17.009  -1.737
  365   1HG   GLU  53          1HG       GLU  53  -4.419  19.084  -1.470
  366   2HG   GLU  53          2HG       GLU  53  -3.261  18.550  -2.704
  367    H    GLU  54           H        GLU  54  -1.912  17.758  -0.332
  368    HA   GLU  54           HA       GLU  54  -2.198  17.403   2.418
  369   1HB   GLU  54          1HB       GLU  54  -0.466  19.187   2.594
  370   2HB   GLU  54          2HB       GLU  54  -0.078  17.835   1.531
  371   1HG   GLU  54          1HG       GLU  54  -0.698  19.288  -0.464
  372   2HG   GLU  54          2HG       GLU  54  -0.941  20.630   0.660
  373    H    GLY  55           H        GLY  55  -4.484  17.816   2.534
  374   1HA   GLY  55          1HA       GLY  55  -4.986  20.294   3.994
  375   2HA   GLY  55          2HA       GLY  55  -5.882  20.170   2.464
  376    H    PHE  56           H        PHE  56  -6.311  17.367   2.357
  377    HA   PHE  56           HA       PHE  56  -8.333  17.038   4.518
  378   1HB   PHE  56          1HB       PHE  56  -8.072  15.275   2.124
  379   2HB   PHE  56          2HB       PHE  56  -9.465  15.630   3.081
  380    HD1  PHE  56           HD1      PHE  56  -7.174  17.089   0.498
  381    HD2  PHE  56           HD2      PHE  56 -11.041  17.277   2.401
  382    HE1  PHE  56           HE1      PHE  56  -7.917  18.710  -1.180
  383    HE2  PHE  56           HE2      PHE  56 -11.812  18.850   0.659
  384    HZ   PHE  56           HZ       PHE  56 -10.250  19.598  -1.131
  385    H    TYR  57           H        TYR  57  -8.420  14.163   4.514
  386    HA   TYR  57           HA       TYR  57  -5.647  13.470   5.432
  387   1HB   TYR  57          1HB       TYR  57  -8.256  12.772   6.808
  388   2HB   TYR  57          2HB       TYR  57  -6.625  12.333   7.327
  389    HD1  TYR  57           HD1      TYR  57  -5.008  14.114   8.061
  390    HD2  TYR  57           HD2      TYR  57  -9.113  15.029   7.144
  391    HE1  TYR  57           HE1      TYR  57  -4.538  16.524   8.355
  392    HE2  TYR  57           HE2      TYR  57  -8.602  17.449   7.289
  393    HH   TYR  57           HH       TYR  57  -6.584  18.822   6.845
  394    H    ARG  58           H        ARG  58  -5.043  11.289   5.370
  395    HA   ARG  58           HA       ARG  58  -6.157   9.845   3.102
  396   1HB   ARG  58          1HB       ARG  58  -4.390   8.213   3.542
  397   2HB   ARG  58          2HB       ARG  58  -3.768   9.858   3.498
  398   1HG   ARG  58          1HG       ARG  58  -2.824   9.567   5.491
  399   2HG   ARG  58          2HG       ARG  58  -4.406   9.327   6.230
  400   1HD   ARG  58          1HD       ARG  58  -4.145   6.826   5.455
  401   2HD   ARG  58          2HD       ARG  58  -2.471   7.271   5.128
  402    HE   ARG  58           HE       ARG  58  -1.989   7.330   7.344
  403   1HH1  ARG  58          1HH1      ARG  58  -5.515   7.352   6.961
  404   2HH1  ARG  58          2HH1      ARG  58  -5.844   6.944   8.627
  405   1HH2  ARG  58          1HH2      ARG  58  -2.382   7.108   9.546
  406   2HH2  ARG  58          2HH2      ARG  58  -4.002   7.100  10.189
  407    H    ASN  59           H        ASN  59  -8.368   9.919   4.214
  408    HA   ASN  59           HA       ASN  59  -8.867   8.352   6.556
  409   1HB   ASN  59          1HB       ASN  59 -10.821   9.013   4.314
  410   2HB   ASN  59          2HB       ASN  59 -11.231   8.367   5.891
  411   1HD2  ASN  59          2HD2      ASN  59  -9.633  11.176   4.310
  412   2HD2  ASN  59          1HD2      ASN  59 -10.210  12.361   5.470
  413    H    LYS  60           H        LYS  60  -8.592   6.223   6.724
  414    HA   LYS  60           HA       LYS  60  -8.149   4.105   6.265
  415   1HB   LYS  60          1HB       LYS  60 -10.093   2.804   5.426
  416   2HB   LYS  60          2HB       LYS  60 -10.363   3.885   6.791
  417   1HG   LYS  60          1HG       LYS  60 -11.424   5.548   5.257
  418   2HG   LYS  60          2HG       LYS  60 -11.288   4.384   3.924
  419   1HD   LYS  60          1HD       LYS  60 -12.634   2.754   5.179
  420   2HD   LYS  60          2HD       LYS  60 -12.736   3.860   6.559
  421   1HE   LYS  60          1HE       LYS  60 -13.839   4.443   3.767
  422   2HE   LYS  60          2HE       LYS  60 -14.787   3.884   5.155
  423   1HZ   LYS  60          1HZ       LYS  60 -14.126   5.866   6.328
  424   2HZ   LYS  60          2HZ       LYS  60 -13.310   6.414   5.007
  425   3HZ   LYS  60          3HZ       LYS  60 -14.944   6.223   4.943
  426    H    ASP  61           H        ASP  61  -9.555   5.017   3.103
  427    HA   ASP  61           HA       ASP  61  -7.465   3.288   1.806
  428   1HB   ASP  61          1HB       ASP  61  -9.731   2.326   1.575
  429   2HB   ASP  61          2HB       ASP  61 -10.304   3.834   0.847
  430    H    ASP  62           H        ASP  62  -6.707   5.631   2.544
  431    HA   ASP  62           HA       ASP  62  -6.138   7.766   2.130
  432   1HB   ASP  62          1HB       ASP  62  -4.656   6.437   0.656
  433   2HB   ASP  62          2HB       ASP  62  -5.774   6.694  -0.693
  434    H    LYS  63           H        LYS  63  -8.955   7.498   2.122
  435    HA   LYS  63           HA       LYS  63 -10.011   8.916  -0.204
  436   1HB   LYS  63          1HB       LYS  63 -11.278   8.114   2.432
  437   2HB   LYS  63          2HB       LYS  63 -12.142   8.883   1.104
  438   1HG   LYS  63          1HG       LYS  63 -10.593   6.282   0.772
  439   2HG   LYS  63          2HG       LYS  63 -12.262   6.313   1.330
  440   1HD   LYS  63          1HD       LYS  63 -13.072   7.278  -0.688
  441   2HD   LYS  63          2HD       LYS  63 -11.452   7.665  -1.279
  442   1HE   LYS  63          1HE       LYS  63 -12.299   4.796  -0.753
  443   2HE   LYS  63          2HE       LYS  63 -12.596   5.603  -2.302
  444   1HZ   LYS  63          1HZ       LYS  63  -9.919   5.424  -1.116
  445   2HZ   LYS  63          2HZ       LYS  63 -10.527   4.331  -2.184
  446   3HZ   LYS  63          3HZ       LYS  63 -10.339   5.906  -2.638
  447    H    CYS  64           H        CYS  64  -9.199  10.854  -0.427
  448    HA   CYS  64           HA       CYS  64  -8.469  12.639   1.618
  449   1HB   CYS  64          1HB       CYS  64  -7.864  12.396  -0.951
  450   2HB   CYS  64          2HB       CYS  64  -9.033  13.676  -1.153
  451    H    VAL  65           H        VAL  65 -10.540  12.369   2.865
  452    HA   VAL  65           HA       VAL  65 -12.233  14.775   2.318
  453    HB   VAL  65           HB       VAL  65 -13.958  13.755   3.775
  454   1HG1  VAL  65          1HG1      VAL  65 -14.140  13.756   1.310
  455   2HG1  VAL  65          2HG1      VAL  65 -13.287  12.198   1.237
  456   3HG1  VAL  65          3HG1      VAL  65 -14.879  12.308   2.017
  457   1HG2  VAL  65          1HG2      VAL  65 -12.555  12.063   4.900
  458   2HG2  VAL  65          2HG2      VAL  65 -13.982  11.339   4.136
  459   3HG2  VAL  65          3HG2      VAL  65 -12.395  11.162   3.377
  460    H    SER  66           H        SER  66 -12.855  16.014   4.087
  461    HA   SER  66           HA       SER  66 -10.617  16.804   5.532
  462   1HB   SER  66          1HB       SER  66 -13.492  17.707   5.882
  463   2HB   SER  66          2HB       SER  66 -12.019  18.680   6.104
  464    HG   SER  66           HG       SER  66 -12.992  19.048   4.066
  465    H    ALA  67           H        ALA  67 -10.911  17.662   7.820
  466    HA   ALA  67           HA       ALA  67 -10.446  15.740   9.655
  467   1HB   ALA  67          1HB       ALA  67  -9.944  18.088   9.950
  468   2HB   ALA  67          2HB       ALA  67 -11.673  18.469  10.134
  469   3HB   ALA  67          3HB       ALA  67 -10.845  17.466  11.352
  470    H    GLU  68           H        GLU  68 -13.576  17.382   9.244
  471    HA   GLU  68           HA       GLU  68 -15.252  16.222  11.074
  472   1HB   GLU  68          1HB       GLU  68 -16.879  16.090   8.902
  473   2HB   GLU  68          2HB       GLU  68 -16.541  17.581   9.779
  474   1HG   GLU  68          1HG       GLU  68 -14.888  16.753   7.366
  475   2HG   GLU  68          2HG       GLU  68 -16.452  17.538   7.193
  476    H    ASP  69           H        ASP  69 -14.563  14.779   7.873
  477    HA   ASP  69           HA       ASP  69 -16.016  12.350   8.360
  478   1HB   ASP  69          1HB       ASP  69 -13.770  12.997   6.418
  479   2HB   ASP  69          2HB       ASP  69 -14.807  11.564   6.346
  480    H    CYS  70           H        CYS  70 -12.563  13.299   8.557
  481    HA   CYS  70           HA       CYS  70 -11.517  10.781   9.262
  482   1HB   CYS  70          1HB       CYS  70  -9.948  12.390   8.679
  483   2HB   CYS  70          2HB       CYS  70 -10.584  13.570   9.829
  484    H    GLU  71           H        GLU  71 -13.001  13.170  11.502
  485    HA   GLU  71           HA       GLU  71 -12.392  11.702  13.827
  486   1HB   GLU  71          1HB       GLU  71 -15.080  13.080  13.380
  487   2HB   GLU  71          2HB       GLU  71 -14.265  12.774  14.917
  488   1HG   GLU  71          1HG       GLU  71 -13.546  14.817  12.789
  489   2HG   GLU  71          2HG       GLU  71 -14.094  15.101  14.424
  490    H    LEU  72           H        LEU  72 -14.955  11.177  11.477
  491    HA   LEU  72           HA       LEU  72 -16.182   8.933  12.919
  492   1HB   LEU  72          1HB       LEU  72 -16.614  10.167  10.182
  493   2HB   LEU  72          2HB       LEU  72 -17.285   8.595  10.615
  494    HG   LEU  72           HG       LEU  72 -18.480   9.556  12.526
  495   1HD1  LEU  72          1HD1      LEU  72 -17.407  12.227  11.524
  496   2HD1  LEU  72          2HD1      LEU  72 -18.748  12.045  12.669
  497   3HD1  LEU  72          3HD1      LEU  72 -17.136  11.500  13.128
  498   1HD2  LEU  72          1HD2      LEU  72 -19.555   9.353  10.309
  499   2HD2  LEU  72          2HD2      LEU  72 -20.172  10.758  11.196
  500   3HD2  LEU  72          3HD2      LEU  72 -18.996  10.985   9.883
  501    H    ASP  73           H        ASP  73 -13.759   9.349  10.337
  502    HA   ASP  73           HA       ASP  73 -13.484   6.598   9.653
  503   1HB   ASP  73          1HB       ASP  73 -12.426   8.547   8.440
  504   2HB   ASP  73          2HB       ASP  73 -11.259   8.660   9.772
  505    H    ASN  74           H        ASN  74 -12.103   8.548  12.296
  506    HA   ASN  74           HA       ASN  74 -10.655   6.358  13.543
  507   1HB   ASN  74          1HB       ASN  74 -10.021   8.605  14.172
  508   2HB   ASN  74          2HB       ASN  74 -11.670   9.031  14.558
  509   1HD2  ASN  74          2HD2      ASN  74  -9.143   6.611  15.646
  510   2HD2  ASN  74          1HD2      ASN  74  -9.726   6.645  17.309
  511    H    MET  75           H        MET  75 -13.696   8.003  14.544
  512    HA   MET  75           HA       MET  75 -15.143   7.439  16.165
  513   1HB   MET  75          1HB       MET  75 -16.156   6.723  14.047
  514   2HB   MET  75          2HB       MET  75 -15.544   5.084  14.277
  515   1HG   MET  75          1HG       MET  75 -17.963   5.419  14.815
  516   2HG   MET  75          2HG       MET  75 -17.047   4.739  16.144
  517   1HE   MET  75          1HE       MET  75 -18.758   7.955  14.704
  518   2HE   MET  75          2HE       MET  75 -18.573   9.105  16.050
  519   3HE   MET  75          3HE       MET  75 -17.149   8.603  15.117
  520    H    ASP  76           H        ASP  76 -12.893   6.985  17.272
  521    HA   ASP  76           HA       ASP  76 -13.201   4.829  19.166
  522   1HB   ASP  76          1HB       ASP  76 -12.352   3.522  17.245
  523   2HB   ASP  76          2HB       ASP  76 -11.003   4.641  17.050
  524    H    PHE  77           H        PHE  77 -13.272   7.020  20.086
  525    HA   PHE  77           HA       PHE  77 -12.525   8.383  21.662
  526   1HB   PHE  77          1HB       PHE  77  -9.910   6.859  21.520
  527   2HB   PHE  77          2HB       PHE  77 -10.424   7.952  22.790
  528    HD1  PHE  77           HD1      PHE  77 -12.510   7.391  24.172
  529    HD2  PHE  77           HD2      PHE  77 -10.478   4.542  21.649
  530    HE1  PHE  77           HE1      PHE  77 -13.504   5.524  25.469
  531    HE2  PHE  77           HE2      PHE  77 -11.513   2.686  22.911
  532    HZ   PHE  77           HZ       PHE  77 -13.012   3.168  24.839
  533    H    ILE  78           H        ILE  78  -9.900   8.063  19.251
  534    HA   ILE  78           HA       ILE  78  -8.467   9.530  18.333
  535    HB   ILE  78           HB       ILE  78 -10.226  11.809  19.383
  536   1HG1  ILE  78          1HG1      ILE  78 -10.072  10.348  16.719
  537   2HG1  ILE  78          2HG1      ILE  78 -11.434  10.384  17.867
  538   1HG2  ILE  78          1HG2      ILE  78  -7.915  11.818  17.417
  539   2HG2  ILE  78          2HG2      ILE  78  -8.989  13.187  17.763
  540   3HG2  ILE  78          3HG2      ILE  78  -7.932  12.564  19.019
  541   1HD1  ILE  78          1HD1      ILE  78 -11.651  12.848  17.434
  542   2HD1  ILE  78          2HD1      ILE  78 -10.469  12.644  16.109
  543   3HD1  ILE  78          3HD1      ILE  78 -12.015  11.786  16.057
  544    H    TYR  79           H        TYR  79  -9.447  11.090  21.388
  545    HA   TYR  79           HA       TYR  79  -8.309  11.737  23.228
  546   1HB   TYR  79          1HB       TYR  79  -5.938  10.047  22.506
  547   2HB   TYR  79          2HB       TYR  79  -6.421  10.687  24.065
  548    HD1  TYR  79           HD1      TYR  79  -8.416   9.759  25.264
  549    HD2  TYR  79           HD2      TYR  79  -6.676   7.867  21.810
  550    HE1  TYR  79           HE1      TYR  79  -9.358   7.574  25.977
  551    HE2  TYR  79           HE2      TYR  79  -7.475   5.669  22.608
  552    HH   TYR  79           HH       TYR  79  -9.805   5.334  25.195
  553    HA   PRO  80           HA       PRO  80  -6.579  15.152  20.792
  554   1HB   PRO  80          1HB       PRO  80  -6.094  16.074  23.648
  555   2HB   PRO  80          2HB       PRO  80  -6.561  17.065  22.232
  556   1HG   PRO  80          1HG       PRO  80  -8.478  16.226  23.938
  557   2HG   PRO  80          2HG       PRO  80  -8.746  16.029  22.179
  558   1HD   PRO  80          1HD       PRO  80  -7.863  13.941  24.179
  559   2HD   PRO  80          2HD       PRO  80  -9.041  13.811  22.834
  560    H    GLY  81           H        GLY  81  -4.636  14.564  19.784
  561   1HA   GLY  81          1HA       GLY  81  -2.371  14.833  19.503
  562   2HA   GLY  81          2HA       GLY  81  -2.159  15.215  21.214
  563    H    THR  82           H        THR  82  -3.186  13.078  22.531
  564    HA   THR  82           HA       THR  82  -2.413  10.540  21.473
  565    HB   THR  82           HB       THR  82  -0.176  11.299  21.898
  566    HG1  THR  82           HG1      THR  82   0.475   9.690  23.214
  567   1HG2  THR  82          1HG2      THR  82  -1.174  11.980  24.695
  568   2HG2  THR  82          2HG2      THR  82   0.542  11.938  24.241
  569   3HG2  THR  82          3HG2      THR  82  -0.546  13.119  23.494
  570    H    ARG  83           H        ARG  83  -2.241   9.075  23.603
  571    HA   ARG  83           HA       ARG  83  -4.914   8.927  24.628
  572   1HB   ARG  83          1HB       ARG  83  -4.060   7.072  26.011
  573   2HB   ARG  83          2HB       ARG  83  -3.714   6.953  24.290
  574   1HG   ARG  83          1HG       ARG  83  -1.331   7.854  24.850
  575   2HG   ARG  83          2HG       ARG  83  -1.773   7.629  26.546
  576   1HD   ARG  83          1HD       ARG  83  -0.514   5.730  25.686
  577   2HD   ARG  83          2HD       ARG  83  -2.169   5.217  26.093
  578    HE   ARG  83           HE       ARG  83  -2.191   5.952  23.369
  579   1HH1  ARG  83          1HH1      ARG  83  -0.531   3.507  25.302
  580   2HH1  ARG  83          2HH1      ARG  83  -0.504   2.333  24.011
  581   1HH2  ARG  83          1HH2      ARG  83  -2.292   4.480  21.801
  582   2HH2  ARG  83          2HH2      ARG  83  -1.523   2.909  21.904
  583    H    ASN  84           H        ASN  84  -1.856  10.060  26.098
  584    HA   ASN  84           HA       ASN  84  -3.306  12.018  27.570
  585   1HB   ASN  84          1HB       ASN  84  -2.568  11.415  29.841
  586   2HB   ASN  84          2HB       ASN  84  -3.596  10.148  29.177
  587   1HD2  ASN  84          2HD2      ASN  84  -0.181  11.013  30.013
  588   2HD2  ASN  84          1HD2      ASN  84   0.342   9.342  30.031
  589    HA   PRO  85           HA       PRO  85   0.849  13.695  26.917
  590   1HB   PRO  85          1HB       PRO  85   0.855  15.843  28.604
  591   2HB   PRO  85          2HB       PRO  85  -0.114  15.806  27.103
  592   1HG   PRO  85          1HG       PRO  85  -1.052  15.156  29.913
  593   2HG   PRO  85          2HG       PRO  85  -1.815  16.270  28.741
  594   1HD   PRO  85          1HD       PRO  85  -2.668  13.710  29.039
  595   2HD   PRO  85          2HD       PRO  85  -2.607  14.458  27.415
  Start of MODEL    9
    1   1H    LYS   1          1H        LYS   1   1.232  11.120 -16.675
    2   2H    LYS   1          2H        LYS   1   0.741  12.691 -16.835
    3   3H    LYS   1          3H        LYS   1   2.233  12.339 -16.216
    4    HA   LYS   1           HA       LYS   1   0.796  12.969 -14.467
    5   1HB   LYS   1          1HB       LYS   1  -1.301  12.368 -15.578
    6   2HB   LYS   1          2HB       LYS   1  -0.906  10.646 -15.458
    7   1HG   LYS   1          1HG       LYS   1  -1.044  10.741 -13.009
    8   2HG   LYS   1          2HG       LYS   1  -1.299  12.500 -13.063
    9   1HD   LYS   1          1HD       LYS   1  -3.401  12.166 -14.311
   10   2HD   LYS   1          2HD       LYS   1  -3.157  10.414 -14.311
   11   1HE   LYS   1          1HE       LYS   1  -3.443  12.117 -11.783
   12   2HE   LYS   1          2HE       LYS   1  -4.771  11.247 -12.563
   13   1HZ   LYS   1          1HZ       LYS   1  -3.609   9.205 -12.202
   14   2HZ   LYS   1          2HZ       LYS   1  -2.366   9.980 -11.455
   15   3HZ   LYS   1          3HZ       LYS   1  -3.875   9.999 -10.785
   16    H    ALA   2           H        ALA   2   1.477  12.243 -12.489
   17    HA   ALA   2           HA       ALA   2   3.309  10.112 -12.099
   18   1HB   ALA   2          1HB       ALA   2   1.389  11.492 -10.175
   19   2HB   ALA   2          2HB       ALA   2   2.693  10.384  -9.698
   20   3HB   ALA   2          3HB       ALA   2   3.086  11.927 -10.487
   21    H    THR   3           H        THR   3   2.735   8.137 -12.831
   22    HA   THR   3           HA       THR   3   0.116   7.249 -13.078
   23    HB   THR   3           HB       THR   3   2.556   5.484 -13.324
   24    HG1  THR   3           HG1      THR   3   1.974   7.884 -14.710
   25   1HG2  THR   3          1HG2      THR   3   0.334   4.597 -14.027
   26   2HG2  THR   3          2HG2      THR   3   0.135   5.983 -15.126
   27   3HG2  THR   3          3HG2      THR   3   1.434   4.805 -15.404
   28    H    MET   4           H        MET   4  -0.254   7.631 -10.650
   29    HA   MET   4           HA       MET   4  -0.878   5.038  -9.541
   30   1HB   MET   4          1HB       MET   4   0.472   7.092  -7.735
   31   2HB   MET   4          2HB       MET   4  -0.131   5.499  -7.284
   32   1HG   MET   4          1HG       MET   4   1.631   4.486  -8.754
   33   2HG   MET   4          2HG       MET   4   2.242   6.123  -9.070
   34   1HE   MET   4          1HE       MET   4   4.239   3.987  -8.123
   35   2HE   MET   4          2HE       MET   4   4.655   5.711  -8.323
   36   3HE   MET   4          3HE       MET   4   5.093   4.860  -6.825
   37    H    GLN   5           H        GLN   5  -2.250   6.013  -7.314
   38    HA   GLN   5           HA       GLN   5  -4.434   7.250  -8.705
   39   1HB   GLN   5          1HB       GLN   5  -5.760   6.741  -6.845
   40   2HB   GLN   5          2HB       GLN   5  -4.690   5.386  -7.173
   41   1HG   GLN   5          1HG       GLN   5  -4.564   7.349  -4.873
   42   2HG   GLN   5          2HG       GLN   5  -4.955   5.646  -4.803
   43   1HE2  GLN   5          2HE2      GLN   5  -2.688   7.499  -3.631
   44   2HE2  GLN   5          1HE2      GLN   5  -1.256   6.514  -3.914
   45    H    CYS   6           H        CYS   6  -2.611   9.175  -8.922
   46    HA   CYS   6           HA       CYS   6  -3.096  11.373  -7.020
   47   1HB   CYS   6          1HB       CYS   6  -1.680  11.118  -9.680
   48   2HB   CYS   6          2HB       CYS   6  -2.068  12.701  -9.008
   49    H    GLY   7           H        GLY   7  -4.044  13.474  -7.988
   50   1HA   GLY   7          1HA       GLY   7  -5.556  14.613  -9.340
   51   2HA   GLY   7          2HA       GLY   7  -5.923  13.134 -10.239
   52    H    GLU   8           H        GLU   8  -6.656  11.421  -8.163
   53    HA   GLU   8           HA       GLU   8  -9.304  12.219  -7.338
   54   1HB   GLU   8          1HB       GLU   8  -7.479   9.959  -6.391
   55   2HB   GLU   8          2HB       GLU   8  -9.213  10.091  -6.072
   56   1HG   GLU   8          1HG       GLU   8  -9.696   9.954  -8.495
   57   2HG   GLU   8          2HG       GLU   8  -7.966   9.855  -8.860
   58    H    ASN   9           H        ASN   9  -8.302  14.340  -6.480
   59    HA   ASN   9           HA       ASN   9  -7.305  15.661  -4.966
   60   1HB   ASN   9          1HB       ASN   9  -8.402  15.827  -2.795
   61   2HB   ASN   9          2HB       ASN   9  -9.500  15.758  -4.167
   62   1HD2  ASN   9          2HD2      ASN   9  -7.912  13.406  -1.937
   63   2HD2  ASN   9          1HD2      ASN   9  -9.426  12.552  -1.558
   64    H    GLU  10           H        GLU  10  -5.520  14.067  -5.634
   65    HA   GLU  10           HA       GLU  10  -3.842  13.677  -3.273
   66   1HB   GLU  10          1HB       GLU  10  -4.617  11.545  -5.313
   67   2HB   GLU  10          2HB       GLU  10  -3.043  11.492  -4.490
   68   1HG   GLU  10          1HG       GLU  10  -4.080  11.356  -2.345
   69   2HG   GLU  10          2HG       GLU  10  -5.711  11.526  -3.037
   70    H    LYS  11           H        LYS  11  -1.610  13.887  -3.814
   71    HA   LYS  11           HA       LYS  11  -0.877  14.405  -6.610
   72   1HB   LYS  11          1HB       LYS  11   0.241  16.400  -6.261
   73   2HB   LYS  11          2HB       LYS  11  -1.350  16.661  -5.558
   74   1HG   LYS  11          1HG       LYS  11   1.173  15.983  -3.937
   75   2HG   LYS  11          2HG       LYS  11   0.640  17.613  -4.331
   76   1HD   LYS  11          1HD       LYS  11  -1.456  17.307  -3.120
   77   2HD   LYS  11          2HD       LYS  11  -1.007  15.640  -2.689
   78   1HE   LYS  11          1HE       LYS  11   0.924  16.402  -1.431
   79   2HE   LYS  11          2HE       LYS  11   0.673  18.079  -1.958
   80   1HZ   LYS  11          1HZ       LYS  11  -1.223  16.552  -0.322
   81   2HZ   LYS  11          2HZ       LYS  11  -0.142  17.661   0.247
   82   3HZ   LYS  11          3HZ       LYS  11  -1.346  18.139  -0.774
   83    H    TYR  12           H        TYR  12   1.519  14.264  -6.886
   84    HA   TYR  12           HA       TYR  12   2.378  11.871  -5.534
   85   1HB   TYR  12          1HB       TYR  12   2.665  12.507  -7.972
   86   2HB   TYR  12          2HB       TYR  12   3.963  13.578  -7.456
   87    HD1  TYR  12           HD1      TYR  12   2.796  10.015  -6.908
   88    HD2  TYR  12           HD2      TYR  12   6.128  12.639  -7.700
   89    HE1  TYR  12           HE1      TYR  12   4.209   8.061  -7.441
   90    HE2  TYR  12           HE2      TYR  12   7.541  10.682  -8.206
   91    HH   TYR  12           HH       TYR  12   7.660   8.329  -8.100
   92    H    ASP  13           H        ASP  13   3.869  11.575  -3.892
   93    HA   ASP  13           HA       ASP  13   5.715  13.754  -3.216
   94   1HB   ASP  13          1HB       ASP  13   3.608  14.226  -1.926
   95   2HB   ASP  13          2HB       ASP  13   3.731  12.601  -1.218
   96    H    SER  14           H        SER  14   7.384  13.059  -1.754
   97    HA   SER  14           HA       SER  14   8.190  10.256  -2.006
   98   1HB   SER  14          1HB       SER  14  10.142  11.254  -0.645
   99   2HB   SER  14          2HB       SER  14   9.899  11.869  -2.296
  100    HG   SER  14           HG       SER  14   8.751  13.109  -0.007
  101    H    CYS  15           H        CYS  15   8.193   8.816  -0.296
  102    HA   CYS  15           HA       CYS  15   7.757   7.841   1.630
  103   1HB   CYS  15          1HB       CYS  15   8.984   9.999   2.582
  104   2HB   CYS  15          2HB       CYS  15   7.391  10.326   3.264
  105    H    GLY  16           H        GLY  16   5.752   7.124   0.633
  106   1HA   GLY  16          1HA       GLY  16   3.356   8.277   1.993
  107   2HA   GLY  16          2HA       GLY  16   3.364   7.938   0.261
  108    H    SER  17           H        SER  17   2.760   5.821  -0.260
  109    HA   SER  17           HA       SER  17   1.875   3.760  -0.007
  110   1HB   SER  17          1HB       SER  17   3.089   3.543   2.787
  111   2HB   SER  17          2HB       SER  17   2.486   2.259   1.734
  112    HG   SER  17           HG       SER  17   4.085   2.843   0.217
  113    H    LYS  18           H        LYS  18   1.748   5.394   3.113
  114    HA   LYS  18           HA       LYS  18  -0.497   6.872   2.895
  115   1HB   LYS  18          1HB       LYS  18  -2.181   5.786   4.327
  116   2HB   LYS  18          2HB       LYS  18  -2.016   5.011   2.757
  117   1HG   LYS  18          1HG       LYS  18  -0.787   3.149   3.705
  118   2HG   LYS  18          2HG       LYS  18  -0.761   3.926   5.307
  119   1HD   LYS  18          1HD       LYS  18  -3.179   3.855   5.475
  120   2HD   LYS  18          2HD       LYS  18  -3.342   3.251   3.816
  121   1HE   LYS  18          1HE       LYS  18  -1.879   1.717   6.010
  122   2HE   LYS  18          2HE       LYS  18  -3.604   1.519   5.653
  123   1HZ   LYS  18          1HZ       LYS  18  -1.453   1.077   3.711
  124   2HZ   LYS  18          2HZ       LYS  18  -2.287  -0.096   4.516
  125   3HZ   LYS  18          3HZ       LYS  18  -3.073   0.886   3.451
  126    H    GLU  19           H        GLU  19   1.930   7.203   3.592
  127    HA   GLU  19           HA       GLU  19   2.927   7.086   6.029
  128   1HB   GLU  19          1HB       GLU  19   4.062   8.057   4.240
  129   2HB   GLU  19          2HB       GLU  19   2.913   9.389   4.077
  130   1HG   GLU  19          1HG       GLU  19   5.279   9.783   5.101
  131   2HG   GLU  19          2HG       GLU  19   3.872  10.603   5.732
  132    H    CYS  20           H        CYS  20   2.472   7.633   7.976
  133    HA   CYS  20           HA       CYS  20   0.039   8.295   8.936
  134   1HB   CYS  20          1HB       CYS  20   2.607   8.844  10.424
  135   2HB   CYS  20          2HB       CYS  20   1.000   8.526  11.101
  136    H    ASP  21           H        ASP  21   2.469  10.512   7.911
  137    HA   ASP  21           HA       ASP  21   1.897  13.039   8.678
  138   1HB   ASP  21          1HB       ASP  21   3.413  12.448   6.802
  139   2HB   ASP  21          2HB       ASP  21   2.027  11.929   5.817
  140    H    LYS  22           H        LYS  22   0.047  11.345   6.116
  141    HA   LYS  22           HA       LYS  22  -2.252  13.191   6.555
  142   1HB   LYS  22          1HB       LYS  22  -1.439  11.562   4.125
  143   2HB   LYS  22          2HB       LYS  22  -3.010  12.355   4.295
  144   1HG   LYS  22          1HG       LYS  22  -0.320  13.744   4.183
  145   2HG   LYS  22          2HG       LYS  22  -1.619  13.762   2.990
  146   1HD   LYS  22          1HD       LYS  22  -3.085  14.748   4.967
  147   2HD   LYS  22          2HD       LYS  22  -1.511  15.110   5.704
  148   1HE   LYS  22          1HE       LYS  22  -2.238  17.054   4.545
  149   2HE   LYS  22          2HE       LYS  22  -0.907  16.373   3.589
  150   1HZ   LYS  22          1HZ       LYS  22  -3.770  15.886   3.056
  151   2HZ   LYS  22          2HZ       LYS  22  -2.884  17.058   2.311
  152   3HZ   LYS  22          3HZ       LYS  22  -2.503  15.485   2.079
  153    H    LYS  23           H        LYS  23  -1.466  10.357   8.003
  154    HA   LYS  23           HA       LYS  23  -4.009   9.067   7.369
  155   1HB   LYS  23          1HB       LYS  23  -1.731   7.878   7.734
  156   2HB   LYS  23          2HB       LYS  23  -2.122   8.049   9.463
  157   1HG   LYS  23          1HG       LYS  23  -3.637   6.624   7.243
  158   2HG   LYS  23          2HG       LYS  23  -2.926   5.919   8.707
  159   1HD   LYS  23          1HD       LYS  23  -4.536   7.318  10.059
  160   2HD   LYS  23          2HD       LYS  23  -5.331   7.805   8.558
  161   1HE   LYS  23          1HE       LYS  23  -5.116   4.972   9.698
  162   2HE   LYS  23          2HE       LYS  23  -6.581   5.957   9.551
  163   1HZ   LYS  23          1HZ       LYS  23  -6.262   5.889   7.151
  164   2HZ   LYS  23          2HZ       LYS  23  -4.970   4.890   7.342
  165   3HZ   LYS  23          3HZ       LYS  23  -6.464   4.373   7.789
  166    H    CYS  24           H        CYS  24  -4.934  11.098   7.957
  167    HA   CYS  24           HA       CYS  24  -6.277  12.392   9.228
  168   1HB   CYS  24          1HB       CYS  24  -7.400  10.189   9.238
  169   2HB   CYS  24          2HB       CYS  24  -6.657   9.832  10.796
  170    H    LYS  25           H        LYS  25  -4.814  13.926  10.085
  171    HA   LYS  25           HA       LYS  25  -3.552  13.540  12.640
  172   1HB   LYS  25          1HB       LYS  25  -4.265  15.980  10.989
  173   2HB   LYS  25          2HB       LYS  25  -3.544  16.132  12.595
  174   1HG   LYS  25          1HG       LYS  25  -2.263  14.384  10.459
  175   2HG   LYS  25          2HG       LYS  25  -1.945  16.123  10.555
  176   1HD   LYS  25          1HD       LYS  25  -1.104  15.942  12.828
  177   2HD   LYS  25          2HD       LYS  25  -1.495  14.224  12.916
  178   1HE   LYS  25          1HE       LYS  25   0.515  15.443  10.974
  179   2HE   LYS  25          2HE       LYS  25   0.902  14.633  12.503
  180   1HZ   LYS  25          1HZ       LYS  25  -0.205  12.658  11.607
  181   2HZ   LYS  25          2HZ       LYS  25  -0.352  13.416  10.147
  182   3HZ   LYS  25          3HZ       LYS  25   1.137  13.106  10.765
  183    H    TYR  26           H        TYR  26  -4.576  13.185  14.466
  184    HA   TYR  26           HA       TYR  26  -7.447  13.411  14.596
  185   1HB   TYR  26          1HB       TYR  26  -5.453  12.590  16.713
  186   2HB   TYR  26          2HB       TYR  26  -7.182  12.289  16.749
  187    HD1  TYR  26           HD1      TYR  26  -8.192  10.899  14.737
  188    HD2  TYR  26           HD2      TYR  26  -4.006  10.915  15.776
  189    HE1  TYR  26           HE1      TYR  26  -7.756   9.090  13.105
  190    HE2  TYR  26           HE2      TYR  26  -3.572   9.197  14.084
  191    HH   TYR  26           HH       TYR  26  -4.644   8.769  11.846
  192    H    ASP  27           H        ASP  27  -7.618  15.723  14.324
  193    HA   ASP  27           HA       ASP  27  -6.957  17.685  16.246
  194   1HB   ASP  27          1HB       ASP  27  -8.139  18.241  14.161
  195   2HB   ASP  27          2HB       ASP  27  -9.549  17.296  14.680
  196    H    GLY  28           H        GLY  28  -7.567  17.958  18.409
  197   1HA   GLY  28          1HA       GLY  28  -8.994  17.619  20.295
  198   2HA   GLY  28          2HA       GLY  28  -9.650  16.144  19.579
  199    H    VAL  29           H        VAL  29  -6.441  16.054  18.772
  200    HA   VAL  29           HA       VAL  29  -4.453  15.732  19.664
  201    HB   VAL  29           HB       VAL  29  -5.716  15.713  22.419
  202   1HG1  VAL  29          1HG1      VAL  29  -2.780  15.434  21.714
  203   2HG1  VAL  29          2HG1      VAL  29  -3.453  15.756  23.318
  204   3HG1  VAL  29          3HG1      VAL  29  -3.788  14.213  22.535
  205   1HG2  VAL  29          1HG2      VAL  29  -5.513  17.900  21.146
  206   2HG2  VAL  29          2HG2      VAL  29  -4.530  17.829  22.618
  207   3HG2  VAL  29          3HG2      VAL  29  -3.774  17.610  21.031
  208    H    GLU  30           H        GLU  30  -3.134  14.199  20.023
  209    HA   GLU  30           HA       GLU  30  -3.843  11.397  20.277
  210   1HB   GLU  30          1HB       GLU  30  -2.268  11.078  18.213
  211   2HB   GLU  30          2HB       GLU  30  -3.955  11.479  17.913
  212   1HG   GLU  30          1HG       GLU  30  -3.419  13.807  17.427
  213   2HG   GLU  30          2HG       GLU  30  -1.770  13.609  18.030
  214    H    GLU  31           H        GLU  31  -1.879  10.308  20.879
  215    HA   GLU  31           HA       GLU  31   0.048  11.927  22.302
  216   1HB   GLU  31          1HB       GLU  31  -0.048   8.956  21.702
  217   2HB   GLU  31          2HB       GLU  31   1.191   9.759  22.681
  218   1HG   GLU  31          1HG       GLU  31  -0.480   8.787  24.139
  219   2HG   GLU  31          2HG       GLU  31  -0.509  10.550  24.266
  220    H    GLU  32           H        GLU  32   0.599  13.287  20.496
  221    HA   GLU  32           HA       GLU  32   2.209  12.505  18.307
  222   1HB   GLU  32          1HB       GLU  32   2.291  15.124  19.858
  223   2HB   GLU  32          2HB       GLU  32   2.970  14.827  18.250
  224   1HG   GLU  32          1HG       GLU  32   0.639  14.152  17.477
  225   2HG   GLU  32          2HG       GLU  32   0.029  14.770  19.027
  226    H    ASP  33           H        ASP  33   2.983  12.307  21.609
  227    HA   ASP  33           HA       ASP  33   5.704  12.652  21.902
  228   1HB   ASP  33          1HB       ASP  33   3.986  10.359  22.949
  229   2HB   ASP  33          2HB       ASP  33   5.514  10.925  23.634
  230    H    ASP  34           H        ASP  34   6.570  12.192  19.805
  231    HA   ASP  34           HA       ASP  34   7.733  11.012  18.253
  232   1HB   ASP  34          1HB       ASP  34   7.707   8.675  20.214
  233   2HB   ASP  34          2HB       ASP  34   8.668   8.797  18.741
  234    H    GLU  35           H        GLU  35   5.066  11.360  18.096
  235    HA   GLU  35           HA       GLU  35   3.037  10.571  17.430
  236   1HB   GLU  35          1HB       GLU  35   3.114   9.846  15.045
  237   2HB   GLU  35          2HB       GLU  35   3.921  11.369  15.430
  238   1HG   GLU  35          1HG       GLU  35   6.119  10.329  15.300
  239   2HG   GLU  35          2HG       GLU  35   5.403   8.729  15.072
  240    H    GLU  36           H        GLU  36   2.775   9.032  19.205
  241    HA   GLU  36           HA       GLU  36   3.347   6.294  18.951
  242   1HB   GLU  36          1HB       GLU  36   0.973   7.526  20.374
  243   2HB   GLU  36          2HB       GLU  36   1.586   5.881  20.569
  244   1HG   GLU  36          1HG       GLU  36   3.791   6.801  21.322
  245   2HG   GLU  36          2HG       GLU  36   3.129   8.436  21.218
  246    HA   PRO  37           HA       PRO  37  -0.959   5.850  16.593
  247   1HB   PRO  37          1HB       PRO  37  -0.338   8.206  14.802
  248   2HB   PRO  37          2HB       PRO  37  -1.923   7.444  15.135
  249   1HG   PRO  37          1HG       PRO  37  -1.240   9.694  16.451
  250   2HG   PRO  37          2HG       PRO  37  -1.936   8.342  17.381
  251   1HD   PRO  37          1HD       PRO  37   0.939   9.126  17.072
  252   2HD   PRO  37          2HD       PRO  37   0.083   8.653  18.567
  253    H    ASN  38           H        ASN  38   2.302   6.781  15.475
  254    HA   ASN  38           HA       ASN  38   2.315   5.450  12.980
  255   1HB   ASN  38          1HB       ASN  38   4.027   7.042  14.011
  256   2HB   ASN  38          2HB       ASN  38   4.704   5.621  14.817
  257   1HD2  ASN  38          2HD2      ASN  38   4.793   7.549  12.018
  258   2HD2  ASN  38          1HD2      ASN  38   5.586   6.405  10.943
  259    H    VAL  39           H        VAL  39   2.302   4.125  16.263
  260    HA   VAL  39           HA       VAL  39   3.462   1.601  15.619
  261    HB   VAL  39           HB       VAL  39   1.550   2.374  17.847
  262   1HG1  VAL  39          1HG1      VAL  39   3.123  -0.204  17.401
  263   2HG1  VAL  39          2HG1      VAL  39   2.288   0.251  18.902
  264   3HG1  VAL  39          3HG1      VAL  39   1.352  -0.057  17.436
  265   1HG2  VAL  39          1HG2      VAL  39   3.768   3.474  17.906
  266   2HG2  VAL  39          2HG2      VAL  39   3.587   2.285  19.201
  267   3HG2  VAL  39          3HG2      VAL  39   4.553   1.889  17.766
  268    HA   PRO  40           HA       PRO  40  -0.787  -0.102  14.343
  269   1HB   PRO  40          1HB       PRO  40  -3.002   1.530  14.170
  270   2HB   PRO  40          2HB       PRO  40  -2.555   0.583  15.617
  271   1HG   PRO  40          1HG       PRO  40  -1.970   3.495  15.065
  272   2HG   PRO  40          2HG       PRO  40  -2.641   2.778  16.553
  273   1HD   PRO  40          1HD       PRO  40  -0.002   3.336  16.411
  274   2HD   PRO  40          2HD       PRO  40  -0.562   1.817  17.150
  275    H    CYS  41           H        CYS  41  -0.181   3.342  13.429
  276    HA   CYS  41           HA       CYS  41  -0.899   2.871  10.631
  277   1HB   CYS  41          1HB       CYS  41  -1.298   5.013  11.507
  278   2HB   CYS  41          2HB       CYS  41   0.350   5.200  12.089
  279    H    LEU  42           H        LEU  42   0.393   0.897  10.616
  280    HA   LEU  42           HA       LEU  42   3.190   0.821  10.806
  281   1HB   LEU  42          1HB       LEU  42   1.223  -1.026   9.430
  282   2HB   LEU  42          2HB       LEU  42   2.909  -1.461   9.711
  283    HG   LEU  42           HG       LEU  42   1.082  -0.742  12.019
  284   1HD1  LEU  42          1HD1      LEU  42   1.619  -3.480  10.801
  285   2HD1  LEU  42          2HD1      LEU  42   0.755  -3.165  12.321
  286   3HD1  LEU  42          3HD1      LEU  42   0.067  -2.613  10.785
  287   1HD2  LEU  42          1HD2      LEU  42   3.688  -2.322  11.807
  288   2HD2  LEU  42          2HD2      LEU  42   3.487  -0.703  12.512
  289   3HD2  LEU  42          3HD2      LEU  42   2.728  -2.095  13.284
  290    H    VAL  43           H        VAL  43   3.117   2.946   9.137
  291    HA   VAL  43           HA       VAL  43   3.222   2.196   6.324
  292    HB   VAL  43           HB       VAL  43   3.735   4.611   5.941
  293   1HG1  VAL  43          1HG1      VAL  43   1.507   3.913   7.896
  294   2HG1  VAL  43          2HG1      VAL  43   1.690   5.477   7.110
  295   3HG1  VAL  43          3HG1      VAL  43   1.456   4.014   6.132
  296   1HG2  VAL  43          1HG2      VAL  43   3.940   4.735   9.006
  297   2HG2  VAL  43          2HG2      VAL  43   5.236   5.058   7.849
  298   3HG2  VAL  43          3HG2      VAL  43   3.837   6.117   7.921
  299    H    ARG  44           H        ARG  44   5.182   0.644   7.748
  300    HA   ARG  44           HA       ARG  44   7.758   1.921   7.796
  301   1HB   ARG  44          1HB       ARG  44   7.047  -1.049   7.685
  302   2HB   ARG  44          2HB       ARG  44   8.687  -0.407   7.786
  303   1HG   ARG  44          1HG       ARG  44   8.330  -0.737  10.005
  304   2HG   ARG  44          2HG       ARG  44   7.810   0.939   9.867
  305   1HD   ARG  44          1HD       ARG  44   5.399  -0.113   9.536
  306   2HD   ARG  44          2HD       ARG  44   6.145  -1.603  10.079
  307    HE   ARG  44           HE       ARG  44   6.100  -0.809  12.222
  308   1HH1  ARG  44          1HH1      ARG  44   5.904   2.025  10.076
  309   2HH1  ARG  44          2HH1      ARG  44   5.302   3.067  11.359
  310   1HH2  ARG  44          1HH2      ARG  44   5.165   0.573  13.801
  311   2HH2  ARG  44          2HH2      ARG  44   4.621   2.167  13.326
  312    H    VAL  45           H        VAL  45   6.023   0.272   5.240
  313    HA   VAL  45           HA       VAL  45   8.026   0.065   3.273
  314    HB   VAL  45           HB       VAL  45   6.020   0.534   1.677
  315   1HG1  VAL  45          1HG1      VAL  45   6.875  -1.712   2.196
  316   2HG1  VAL  45          2HG1      VAL  45   5.912  -1.758   3.690
  317   3HG1  VAL  45          3HG1      VAL  45   5.106  -1.721   2.107
  318   1HG2  VAL  45          1HG2      VAL  45   4.609   1.722   3.428
  319   2HG2  VAL  45          2HG2      VAL  45   3.817   0.399   2.553
  320   3HG2  VAL  45          3HG2      VAL  45   4.365   0.148   4.210
  321    H    CYS  46           H        CYS  46   6.291   2.925   4.389
  322    HA   CYS  46           HA       CYS  46   5.837   4.844   3.133
  323   1HB   CYS  46          1HB       CYS  46   7.340   4.994   5.279
  324   2HB   CYS  46          2HB       CYS  46   8.592   5.508   4.171
  325    H    HIS  47           H        HIS  47   6.141   3.716   0.865
  326    HA   HIS  47           HA       HIS  47   8.632   4.727  -0.448
  327   1HB   HIS  47          1HB       HIS  47   8.033   3.479  -2.374
  328   2HB   HIS  47          2HB       HIS  47   8.010   2.439  -0.947
  329    HD1  HIS  47           HD1      HIS  47   5.409   4.448  -3.036
  330    HD2  HIS  47           HD2      HIS  47   5.815   1.078  -0.550
  331    HE1  HIS  47           HE1      HIS  47   3.104   3.494  -2.764
  332    H    GLN  48           H        GLN  48   8.549   6.225  -2.115
  333    HA   GLN  48           HA       GLN  48   6.842   8.404  -2.128
  334   1HB   GLN  48          1HB       GLN  48   8.882   8.470  -3.356
  335   2HB   GLN  48          2HB       GLN  48   8.483   7.014  -4.278
  336   1HG   GLN  48          1HG       GLN  48   6.854   8.081  -5.574
  337   2HG   GLN  48          2HG       GLN  48   6.833   9.538  -4.572
  338   1HE2  GLN  48          2HE2      GLN  48   8.735  10.971  -4.577
  339   2HE2  GLN  48          1HE2      GLN  48   9.815  10.946  -5.961
  340    H    ASP  49           H        ASP  49   4.834   8.948  -3.010
  341    HA   ASP  49           HA       ASP  49   3.350   7.135  -4.712
  342   1HB   ASP  49          1HB       ASP  49   3.330   5.901  -2.509
  343   2HB   ASP  49          2HB       ASP  49   2.671   7.357  -1.755
  344    H    CYS  50           H        CYS  50   1.048   7.865  -4.808
  345    HA   CYS  50           HA       CYS  50   0.736  10.792  -4.832
  346   1HB   CYS  50          1HB       CYS  50  -0.993   8.434  -5.571
  347   2HB   CYS  50          2HB       CYS  50  -1.595  10.093  -5.587
  348    H    VAL  51           H        VAL  51   0.248  11.829  -2.973
  349    HA   VAL  51           HA       VAL  51  -1.107  10.380  -0.757
  350    HB   VAL  51           HB       VAL  51   1.341  10.910  -0.432
  351   1HG1  VAL  51          1HG1      VAL  51   1.338  13.184  -1.481
  352   2HG1  VAL  51          2HG1      VAL  51   0.311  13.783  -0.163
  353   3HG1  VAL  51          3HG1      VAL  51   1.941  13.207   0.190
  354   1HG2  VAL  51          1HG2      VAL  51  -0.204  10.422   1.431
  355   2HG2  VAL  51          2HG2      VAL  51   1.074  11.565   1.874
  356   3HG2  VAL  51          3HG2      VAL  51  -0.566  12.158   1.574
  357    H    CYS  52           H        CYS  52  -2.458  11.810   0.603
  358    HA   CYS  52           HA       CYS  52  -4.405  12.974  -1.005
  359   1HB   CYS  52          1HB       CYS  52  -4.024  13.568   1.932
  360   2HB   CYS  52          2HB       CYS  52  -5.497  13.686   0.966
  361    H    GLU  53           H        GLU  53  -5.125  14.940  -1.495
  362    HA   GLU  53           HA       GLU  53  -3.451  17.209  -1.766
  363   1HB   GLU  53          1HB       GLU  53  -5.472  16.754  -3.074
  364   2HB   GLU  53          2HB       GLU  53  -6.481  16.898  -1.624
  365   1HG   GLU  53          1HG       GLU  53  -5.873  19.305  -1.455
  366   2HG   GLU  53          2HG       GLU  53  -4.869  19.143  -2.912
  367    H    GLU  54           H        GLU  54  -3.400  19.151  -0.567
  368    HA   GLU  54           HA       GLU  54  -3.247  19.120   2.195
  369   1HB   GLU  54          1HB       GLU  54  -4.071  21.507   0.480
  370   2HB   GLU  54          2HB       GLU  54  -3.401  21.543   2.111
  371   1HG   GLU  54          1HG       GLU  54  -1.501  21.980   0.909
  372   2HG   GLU  54          2HG       GLU  54  -1.364  20.225   1.027
  373    H    GLY  55           H        GLY  55  -4.718  18.949   3.820
  374   1HA   GLY  55          1HA       GLY  55  -6.679  19.503   4.987
  375   2HA   GLY  55          2HA       GLY  55  -7.487  19.973   3.491
  376    H    PHE  56           H        PHE  56  -6.299  17.265   2.339
  377    HA   PHE  56           HA       PHE  56  -8.516  15.550   3.289
  378   1HB   PHE  56          1HB       PHE  56  -6.823  15.446   0.775
  379   2HB   PHE  56          2HB       PHE  56  -7.968  14.211   1.266
  380    HD1  PHE  56           HD1      PHE  56  -7.766  17.919   0.537
  381    HD2  PHE  56           HD2      PHE  56 -10.114  14.303   0.341
  382    HE1  PHE  56           HE1      PHE  56  -9.508  19.109  -0.742
  383    HE2  PHE  56           HE2      PHE  56 -11.832  15.484  -0.954
  384    HZ   PHE  56           HZ       PHE  56 -11.563  17.909  -1.476
  385    H    TYR  57           H        TYR  57  -8.085  13.396   3.884
  386    HA   TYR  57           HA       TYR  57  -5.307  12.761   4.728
  387   1HB   TYR  57          1HB       TYR  57  -7.855  12.925   6.383
  388   2HB   TYR  57          2HB       TYR  57  -6.438  12.034   6.904
  389    HD1  TYR  57           HD1      TYR  57  -7.746  15.409   6.100
  390    HD2  TYR  57           HD2      TYR  57  -4.464  13.181   7.767
  391    HE1  TYR  57           HE1      TYR  57  -6.709  17.521   6.839
  392    HE2  TYR  57           HE2      TYR  57  -3.352  15.307   8.405
  393    HH   TYR  57           HH       TYR  57  -4.896  18.489   7.925
  394    H    ARG  58           H        ARG  58  -4.892  10.610   4.931
  395    HA   ARG  58           HA       ARG  58  -6.248   8.772   3.179
  396   1HB   ARG  58          1HB       ARG  58  -4.109   8.229   5.292
  397   2HB   ARG  58          2HB       ARG  58  -4.482   7.207   3.913
  398   1HG   ARG  58          1HG       ARG  58  -3.334  10.021   3.714
  399   2HG   ARG  58          2HG       ARG  58  -2.334   8.596   3.856
  400   1HD   ARG  58          1HD       ARG  58  -4.423   8.725   1.649
  401   2HD   ARG  58          2HD       ARG  58  -2.885   9.614   1.524
  402    HE   ARG  58           HE       ARG  58  -2.549   6.812   2.199
  403   1HH1  ARG  58          1HH1      ARG  58  -3.286   8.914  -0.524
  404   2HH1  ARG  58          2HH1      ARG  58  -1.999   8.327  -1.547
  405   1HH2  ARG  58          1HH2      ARG  58  -1.216   5.636   0.629
  406   2HH2  ARG  58          2HH2      ARG  58  -0.931   6.348  -0.927
  407    H    ASN  59           H        ASN  59  -8.449   9.143   4.535
  408    HA   ASN  59           HA       ASN  59  -8.570   7.886   7.109
  409   1HB   ASN  59          1HB       ASN  59 -10.265   9.456   6.273
  410   2HB   ASN  59          2HB       ASN  59 -10.804   8.263   5.075
  411   1HD2  ASN  59          2HD2      ASN  59 -12.984   8.665   6.290
  412   2HD2  ASN  59          1HD2      ASN  59 -13.217   7.696   7.721
  413    H    LYS  60           H        LYS  60  -9.396   5.832   7.666
  414    HA   LYS  60           HA       LYS  60  -9.217   3.611   7.740
  415   1HB   LYS  60          1HB       LYS  60 -10.546   3.600   5.003
  416   2HB   LYS  60          2HB       LYS  60 -10.659   2.410   6.307
  417   1HG   LYS  60          1HG       LYS  60 -11.636   4.340   7.731
  418   2HG   LYS  60          2HG       LYS  60 -11.771   5.231   6.194
  419   1HD   LYS  60          1HD       LYS  60 -13.126   3.346   5.253
  420   2HD   LYS  60          2HD       LYS  60 -13.105   2.570   6.845
  421   1HE   LYS  60          1HE       LYS  60 -14.260   5.330   6.193
  422   2HE   LYS  60          2HE       LYS  60 -15.193   3.853   6.481
  423   1HZ   LYS  60          1HZ       LYS  60 -14.298   3.799   8.702
  424   2HZ   LYS  60          2HZ       LYS  60 -13.461   5.193   8.438
  425   3HZ   LYS  60          3HZ       LYS  60 -15.108   5.206   8.420
  426    H    ASP  61           H        ASP  61  -8.614   4.050   4.272
  427    HA   ASP  61           HA       ASP  61  -5.934   2.983   4.335
  428   1HB   ASP  61          1HB       ASP  61  -7.177   0.843   4.487
  429   2HB   ASP  61          2HB       ASP  61  -8.159   1.316   3.083
  430    H    ASP  62           H        ASP  62  -5.473   4.898   3.263
  431    HA   ASP  62           HA       ASP  62  -5.542   6.579   1.771
  432   1HB   ASP  62          1HB       ASP  62  -4.177   4.872   0.616
  433   2HB   ASP  62          2HB       ASP  62  -5.631   4.273  -0.202
  434    H    LYS  63           H        LYS  63  -8.176   6.201   2.814
  435    HA   LYS  63           HA       LYS  63  -9.864   6.813   0.426
  436   1HB   LYS  63          1HB       LYS  63 -10.679   6.832   3.340
  437   2HB   LYS  63          2HB       LYS  63 -11.707   6.915   1.920
  438   1HG   LYS  63          1HG       LYS  63  -9.980   4.524   2.710
  439   2HG   LYS  63          2HG       LYS  63 -11.704   4.711   3.050
  440   1HD   LYS  63          1HD       LYS  63 -12.187   4.746   0.615
  441   2HD   LYS  63          2HD       LYS  63 -10.450   4.659   0.260
  442   1HE   LYS  63          1HE       LYS  63 -11.442   2.458  -0.002
  443   2HE   LYS  63          2HE       LYS  63 -10.268   2.464   1.320
  444   1HZ   LYS  63          1HZ       LYS  63 -13.186   2.652   1.631
  445   2HZ   LYS  63          2HZ       LYS  63 -12.278   1.299   1.879
  446   3HZ   LYS  63          3HZ       LYS  63 -12.084   2.608   2.858
  447    H    CYS  64           H        CYS  64  -8.471   8.645  -0.176
  448    HA   CYS  64           HA       CYS  64  -7.789  10.670   1.716
  449   1HB   CYS  64          1HB       CYS  64  -7.830  10.815  -1.308
  450   2HB   CYS  64          2HB       CYS  64  -7.397  12.149  -0.242
  451    H    VAL  65           H        VAL  65  -9.442  11.431   2.902
  452    HA   VAL  65           HA       VAL  65 -11.670  12.884   1.496
  453    HB   VAL  65           HB       VAL  65 -13.087  12.276   3.398
  454   1HG1  VAL  65          1HG1      VAL  65 -13.128  10.909   1.347
  455   2HG1  VAL  65          2HG1      VAL  65 -11.914   9.817   2.042
  456   3HG1  VAL  65          3HG1      VAL  65 -13.510   9.962   2.797
  457   1HG2  VAL  65          1HG2      VAL  65 -10.694  10.609   4.301
  458   2HG2  VAL  65          2HG2      VAL  65 -11.486  11.912   5.192
  459   3HG2  VAL  65          3HG2      VAL  65 -12.328  10.385   4.905
  460    H    SER  66           H        SER  66 -12.263  14.897   2.402
  461    HA   SER  66           HA       SER  66 -10.442  16.531   3.632
  462   1HB   SER  66          1HB       SER  66 -13.442  16.653   4.042
  463   2HB   SER  66          2HB       SER  66 -12.293  18.000   3.900
  464    HG   SER  66           HG       SER  66 -11.886  17.197   1.713
  465    H    ALA  67           H        ALA  67  -9.748  16.828   5.714
  466    HA   ALA  67           HA       ALA  67  -9.498  15.124   7.682
  467   1HB   ALA  67          1HB       ALA  67  -8.696  17.496   7.738
  468   2HB   ALA  67          2HB       ALA  67 -10.286  18.020   8.275
  469   3HB   ALA  67          3HB       ALA  67  -9.316  16.947   9.301
  470    H    GLU  68           H        GLU  68 -12.202  17.304   7.762
  471    HA   GLU  68           HA       GLU  68 -13.980  16.786   9.584
  472   1HB   GLU  68          1HB       GLU  68 -14.802  16.535   6.660
  473   2HB   GLU  68          2HB       GLU  68 -15.712  17.231   8.004
  474   1HG   GLU  68          1HG       GLU  68 -13.920  19.044   8.149
  475   2HG   GLU  68          2HG       GLU  68 -13.200  18.396   6.664
  476    H    ASP  69           H        ASP  69 -13.728  14.485   6.809
  477    HA   ASP  69           HA       ASP  69 -15.634  12.617   8.029
  478   1HB   ASP  69          1HB       ASP  69 -15.437  12.894   5.556
  479   2HB   ASP  69          2HB       ASP  69 -13.780  12.267   5.640
  480    H    CYS  70           H        CYS  70 -12.124  12.884   7.574
  481    HA   CYS  70           HA       CYS  70 -11.356  10.273   8.330
  482   1HB   CYS  70          1HB       CYS  70  -9.267  11.008   8.058
  483   2HB   CYS  70          2HB       CYS  70 -10.022  12.459   7.420
  484    H    GLU  71           H        GLU  71 -11.949  13.190  10.282
  485    HA   GLU  71           HA       GLU  71 -11.173  12.299  12.763
  486   1HB   GLU  71          1HB       GLU  71 -13.771  13.816  12.303
  487   2HB   GLU  71          2HB       GLU  71 -12.797  13.785  13.773
  488   1HG   GLU  71          1HG       GLU  71 -12.209  15.176  11.157
  489   2HG   GLU  71          2HG       GLU  71 -12.385  15.874  12.754
  490    H    LEU  72           H        LEU  72 -13.997  11.066  10.998
  491    HA   LEU  72           HA       LEU  72 -15.370   9.901  13.226
  492   1HB   LEU  72          1HB       LEU  72 -15.147   8.945  10.346
  493   2HB   LEU  72          2HB       LEU  72 -16.332   8.374  11.520
  494    HG   LEU  72           HG       LEU  72 -16.145  11.280  10.581
  495   1HD1  LEU  72          1HD1      LEU  72 -16.729   9.758   8.729
  496   2HD1  LEU  72          2HD1      LEU  72 -18.039   9.062   9.707
  497   3HD1  LEU  72          3HD1      LEU  72 -18.106  10.766   9.203
  498   1HD2  LEU  72          1HD2      LEU  72 -18.267   9.781  12.182
  499   2HD2  LEU  72          2HD2      LEU  72 -17.224  11.093  12.779
  500   3HD2  LEU  72          3HD2      LEU  72 -18.435  11.427  11.538
  501    H    ASP  73           H        ASP  73 -12.552   8.829  11.327
  502    HA   ASP  73           HA       ASP  73 -12.479   6.179  12.631
  503   1HB   ASP  73          1HB       ASP  73 -11.882   6.424  10.261
  504   2HB   ASP  73          2HB       ASP  73 -10.600   7.578  10.682
  505    H    ASN  74           H        ASN  74 -12.563   7.693  14.678
  506    HA   ASN  74           HA       ASN  74 -10.278   9.232  15.324
  507   1HB   ASN  74          1HB       ASN  74 -11.273   9.737  17.295
  508   2HB   ASN  74          2HB       ASN  74 -12.670   9.334  16.310
  509   1HD2  ASN  74          2HD2      ASN  74 -11.334   8.936  19.337
  510   2HD2  ASN  74          1HD2      ASN  74 -12.225   7.496  19.819
  511    H    MET  75           H        MET  75 -11.188   5.980  16.468
  512    HA   MET  75           HA       MET  75 -10.145   4.373  17.540
  513   1HB   MET  75          1HB       MET  75  -7.921   3.627  16.760
  514   2HB   MET  75          2HB       MET  75  -9.178   3.754  15.528
  515   1HG   MET  75          1HG       MET  75  -8.216   5.790  14.646
  516   2HG   MET  75          2HG       MET  75  -6.994   5.822  15.933
  517   1HE   MET  75          1HE       MET  75  -6.522   6.012  12.744
  518   2HE   MET  75          2HE       MET  75  -5.226   6.174  13.960
  519   3HE   MET  75          3HE       MET  75  -5.034   5.044  12.598
  520    H    ASP  76           H        ASP  76 -10.545   6.010  19.182
  521    HA   ASP  76           HA       ASP  76 -10.094   6.348  21.360
  522   1HB   ASP  76          1HB       ASP  76  -8.583   4.428  21.272
  523   2HB   ASP  76          2HB       ASP  76  -7.232   5.487  20.840
  524    H    PHE  77           H        PHE  77  -7.556   7.595  19.167
  525    HA   PHE  77           HA       PHE  77  -7.003  10.003  20.598
  526   1HB   PHE  77          1HB       PHE  77  -7.145   9.727  17.596
  527   2HB   PHE  77          2HB       PHE  77  -6.104  10.799  18.535
  528    HD1  PHE  77           HD1      PHE  77  -4.754   9.140  20.482
  529    HD2  PHE  77           HD2      PHE  77  -5.981   8.042  16.494
  530    HE1  PHE  77           HE1      PHE  77  -3.163   7.252  20.508
  531    HE2  PHE  77           HE2      PHE  77  -4.381   6.156  16.527
  532    HZ   PHE  77           HZ       PHE  77  -2.984   5.739  18.543
  533    H    ILE  78           H        ILE  78  -7.684  12.235  19.652
  534    HA   ILE  78           HA       ILE  78  -9.298  13.785  19.360
  535    HB   ILE  78           HB       ILE  78 -11.330  11.683  18.526
  536   1HG1  ILE  78          1HG1      ILE  78  -9.317  13.314  16.915
  537   2HG1  ILE  78          2HG1      ILE  78  -9.456  11.552  17.001
  538   1HG2  ILE  78          1HG2      ILE  78 -12.310  13.795  19.321
  539   2HG2  ILE  78          2HG2      ILE  78 -11.327  14.688  18.165
  540   3HG2  ILE  78          3HG2      ILE  78 -12.558  13.544  17.606
  541   1HD1  ILE  78          1HD1      ILE  78 -11.767  11.776  15.996
  542   2HD1  ILE  78          2HD1      ILE  78 -11.359  13.477  15.660
  543   3HD1  ILE  78          3HD1      ILE  78 -10.393  12.176  14.940
  544    H    TYR  79           H        TYR  79  -8.770  13.797  21.607
  545    HA   TYR  79           HA       TYR  79 -10.802  12.794  23.506
  546   1HB   TYR  79          1HB       TYR  79  -8.360  14.575  23.906
  547   2HB   TYR  79          2HB       TYR  79  -9.249  13.746  25.168
  548    HD1  TYR  79           HD1      TYR  79  -9.507  11.054  24.686
  549    HD2  TYR  79           HD2      TYR  79  -6.357  13.573  23.164
  550    HE1  TYR  79           HE1      TYR  79  -8.145   9.059  24.206
  551    HE2  TYR  79           HE2      TYR  79  -5.025  11.557  22.616
  552    HH   TYR  79           HH       TYR  79  -6.291   8.246  23.104
  553    HA   PRO  80           HA       PRO  80 -12.958  16.748  23.223
  554   1HB   PRO  80          1HB       PRO  80 -13.519  17.461  25.817
  555   2HB   PRO  80          2HB       PRO  80 -14.354  16.147  24.943
  556   1HG   PRO  80          1HG       PRO  80 -12.013  15.895  26.833
  557   2HG   PRO  80          2HG       PRO  80 -13.533  14.960  26.867
  558   1HD   PRO  80          1HD       PRO  80 -11.327  13.936  25.716
  559   2HD   PRO  80          2HD       PRO  80 -12.901  13.730  24.910
  560    H    GLY  81           H        GLY  81 -10.948  17.583  22.326
  561   1HA   GLY  81          1HA       GLY  81  -9.615  19.477  22.124
  562   2HA   GLY  81          2HA       GLY  81  -9.887  19.898  23.823
  563    H    THR  82           H        THR  82  -9.140  17.946  25.278
  564    HA   THR  82           HA       THR  82  -6.662  16.612  24.503
  565    HB   THR  82           HB       THR  82  -6.465  18.756  26.663
  566    HG1  THR  82           HG1      THR  82  -6.076  18.900  23.911
  567   1HG2  THR  82          1HG2      THR  82  -4.347  17.121  25.196
  568   2HG2  THR  82          2HG2      THR  82  -4.025  18.431  26.348
  569   3HG2  THR  82          3HG2      THR  82  -4.807  16.942  26.902
  570    H    ARG  83           H        ARG  83  -9.148  17.379  26.931
  571    HA   ARG  83           HA       ARG  83  -8.005  15.832  29.028
  572   1HB   ARG  83          1HB       ARG  83  -9.536  17.769  29.297
  573   2HB   ARG  83          2HB       ARG  83 -10.856  16.786  28.653
  574   1HG   ARG  83          1HG       ARG  83 -10.467  15.163  30.578
  575   2HG   ARG  83          2HG       ARG  83  -9.230  16.261  31.191
  576   1HD   ARG  83          1HD       ARG  83 -11.397  16.608  32.354
  577   2HD   ARG  83          2HD       ARG  83 -10.882  18.044  31.472
  578    HE   ARG  83           HE       ARG  83 -12.728  17.923  30.153
  579   1HH1  ARG  83          1HH1      ARG  83 -12.282  14.746  31.624
  580   2HH1  ARG  83          2HH1      ARG  83 -13.761  14.080  30.985
  581   1HH2  ARG  83          1HH2      ARG  83 -14.643  17.072  29.291
  582   2HH2  ARG  83          2HH2      ARG  83 -15.127  15.433  29.630
  583    H    ASN  84           H        ASN  84  -7.553  13.871  27.727
  584    HA   ASN  84           HA       ASN  84  -9.319  11.922  26.907
  585   1HB   ASN  84          1HB       ASN  84  -6.960  11.537  26.832
  586   2HB   ASN  84          2HB       ASN  84  -6.802  11.688  28.586
  587   1HD2  ASN  84          2HD2      ASN  84  -7.974  10.033  29.947
  588   2HD2  ASN  84          1HD2      ASN  84  -8.073   8.398  29.304
  589    HA   PRO  85           HA       PRO  85 -11.717  11.700  30.758
  590   1HB   PRO  85          1HB       PRO  85 -13.738  10.035  29.982
  591   2HB   PRO  85          2HB       PRO  85 -13.611  11.729  29.423
  592   1HG   PRO  85          1HG       PRO  85 -12.678   9.238  27.971
  593   2HG   PRO  85          2HG       PRO  85 -13.686  10.565  27.324
  594   1HD   PRO  85          1HD       PRO  85 -10.999  10.457  26.927
  595   2HD   PRO  85          2HD       PRO  85 -11.818  12.026  27.202
  Start of MODEL   10
    1   1H    LYS   1          1H        LYS   1  -6.228  17.480  -7.333
    2   2H    LYS   1          2H        LYS   1  -6.663  16.800  -5.884
    3   3H    LYS   1          3H        LYS   1  -5.412  17.877  -5.962
    4    HA   LYS   1           HA       LYS   1  -4.476  15.794  -5.742
    5   1HB   LYS   1          1HB       LYS   1  -4.884  14.006  -7.346
    6   2HB   LYS   1          2HB       LYS   1  -6.361  14.454  -6.493
    7   1HG   LYS   1          1HG       LYS   1  -7.131  15.746  -8.448
    8   2HG   LYS   1          2HG       LYS   1  -5.659  15.316  -9.335
    9   1HD   LYS   1          1HD       LYS   1  -7.698  13.308  -8.252
   10   2HD   LYS   1          2HD       LYS   1  -7.636  13.909  -9.919
   11   1HE   LYS   1          1HE       LYS   1  -5.288  12.994 -10.112
   12   2HE   LYS   1          2HE       LYS   1  -5.481  12.265  -8.506
   13   1HZ   LYS   1          1HZ       LYS   1  -7.203  11.674 -10.792
   14   2HZ   LYS   1          2HZ       LYS   1  -5.931  10.761 -10.262
   15   3HZ   LYS   1          3HZ       LYS   1  -7.248  10.967  -9.293
   16    H    ALA   2           H        ALA   2  -2.651  14.951  -7.083
   17    HA   ALA   2           HA       ALA   2  -1.601  17.051  -8.909
   18   1HB   ALA   2          1HB       ALA   2  -0.344  14.510  -7.835
   19   2HB   ALA   2          2HB       ALA   2   0.442  15.644  -8.952
   20   3HB   ALA   2          3HB       ALA   2  -0.020  16.186  -7.330
   21    H    THR   3           H        THR   3  -0.790  16.404 -11.074
   22    HA   THR   3           HA       THR   3  -2.949  15.244 -12.522
   23    HB   THR   3           HB       THR   3  -1.219  15.801 -14.412
   24    HG1  THR   3           HG1      THR   3   0.453  17.160 -13.616
   25   1HG2  THR   3          1HG2      THR   3  -2.146  17.977 -12.469
   26   2HG2  THR   3          2HG2      THR   3  -1.647  18.229 -14.155
   27   3HG2  THR   3          3HG2      THR   3  -3.105  17.289 -13.797
   28    H    MET   4           H        MET   4   0.107  13.943 -11.385
   29    HA   MET   4           HA       MET   4   0.382  11.978 -13.489
   30   1HB   MET   4          1HB       MET   4   1.803  12.230 -10.814
   31   2HB   MET   4          2HB       MET   4   2.278  11.180 -12.165
   32   1HG   MET   4          1HG       MET   4   2.396  13.266 -13.619
   33   2HG   MET   4          2HG       MET   4   2.240  14.221 -12.142
   34   1HE   MET   4          1HE       MET   4   4.040  14.106 -10.149
   35   2HE   MET   4          2HE       MET   4   4.055  12.321 -10.148
   36   3HE   MET   4          3HE       MET   4   5.580  13.222 -10.275
   37    H    GLN   5           H        GLN   5  -1.939  11.378 -13.081
   38    HA   GLN   5           HA       GLN   5  -3.554  10.033 -12.562
   39   1HB   GLN   5          1HB       GLN   5  -3.143   7.596 -12.320
   40   2HB   GLN   5          2HB       GLN   5  -2.572   8.424 -13.759
   41   1HG   GLN   5          1HG       GLN   5  -0.959   6.866 -13.331
   42   2HG   GLN   5          2HG       GLN   5  -0.213   8.361 -12.817
   43   1HE2  GLN   5          2HE2      GLN   5   0.562   8.401 -10.652
   44   2HE2  GLN   5          1HE2      GLN   5   0.354   7.037  -9.548
   45    H    CYS   6           H        CYS   6  -1.217   9.147 -10.027
   46    HA   CYS   6           HA       CYS   6  -1.384   8.834  -7.845
   47   1HB   CYS   6          1HB       CYS   6  -3.216  11.252  -8.077
   48   2HB   CYS   6          2HB       CYS   6  -2.448  10.642  -6.611
   49    H    GLY   7           H        GLY   7  -4.825   9.621  -8.555
   50   1HA   GLY   7          1HA       GLY   7  -6.235   7.506  -8.373
   51   2HA   GLY   7          2HA       GLY   7  -5.668   7.411  -6.702
   52    H    GLU   8           H        GLU   8  -6.647   8.674  -5.157
   53    HA   GLU   8           HA       GLU   8  -9.133  10.068  -5.908
   54   1HB   GLU   8          1HB       GLU   8  -7.910   9.604  -3.161
   55   2HB   GLU   8          2HB       GLU   8  -9.589  10.069  -3.547
   56   1HG   GLU   8          1HG       GLU   8  -9.866   7.867  -4.705
   57   2HG   GLU   8          2HG       GLU   8  -8.264   7.393  -4.111
   58    H    ASN   9           H        ASN   9  -8.749  11.834  -3.418
   59    HA   ASN   9           HA       ASN   9  -7.551  14.162  -4.665
   60   1HB   ASN   9          1HB       ASN   9  -8.403  13.676  -1.788
   61   2HB   ASN   9          2HB       ASN   9  -7.940  15.226  -2.495
   62   1HD2  ASN   9          2HD2      ASN   9 -10.599  13.376  -1.667
   63   2HD2  ASN   9          1HD2      ASN   9 -11.756  14.074  -2.797
   64    H    GLU  10           H        GLU  10  -5.532  12.808  -5.121
   65    HA   GLU  10           HA       GLU  10  -3.684  12.651  -2.794
   66   1HB   GLU  10          1HB       GLU  10  -4.074  10.914  -5.239
   67   2HB   GLU  10          2HB       GLU  10  -2.623  10.810  -4.201
   68   1HG   GLU  10          1HG       GLU  10  -4.036  10.278  -2.268
   69   2HG   GLU  10          2HG       GLU  10  -5.493  10.421  -3.271
   70    H    LYS  11           H        LYS  11  -1.753  13.620  -2.902
   71    HA   LYS  11           HA       LYS  11  -1.048  15.155  -5.370
   72   1HB   LYS  11          1HB       LYS  11  -1.628  16.512  -3.409
   73   2HB   LYS  11          2HB       LYS  11  -0.370  15.699  -2.457
   74   1HG   LYS  11          1HG       LYS  11   1.369  16.621  -3.926
   75   2HG   LYS  11          2HG       LYS  11   0.132  17.332  -4.990
   76   1HD   LYS  11          1HD       LYS  11  -0.641  18.790  -3.180
   77   2HD   LYS  11          2HD       LYS  11   0.483  18.024  -2.036
   78   1HE   LYS  11          1HE       LYS  11   2.410  18.818  -3.345
   79   2HE   LYS  11          2HE       LYS  11   1.324  19.538  -4.550
   80   1HZ   LYS  11          1HZ       LYS  11   1.462  20.313  -1.715
   81   2HZ   LYS  11          2HZ       LYS  11   2.132  21.138  -2.976
   82   3HZ   LYS  11          3HZ       LYS  11   0.495  20.992  -2.864
   83    H    TYR  12           H        TYR  12   1.073  14.919  -6.127
   84    HA   TYR  12           HA       TYR  12   2.492  12.514  -5.510
   85   1HB   TYR  12          1HB       TYR  12   2.555  13.704  -7.697
   86   2HB   TYR  12          2HB       TYR  12   3.528  14.970  -6.941
   87    HD1  TYR  12           HD1      TYR  12   3.375  11.279  -7.595
   88    HD2  TYR  12           HD2      TYR  12   5.927  14.640  -6.718
   89    HE1  TYR  12           HE1      TYR  12   5.354   9.830  -7.839
   90    HE2  TYR  12           HE2      TYR  12   7.919  13.187  -7.010
   91    HH   TYR  12           HH       TYR  12   7.603   9.690  -7.352
   92    H    ASP  13           H        ASP  13   4.155  12.175  -4.021
   93    HA   ASP  13           HA       ASP  13   5.290  14.491  -2.548
   94   1HB   ASP  13          1HB       ASP  13   3.379  13.814  -1.171
   95   2HB   ASP  13          2HB       ASP  13   3.834  12.103  -1.336
   96    H    SER  14           H        SER  14   7.390  14.013  -1.784
   97    HA   SER  14           HA       SER  14   8.747  11.860  -3.123
   98   1HB   SER  14          1HB       SER  14   9.783  13.663  -0.916
   99   2HB   SER  14          2HB       SER  14  10.714  12.820  -2.168
  100    HG   SER  14           HG       SER  14   9.532  14.132  -3.714
  101    H    CYS  15           H        CYS  15   6.800  10.519  -1.601
  102    HA   CYS  15           HA       CYS  15   8.453   8.811  -0.067
  103   1HB   CYS  15          1HB       CYS  15   7.731  10.900   1.484
  104   2HB   CYS  15          2HB       CYS  15   6.267   9.943   1.676
  105    H    GLY  16           H        GLY  16   6.797   7.226   1.244
  106   1HA   GLY  16          1HA       GLY  16   5.738   5.723  -0.878
  107   2HA   GLY  16          2HA       GLY  16   5.569   5.355   0.842
  108    H    SER  17           H        SER  17   3.682   5.110  -1.477
  109    HA   SER  17           HA       SER  17   1.864   6.946  -1.836
  110   1HB   SER  17          1HB       SER  17   1.027   4.051  -1.642
  111   2HB   SER  17          2HB       SER  17   0.640   5.264  -2.887
  112    HG   SER  17           HG       SER  17   2.265   3.792  -3.593
  113    H    LYS  18           H        LYS  18   1.707   4.752   0.973
  114    HA   LYS  18           HA       LYS  18  -0.159   6.678   2.218
  115   1HB   LYS  18          1HB       LYS  18  -0.716   3.671   2.305
  116   2HB   LYS  18          2HB       LYS  18  -1.483   4.941   3.271
  117   1HG   LYS  18          1HG       LYS  18  -3.066   4.699   1.660
  118   2HG   LYS  18          2HG       LYS  18  -2.114   6.035   1.022
  119   1HD   LYS  18          1HD       LYS  18  -0.824   4.110  -0.286
  120   2HD   LYS  18          2HD       LYS  18  -2.171   3.094   0.176
  121   1HE   LYS  18          1HE       LYS  18  -2.317   4.077  -2.134
  122   2HE   LYS  18          2HE       LYS  18  -3.720   4.431  -1.128
  123   1HZ   LYS  18          1HZ       LYS  18  -1.471   6.306  -1.453
  124   2HZ   LYS  18          2HZ       LYS  18  -2.816   6.331  -2.413
  125   3HZ   LYS  18          3HZ       LYS  18  -2.949   6.599  -0.800
  126    H    GLU  19           H        GLU  19   2.499   6.742   2.429
  127    HA   GLU  19           HA       GLU  19   3.392   5.238   4.719
  128   1HB   GLU  19          1HB       GLU  19   4.776   6.278   2.946
  129   2HB   GLU  19          2HB       GLU  19   4.533   7.868   3.672
  130   1HG   GLU  19          1HG       GLU  19   5.875   7.345   5.537
  131   2HG   GLU  19          2HG       GLU  19   5.505   5.612   5.450
  132    H    CYS  20           H        CYS  20   4.251   6.827   6.655
  133    HA   CYS  20           HA       CYS  20   1.747   7.270   7.967
  134   1HB   CYS  20          1HB       CYS  20   4.334   7.807   9.368
  135   2HB   CYS  20          2HB       CYS  20   2.827   7.098   9.941
  136    H    ASP  21           H        ASP  21   1.406   9.076   6.299
  137    HA   ASP  21           HA       ASP  21   2.165  11.764   7.310
  138   1HB   ASP  21          1HB       ASP  21   2.316  11.159   4.875
  139   2HB   ASP  21          2HB       ASP  21   0.576  10.917   4.844
  140    H    LYS  22           H        LYS  22  -0.223  13.088   6.808
  141    HA   LYS  22           HA       LYS  22  -1.518  12.984   9.183
  142   1HB   LYS  22          1HB       LYS  22  -2.541  13.904   6.486
  143   2HB   LYS  22          2HB       LYS  22  -3.332  14.270   8.015
  144   1HG   LYS  22          1HG       LYS  22  -1.439  15.433   8.880
  145   2HG   LYS  22          2HG       LYS  22  -0.435  15.066   7.482
  146   1HD   LYS  22          1HD       LYS  22  -3.067  16.524   7.075
  147   2HD   LYS  22          2HD       LYS  22  -1.681  17.389   7.739
  148   1HE   LYS  22          1HE       LYS  22  -1.723  17.732   5.355
  149   2HE   LYS  22          2HE       LYS  22  -0.290  16.795   5.790
  150   1HZ   LYS  22          1HZ       LYS  22  -2.778  15.661   4.702
  151   2HZ   LYS  22          2HZ       LYS  22  -1.397  15.943   3.848
  152   3HZ   LYS  22          3HZ       LYS  22  -1.397  14.835   5.058
  153    H    LYS  23           H        LYS  23  -2.198  11.058  10.006
  154    HA   LYS  23           HA       LYS  23  -4.332   9.445   8.777
  155   1HB   LYS  23          1HB       LYS  23  -3.323   9.517  11.663
  156   2HB   LYS  23          2HB       LYS  23  -4.303   8.260  10.904
  157   1HG   LYS  23          1HG       LYS  23  -1.381   8.910  10.361
  158   2HG   LYS  23          2HG       LYS  23  -2.081   7.461  11.095
  159   1HD   LYS  23          1HD       LYS  23  -3.336   7.135   8.823
  160   2HD   LYS  23          2HD       LYS  23  -2.294   8.444   8.228
  161   1HE   LYS  23          1HE       LYS  23  -1.198   6.354   7.641
  162   2HE   LYS  23          2HE       LYS  23  -0.287   7.113   8.956
  163   1HZ   LYS  23          1HZ       LYS  23  -1.541   5.634  10.472
  164   2HZ   LYS  23          2HZ       LYS  23  -2.147   4.844   9.155
  165   3HZ   LYS  23          3HZ       LYS  23  -0.532   4.858   9.438
  166    H    CYS  24           H        CYS  24  -6.428   9.210   9.835
  167    HA   CYS  24           HA       CYS  24  -7.574  11.766  10.755
  168   1HB   CYS  24          1HB       CYS  24  -9.069  10.463   9.469
  169   2HB   CYS  24          2HB       CYS  24  -8.628   8.966  10.319
  170    H    LYS  25           H        LYS  25  -7.967  12.253  12.863
  171    HA   LYS  25           HA       LYS  25  -6.874  10.692  15.048
  172   1HB   LYS  25          1HB       LYS  25  -7.981  12.498  16.452
  173   2HB   LYS  25          2HB       LYS  25  -6.704  12.949  15.337
  174   1HG   LYS  25          1HG       LYS  25  -8.286  14.670  15.311
  175   2HG   LYS  25          2HG       LYS  25  -8.299  13.911  13.746
  176   1HD   LYS  25          1HD       LYS  25 -10.547  14.387  14.259
  177   2HD   LYS  25          2HD       LYS  25 -10.427  12.646  14.535
  178   1HE   LYS  25          1HE       LYS  25 -10.263  13.014  16.964
  179   2HE   LYS  25          2HE       LYS  25 -10.228  14.771  16.722
  180   1HZ   LYS  25          1HZ       LYS  25 -12.450  13.010  15.975
  181   2HZ   LYS  25          2HZ       LYS  25 -12.394  13.973  17.312
  182   3HZ   LYS  25          3HZ       LYS  25 -12.413  14.649  15.810
  183    H    TYR  26           H        TYR  26  -8.345   8.850  13.873
  184    HA   TYR  26           HA       TYR  26 -11.073   8.668  14.845
  185   1HB   TYR  26          1HB       TYR  26  -9.067   6.720  13.665
  186   2HB   TYR  26          2HB       TYR  26 -10.579   6.140  14.308
  187    HD1  TYR  26           HD1      TYR  26 -12.637   8.017  13.351
  188    HD2  TYR  26           HD2      TYR  26  -9.151   6.410  11.360
  189    HE1  TYR  26           HE1      TYR  26 -13.759   8.258  11.191
  190    HE2  TYR  26           HE2      TYR  26 -10.301   6.674   9.188
  191    HH   TYR  26           HH       TYR  26 -13.671   7.599   8.907
  192    H    ASP  27           H        ASP  27  -7.924   7.523  15.938
  193    HA   ASP  27           HA       ASP  27  -7.217   6.254  17.624
  194   1HB   ASP  27          1HB       ASP  27  -7.369   8.426  18.709
  195   2HB   ASP  27          2HB       ASP  27  -8.988   8.069  19.305
  196    H    GLY  28           H        GLY  28 -10.311   6.560  19.339
  197   1HA   GLY  28          1HA       GLY  28 -10.729   3.855  19.871
  198   2HA   GLY  28          2HA       GLY  28 -12.015   5.077  19.684
  199    H    VAL  29           H        VAL  29 -11.886   5.760  17.044
  200    HA   VAL  29           HA       VAL  29 -13.241   3.466  15.879
  201    HB   VAL  29           HB       VAL  29 -12.700   6.290  14.932
  202   1HG1  VAL  29          1HG1      VAL  29 -14.242   4.084  13.508
  203   2HG1  VAL  29          2HG1      VAL  29 -14.471   5.817  13.185
  204   3HG1  VAL  29          3HG1      VAL  29 -12.916   5.064  12.853
  205   1HG2  VAL  29          1HG2      VAL  29 -14.267   6.027  16.799
  206   2HG2  VAL  29          2HG2      VAL  29 -15.110   6.530  15.332
  207   3HG2  VAL  29          3HG2      VAL  29 -15.201   4.841  15.867
  208    H    GLU  30           H        GLU  30  -9.962   3.914  16.165
  209    HA   GLU  30           HA       GLU  30  -9.565   2.045  13.895
  210   1HB   GLU  30          1HB       GLU  30  -7.404   3.006  13.388
  211   2HB   GLU  30          2HB       GLU  30  -8.689   4.192  13.146
  212   1HG   GLU  30          1HG       GLU  30  -8.158   5.099  15.444
  213   2HG   GLU  30          2HG       GLU  30  -6.731   4.043  15.477
  214    H    GLU  31           H        GLU  31 -10.130   1.819  16.881
  215    HA   GLU  31           HA       GLU  31  -7.730   0.620  17.973
  216   1HB   GLU  31          1HB       GLU  31  -9.077  -0.110  19.757
  217   2HB   GLU  31          2HB       GLU  31  -9.659   1.494  19.308
  218   1HG   GLU  31          1HG       GLU  31 -11.520   0.290  17.981
  219   2HG   GLU  31          2HG       GLU  31 -10.968  -1.195  18.756
  220    H    GLU  32           H        GLU  32 -10.279  -0.334  15.813
  221    HA   GLU  32           HA       GLU  32  -9.714  -3.165  15.708
  222   1HB   GLU  32          1HB       GLU  32 -10.988  -3.044  13.575
  223   2HB   GLU  32          2HB       GLU  32 -11.869  -2.484  14.991
  224   1HG   GLU  32          1HG       GLU  32 -10.448  -0.407  13.304
  225   2HG   GLU  32          2HG       GLU  32 -11.901  -1.170  12.667
  226    H    ASP  33           H        ASP  33  -7.324  -2.493  15.838
  227    HA   ASP  33           HA       ASP  33  -5.845  -1.687  13.573
  228   1HB   ASP  33          1HB       ASP  33  -3.957  -2.476  14.743
  229   2HB   ASP  33          2HB       ASP  33  -5.090  -1.895  15.978
  230    H    ASP  34           H        ASP  34  -7.555  -4.604  14.214
  231    HA   ASP  34           HA       ASP  34  -6.562  -6.572  12.588
  232   1HB   ASP  34          1HB       ASP  34  -9.460  -5.617  12.645
  233   2HB   ASP  34          2HB       ASP  34  -8.888  -7.237  12.232
  234    H    GLU  35           H        GLU  35  -7.949  -3.452  11.571
  235    HA   GLU  35           HA       GLU  35  -8.056  -4.002   8.729
  236   1HB   GLU  35          1HB       GLU  35  -7.681  -1.432  10.324
  237   2HB   GLU  35          2HB       GLU  35  -7.989  -1.501   8.583
  238   1HG   GLU  35          1HG       GLU  35  -9.891  -2.541  10.748
  239   2HG   GLU  35          2HG       GLU  35 -10.037  -1.003   9.897
  240    H    GLU  36           H        GLU  36  -6.060  -5.296   8.729
  241    HA   GLU  36           HA       GLU  36  -3.602  -4.595   9.441
  242   1HB   GLU  36          1HB       GLU  36  -4.153  -6.137   6.875
  243   2HB   GLU  36          2HB       GLU  36  -2.647  -6.103   7.798
  244   1HG   GLU  36          1HG       GLU  36  -3.956  -6.980   9.800
  245   2HG   GLU  36          2HG       GLU  36  -5.327  -7.230   8.704
  246    HA   PRO  37           HA       PRO  37  -2.165  -2.108   5.794
  247   1HB   PRO  37          1HB       PRO  37  -3.593  -1.370   3.688
  248   2HB   PRO  37          2HB       PRO  37  -3.102  -3.077   3.939
  249   1HG   PRO  37          1HG       PRO  37  -5.792  -1.813   4.591
  250   2HG   PRO  37          2HG       PRO  37  -5.498  -3.321   3.680
  251   1HD   PRO  37          1HD       PRO  37  -6.044  -3.218   6.388
  252   2HD   PRO  37          2HD       PRO  37  -5.071  -4.516   5.641
  253    H    ASN  38           H        ASN  38  -1.719   0.047   5.789
  254    HA   ASN  38           HA       ASN  38  -1.809   2.231   6.017
  255   1HB   ASN  38          1HB       ASN  38  -3.363   2.154   4.229
  256   2HB   ASN  38          2HB       ASN  38  -4.717   1.920   5.312
  257   1HD2  ASN  38          2HD2      ASN  38  -2.693   4.321   6.828
  258   2HD2  ASN  38          1HD2      ASN  38  -3.563   5.681   6.149
  259    H    VAL  39           H        VAL  39  -4.605   0.915   7.945
  260    HA   VAL  39           HA       VAL  39  -4.546   2.948   9.894
  261    HB   VAL  39           HB       VAL  39  -5.297   0.021  10.175
  262   1HG1  VAL  39          1HG1      VAL  39  -5.535   2.295  12.186
  263   2HG1  VAL  39          2HG1      VAL  39  -6.411   0.752  12.303
  264   3HG1  VAL  39          3HG1      VAL  39  -4.651   0.772  12.415
  265   1HG2  VAL  39          1HG2      VAL  39  -6.886   2.591   9.954
  266   2HG2  VAL  39          2HG2      VAL  39  -6.744   1.317   8.716
  267   3HG2  VAL  39          3HG2      VAL  39  -7.574   0.983  10.240
  268    HA   PRO  40           HA       PRO  40  -0.905   0.990  12.213
  269   1HB   PRO  40          1HB       PRO  40   0.231  -1.384  11.559
  270   2HB   PRO  40          2HB       PRO  40  -1.337  -1.318  12.398
  271   1HG   PRO  40          1HG       PRO  40  -0.930  -1.526   9.376
  272   2HG   PRO  40          2HG       PRO  40  -1.830  -2.659  10.431
  273   1HD   PRO  40          1HD       PRO  40  -3.107  -0.679   9.148
  274   2HD   PRO  40          2HD       PRO  40  -3.513  -1.070  10.846
  275    H    CYS  41           H        CYS  41  -0.947   2.624   9.850
  276    HA   CYS  41           HA       CYS  41   0.125   3.483   8.100
  277   1HB   CYS  41          1HB       CYS  41   1.549   4.297   9.862
  278   2HB   CYS  41          2HB       CYS  41   2.572   2.853   9.767
  279    H    LEU  42           H        LEU  42   2.272   0.697   8.801
  280    HA   LEU  42           HA       LEU  42   3.005  -0.988   7.611
  281   1HB   LEU  42          1HB       LEU  42   0.628  -1.407   7.202
  282   2HB   LEU  42          2HB       LEU  42   0.685  -0.440   5.724
  283    HG   LEU  42           HG       LEU  42   2.312  -2.018   4.721
  284   1HD1  LEU  42          1HD1      LEU  42   1.819  -3.631   7.270
  285   2HD1  LEU  42          2HD1      LEU  42   2.561  -4.276   5.790
  286   3HD1  LEU  42          3HD1      LEU  42   3.381  -3.004   6.693
  287   1HD2  LEU  42          1HD2      LEU  42  -0.135  -2.241   4.357
  288   2HD2  LEU  42          2HD2      LEU  42   0.707  -3.799   4.298
  289   3HD2  LEU  42          3HD2      LEU  42  -0.217  -3.357   5.746
  290    H    VAL  43           H        VAL  43   2.154   1.535   5.197
  291    HA   VAL  43           HA       VAL  43   4.178   0.584   3.353
  292    HB   VAL  43           HB       VAL  43   2.503   3.106   3.153
  293   1HG1  VAL  43          1HG1      VAL  43   3.717   1.289   1.024
  294   2HG1  VAL  43          2HG1      VAL  43   2.660   2.675   0.710
  295   3HG1  VAL  43          3HG1      VAL  43   4.253   2.939   1.404
  296   1HG2  VAL  43          1HG2      VAL  43   1.770   0.243   2.411
  297   2HG2  VAL  43          2HG2      VAL  43   0.924   1.292   3.572
  298   3HG2  VAL  43          3HG2      VAL  43   0.888   1.681   1.858
  299    H    ARG  44           H        ARG  44   5.719   1.004   5.398
  300    HA   ARG  44           HA       ARG  44   6.873   3.724   5.470
  301   1HB   ARG  44          1HB       ARG  44   7.690   1.121   6.769
  302   2HB   ARG  44          2HB       ARG  44   8.483   2.668   7.044
  303   1HG   ARG  44          1HG       ARG  44   6.837   3.500   8.378
  304   2HG   ARG  44          2HG       ARG  44   5.527   2.772   7.444
  305   1HD   ARG  44          1HD       ARG  44   7.332   1.258   9.357
  306   2HD   ARG  44          2HD       ARG  44   5.668   1.788   9.702
  307    HE   ARG  44           HE       ARG  44   5.426   0.390   7.342
  308   1HH1  ARG  44          1HH1      ARG  44   6.628  -0.495  10.544
  309   2HH1  ARG  44          2HH1      ARG  44   6.486  -2.208  10.255
  310   1HH2  ARG  44          1HH2      ARG  44   5.254  -1.709   6.941
  311   2HH2  ARG  44          2HH2      ARG  44   5.656  -2.945   8.125
  312    H    VAL  45           H        VAL  45   6.921   3.252   2.961
  313    HA   VAL  45           HA       VAL  45   9.708   2.457   2.239
  314    HB   VAL  45           HB       VAL  45   8.714   1.515   0.108
  315   1HG1  VAL  45          1HG1      VAL  45   9.779   0.138   1.860
  316   2HG1  VAL  45          2HG1      VAL  45   8.221  -0.007   2.701
  317   3HG1  VAL  45          3HG1      VAL  45   8.434  -0.718   1.089
  318   1HG2  VAL  45          1HG2      VAL  45   6.329   2.247   0.388
  319   2HG2  VAL  45          2HG2      VAL  45   6.498   0.504   0.188
  320   3HG2  VAL  45          3HG2      VAL  45   6.196   1.173   1.797
  321    H    CYS  46           H        CYS  46  10.296   4.566   2.193
  322    HA   CYS  46           HA       CYS  46   8.626   6.611   1.132
  323   1HB   CYS  46          1HB       CYS  46  10.311   6.697   3.039
  324   2HB   CYS  46          2HB       CYS  46  11.551   6.896   1.799
  325    H    HIS  47           H        HIS  47   8.489   5.238  -0.981
  326    HA   HIS  47           HA       HIS  47  10.703   5.817  -2.862
  327   1HB   HIS  47          1HB       HIS  47   9.859   3.993  -4.135
  328   2HB   HIS  47          2HB       HIS  47  10.033   3.505  -2.447
  329    HD1  HIS  47           HD1      HIS  47   7.106   5.008  -4.497
  330    HD2  HIS  47           HD2      HIS  47   8.065   1.833  -1.934
  331    HE1  HIS  47           HE1      HIS  47   4.964   3.706  -4.141
  332    H    GLN  48           H        GLN  48   8.930   7.964  -2.209
  333    HA   GLN  48           HA       GLN  48   7.768   9.634  -3.263
  334   1HB   GLN  48          1HB       GLN  48   8.891  10.446  -5.254
  335   2HB   GLN  48          2HB       GLN  48  10.001   9.984  -3.969
  336   1HG   GLN  48          1HG       GLN  48  10.623   7.931  -5.070
  337   2HG   GLN  48          2HG       GLN  48   9.427   8.145  -6.339
  338   1HE2  GLN  48          2HE2      GLN  48   9.668  10.532  -7.429
  339   2HE2  GLN  48          1HE2      GLN  48  11.334  10.896  -7.864
  340    H    ASP  49           H        ASP  49   5.719   8.584  -3.275
  341    HA   ASP  49           HA       ASP  49   4.678   8.014  -6.039
  342   1HB   ASP  49          1HB       ASP  49   4.792   6.125  -4.255
  343   2HB   ASP  49          2HB       ASP  49   3.458   6.967  -3.477
  344    H    CYS  50           H        CYS  50   1.856   8.153  -4.925
  345    HA   CYS  50           HA       CYS  50   1.742  11.038  -4.196
  346   1HB   CYS  50          1HB       CYS  50  -0.531   9.512  -5.483
  347   2HB   CYS  50          2HB       CYS  50  -0.389  11.238  -5.155
  348    H    VAL  51           H        VAL  51   0.382  11.612  -2.541
  349    HA   VAL  51           HA       VAL  51  -0.720   9.414  -0.849
  350    HB   VAL  51           HB       VAL  51   0.252  10.409   1.107
  351   1HG1  VAL  51          1HG1      VAL  51   1.718   8.878  -0.175
  352   2HG1  VAL  51          2HG1      VAL  51   2.488  10.265  -0.954
  353   3HG1  VAL  51          3HG1      VAL  51   2.620  10.048   0.800
  354   1HG2  VAL  51          1HG2      VAL  51   1.374  12.589  -0.710
  355   2HG2  VAL  51          2HG2      VAL  51   0.172  12.809   0.572
  356   3HG2  VAL  51          3HG2      VAL  51   1.825  12.357   0.990
  357    H    CYS  52           H        CYS  52  -2.479  10.271   0.619
  358    HA   CYS  52           HA       CYS  52  -4.292  11.945  -0.699
  359   1HB   CYS  52          1HB       CYS  52  -4.102  11.575   2.291
  360   2HB   CYS  52          2HB       CYS  52  -5.443  12.285   1.407
  361    H    GLU  53           H        GLU  53  -4.442  14.019  -1.042
  362    HA   GLU  53           HA       GLU  53  -2.200  15.651  -0.876
  363   1HB   GLU  53          1HB       GLU  53  -3.870  15.777  -2.603
  364   2HB   GLU  53          2HB       GLU  53  -5.134  16.231  -1.466
  365   1HG   GLU  53          1HG       GLU  53  -4.183  18.430  -1.149
  366   2HG   GLU  53          2HG       GLU  53  -2.705  17.986  -2.018
  367    H    GLU  54           H        GLU  54  -1.925  17.772   0.099
  368    HA   GLU  54           HA       GLU  54  -2.175  17.830   2.904
  369   1HB   GLU  54          1HB       GLU  54  -1.841  20.104   0.905
  370   2HB   GLU  54          2HB       GLU  54  -1.606  20.251   2.653
  371   1HG   GLU  54          1HG       GLU  54   0.212  18.597   2.604
  372   2HG   GLU  54          2HG       GLU  54  -0.016  18.334   0.871
  373    H    GLY  55           H        GLY  55  -3.862  18.291   4.225
  374   1HA   GLY  55          1HA       GLY  55  -5.811  19.480   4.900
  375   2HA   GLY  55          2HA       GLY  55  -6.243  19.792   3.217
  376    H    PHE  56           H        PHE  56  -5.440  16.822   2.645
  377    HA   PHE  56           HA       PHE  56  -8.006  15.585   3.462
  378   1HB   PHE  56          1HB       PHE  56  -6.087  14.810   1.244
  379   2HB   PHE  56          2HB       PHE  56  -7.614  14.050   1.631
  380    HD1  PHE  56           HD1      PHE  56  -6.109  17.312   0.482
  381    HD2  PHE  56           HD2      PHE  56  -9.651  14.873   0.694
  382    HE1  PHE  56           HE1      PHE  56  -7.248  18.829  -1.095
  383    HE2  PHE  56           HE2      PHE  56 -10.811  16.423  -0.850
  384    HZ   PHE  56           HZ       PHE  56  -9.600  18.388  -1.776
  385    H    TYR  57           H        TYR  57  -7.878  13.369   4.224
  386    HA   TYR  57           HA       TYR  57  -5.304  12.771   5.655
  387   1HB   TYR  57          1HB       TYR  57  -8.224  12.420   6.438
  388   2HB   TYR  57          2HB       TYR  57  -6.872  11.701   7.307
  389    HD1  TYR  57           HD1      TYR  57  -8.513  14.931   6.442
  390    HD2  TYR  57           HD2      TYR  57  -5.363  12.995   8.643
  391    HE1  TYR  57           HE1      TYR  57  -7.886  17.101   7.440
  392    HE2  TYR  57           HE2      TYR  57  -4.914  15.127   9.859
  393    HH   TYR  57           HH       TYR  57  -6.561  18.180   8.990
  394    H    ARG  58           H        ARG  58  -4.531  10.694   5.524
  395    HA   ARG  58           HA       ARG  58  -5.991   8.733   3.800
  396   1HB   ARG  58          1HB       ARG  58  -4.037   7.319   4.126
  397   2HB   ARG  58          2HB       ARG  58  -3.617   8.861   3.390
  398   1HG   ARG  58          1HG       ARG  58  -3.348   8.980   6.322
  399   2HG   ARG  58          2HG       ARG  58  -2.430   7.642   5.627
  400   1HD   ARG  58          1HD       ARG  58  -0.987   9.482   5.719
  401   2HD   ARG  58          2HD       ARG  58  -1.380   9.216   4.021
  402    HE   ARG  58           HE       ARG  58  -2.771  11.266   5.752
  403   1HH1  ARG  58          1HH1      ARG  58  -0.746  10.742   2.864
  404   2HH1  ARG  58          2HH1      ARG  58  -1.289  12.245   2.126
  405   1HH2  ARG  58          1HH2      ARG  58  -3.444  13.251   4.631
  406   2HH2  ARG  58          2HH2      ARG  58  -2.688  13.583   3.096
  407    H    ASN  59           H        ASN  59  -7.672   9.282   5.439
  408    HA   ASN  59           HA       ASN  59  -7.737   9.174   8.016
  409   1HB   ASN  59          1HB       ASN  59 -10.064   8.690   7.974
  410   2HB   ASN  59          2HB       ASN  59  -9.645   9.627   6.546
  411   1HD2  ASN  59          2HD2      ASN  59 -11.983   7.825   7.076
  412   2HD2  ASN  59          1HD2      ASN  59 -11.959   6.766   5.675
  413    H    LYS  60           H        LYS  60  -8.230   6.100   6.300
  414    HA   LYS  60           HA       LYS  60  -6.980   4.604   8.491
  415   1HB   LYS  60          1HB       LYS  60  -8.873   3.052   8.747
  416   2HB   LYS  60          2HB       LYS  60  -9.196   4.672   9.344
  417   1HG   LYS  60          1HG       LYS  60 -10.556   5.105   7.231
  418   2HG   LYS  60          2HG       LYS  60 -10.280   3.434   6.749
  419   1HD   LYS  60          1HD       LYS  60 -11.271   2.625   8.871
  420   2HD   LYS  60          2HD       LYS  60 -11.598   4.286   9.373
  421   1HE   LYS  60          1HE       LYS  60 -12.757   2.944   6.883
  422   2HE   LYS  60          2HE       LYS  60 -13.588   3.116   8.437
  423   1HZ   LYS  60          1HZ       LYS  60 -13.444   5.483   8.215
  424   2HZ   LYS  60          2HZ       LYS  60 -12.659   5.341   6.776
  425   3HZ   LYS  60          3HZ       LYS  60 -14.218   4.827   6.920
  426    H    ASP  61           H        ASP  61  -8.804   4.434   5.434
  427    HA   ASP  61           HA       ASP  61  -6.734   2.642   4.290
  428   1HB   ASP  61          1HB       ASP  61  -8.444   1.126   5.129
  429   2HB   ASP  61          2HB       ASP  61  -9.715   2.073   4.345
  430    H    ASP  62           H        ASP  62  -6.294   4.846   3.664
  431    HA   ASP  62           HA       ASP  62  -6.289   6.654   2.329
  432   1HB   ASP  62          1HB       ASP  62  -5.296   4.620   1.130
  433   2HB   ASP  62          2HB       ASP  62  -6.775   4.570   0.168
  434    H    LYS  63           H        LYS  63  -9.000   6.589   3.336
  435    HA   LYS  63           HA       LYS  63 -10.612   7.280   0.937
  436   1HB   LYS  63          1HB       LYS  63 -11.421   7.778   3.792
  437   2HB   LYS  63          2HB       LYS  63 -12.404   7.695   2.357
  438   1HG   LYS  63          1HG       LYS  63 -10.996   5.323   3.698
  439   2HG   LYS  63          2HG       LYS  63 -12.723   5.685   3.687
  440   1HD   LYS  63          1HD       LYS  63 -12.694   5.597   1.144
  441   2HD   LYS  63          2HD       LYS  63 -11.034   4.990   1.237
  442   1HE   LYS  63          1HE       LYS  63 -13.499   3.627   2.412
  443   2HE   LYS  63          2HE       LYS  63 -12.630   3.169   0.936
  444   1HZ   LYS  63          1HZ       LYS  63 -10.660   2.866   2.321
  445   2HZ   LYS  63          2HZ       LYS  63 -11.580   3.103   3.664
  446   3HZ   LYS  63          3HZ       LYS  63 -11.884   1.816   2.679
  447    H    CYS  64           H        CYS  64  -9.257   8.900   0.054
  448    HA   CYS  64           HA       CYS  64  -8.089  10.959   1.713
  449   1HB   CYS  64          1HB       CYS  64  -8.394  10.937  -1.301
  450   2HB   CYS  64          2HB       CYS  64  -7.370  11.998  -0.337
  451    H    VAL  65           H        VAL  65 -10.084  11.494   2.795
  452    HA   VAL  65           HA       VAL  65 -11.423  13.850   1.529
  453    HB   VAL  65           HB       VAL  65 -13.281  13.285   3.252
  454   1HG1  VAL  65          1HG1      VAL  65 -12.926  11.665   0.698
  455   2HG1  VAL  65          2HG1      VAL  65 -14.460  11.945   1.550
  456   3HG1  VAL  65          3HG1      VAL  65 -13.593  13.307   0.820
  457   1HG2  VAL  65          1HG2      VAL  65 -12.043  11.326   4.302
  458   2HG2  VAL  65          2HG2      VAL  65 -13.662  10.928   3.669
  459   3HG2  VAL  65          3HG2      VAL  65 -12.246  10.457   2.760
  460    H    SER  66           H        SER  66 -12.137  15.401   3.324
  461    HA   SER  66           HA       SER  66  -9.692  15.931   4.843
  462   1HB   SER  66          1HB       SER  66 -10.825  17.686   3.489
  463   2HB   SER  66          2HB       SER  66 -12.159  17.668   4.661
  464    HG   SER  66           HG       SER  66  -9.404  18.276   5.082
  465    H    ALA  67           H        ALA  67 -10.326  17.208   6.986
  466    HA   ALA  67           HA       ALA  67 -10.655  15.172   8.906
  467   1HB   ALA  67          1HB       ALA  67  -9.399  17.205   9.384
  468   2HB   ALA  67          2HB       ALA  67 -10.893  18.172   9.308
  469   3HB   ALA  67          3HB       ALA  67 -10.667  16.957  10.590
  470    H    GLU  68           H        GLU  68 -12.967  17.151   7.307
  471    HA   GLU  68           HA       GLU  68 -15.303  17.064   8.820
  472   1HB   GLU  68          1HB       GLU  68 -15.053  16.458   5.831
  473   2HB   GLU  68          2HB       GLU  68 -16.460  17.103   6.681
  474   1HG   GLU  68          1HG       GLU  68 -15.165  19.172   7.213
  475   2HG   GLU  68          2HG       GLU  68 -13.769  18.541   6.323
  476    H    ASP  69           H        ASP  69 -13.994  14.537   6.594
  477    HA   ASP  69           HA       ASP  69 -16.063  12.590   7.158
  478   1HB   ASP  69          1HB       ASP  69 -14.728  12.372   5.138
  479   2HB   ASP  69          2HB       ASP  69 -13.219  12.284   6.076
  480    H    CYS  70           H        CYS  70 -12.709  13.073   8.231
  481    HA   CYS  70           HA       CYS  70 -12.356  10.878   9.839
  482   1HB   CYS  70          1HB       CYS  70 -10.563  12.470   9.386
  483   2HB   CYS  70          2HB       CYS  70 -11.413  13.735  10.297
  484    H    GLU  71           H        GLU  71 -13.745  14.012  10.862
  485    HA   GLU  71           HA       GLU  71 -14.310  13.139  13.553
  486   1HB   GLU  71          1HB       GLU  71 -13.866  15.485  12.870
  487   2HB   GLU  71          2HB       GLU  71 -15.404  15.522  11.991
  488   1HG   GLU  71          1HG       GLU  71 -16.638  15.150  14.096
  489   2HG   GLU  71          2HG       GLU  71 -15.116  14.950  14.981
  490    H    LEU  72           H        LEU  72 -16.405  13.680  10.632
  491    HA   LEU  72           HA       LEU  72 -18.810  13.073  12.046
  492   1HB   LEU  72          1HB       LEU  72 -18.144  13.030   9.083
  493   2HB   LEU  72          2HB       LEU  72 -19.780  12.842   9.715
  494    HG   LEU  72           HG       LEU  72 -18.071  15.302  10.302
  495   1HD1  LEU  72          1HD1      LEU  72 -18.460  15.076   7.866
  496   2HD1  LEU  72          2HD1      LEU  72 -20.203  14.897   8.161
  497   3HD1  LEU  72          3HD1      LEU  72 -19.384  16.425   8.549
  498   1HD2  LEU  72          1HD2      LEU  72 -21.057  14.746  10.586
  499   2HD2  LEU  72          2HD2      LEU  72 -19.903  14.998  11.914
  500   3HD2  LEU  72          3HD2      LEU  72 -20.279  16.324  10.814
  501    H    ASP  73           H        ASP  73 -16.563  10.976  10.309
  502    HA   ASP  73           HA       ASP  73 -18.373   8.722  10.161
  503   1HB   ASP  73          1HB       ASP  73 -16.647   9.188   8.476
  504   2HB   ASP  73          2HB       ASP  73 -15.382   8.982   9.696
  505    H    ASN  74           H        ASN  74 -18.650   9.254  12.660
  506    HA   ASN  74           HA       ASN  74 -16.765   7.886  14.440
  507   1HB   ASN  74          1HB       ASN  74 -17.904   9.901  15.186
  508   2HB   ASN  74          2HB       ASN  74 -19.488   9.164  14.912
  509   1HD2  ASN  74          2HD2      ASN  74 -19.893   7.073  16.132
  510   2HD2  ASN  74          1HD2      ASN  74 -19.307   6.928  17.775
  511    H    MET  75           H        MET  75 -16.791   5.772  13.522
  512    HA   MET  75           HA       MET  75 -19.092   4.224  13.005
  513   1HB   MET  75          1HB       MET  75 -16.334   3.334  13.956
  514   2HB   MET  75          2HB       MET  75 -17.581   2.249  13.336
  515   1HG   MET  75          1HG       MET  75 -16.301   4.504  11.738
  516   2HG   MET  75          2HG       MET  75 -15.884   2.790  11.661
  517   1HE   MET  75          1HE       MET  75 -16.324   4.232   9.087
  518   2HE   MET  75          2HE       MET  75 -16.181   2.459   9.116
  519   3HE   MET  75          3HE       MET  75 -17.499   3.231   8.201
  520    H    ASP  76           H        ASP  76 -17.021   3.843  15.878
  521    HA   ASP  76           HA       ASP  76 -19.376   2.910  17.477
  522   1HB   ASP  76          1HB       ASP  76 -17.576   1.315  17.437
  523   2HB   ASP  76          2HB       ASP  76 -16.368   2.539  17.828
  524    H    PHE  77           H        PHE  77 -16.310   4.529  18.373
  525    HA   PHE  77           HA       PHE  77 -17.607   7.018  19.031
  526   1HB   PHE  77          1HB       PHE  77 -18.268   5.516  20.960
  527   2HB   PHE  77          2HB       PHE  77 -16.560   5.420  21.357
  528    HD1  PHE  77           HD1      PHE  77 -15.341   7.485  22.093
  529    HD2  PHE  77           HD2      PHE  77 -19.561   7.566  21.253
  530    HE1  PHE  77           HE1      PHE  77 -15.480   9.771  23.040
  531    HE2  PHE  77           HE2      PHE  77 -19.718   9.820  22.274
  532    HZ   PHE  77           HZ       PHE  77 -17.677  10.930  23.163
  533    H    ILE  78           H        ILE  78 -16.054   8.482  18.499
  534    HA   ILE  78           HA       ILE  78 -13.235   7.765  18.314
  535    HB   ILE  78           HB       ILE  78 -14.639  10.455  18.174
  536   1HG1  ILE  78          1HG1      ILE  78 -13.509   8.612  16.005
  537   2HG1  ILE  78          2HG1      ILE  78 -15.224   8.803  16.379
  538   1HG2  ILE  78          1HG2      ILE  78 -12.225  10.718  18.824
  539   2HG2  ILE  78          2HG2      ILE  78 -11.765   9.700  17.455
  540   3HG2  ILE  78          3HG2      ILE  78 -12.517  11.279  17.193
  541   1HD1  ILE  78          1HD1      ILE  78 -15.039  11.243  15.803
  542   2HD1  ILE  78          2HD1      ILE  78 -13.400  10.909  15.186
  543   3HD1  ILE  78          3HD1      ILE  78 -14.797  10.113  14.458
  544    H    TYR  79           H        TYR  79 -13.054   6.817  20.434
  545    HA   TYR  79           HA       TYR  79 -13.157   8.269  22.836
  546   1HB   TYR  79          1HB       TYR  79 -11.191   6.094  22.021
  547   2HB   TYR  79          2HB       TYR  79 -11.464   6.625  23.674
  548    HD1  TYR  79           HD1      TYR  79 -14.122   6.644  24.371
  549    HD2  TYR  79           HD2      TYR  79 -12.168   3.960  21.636
  550    HE1  TYR  79           HE1      TYR  79 -16.089   5.134  24.428
  551    HE2  TYR  79           HE2      TYR  79 -14.166   2.520  21.597
  552    HH   TYR  79           HH       TYR  79 -16.477   2.544  22.046
  553    HA   PRO  80           HA       PRO  80 -10.018  11.345  22.838
  554   1HB   PRO  80          1HB       PRO  80  -8.869   9.864  25.228
  555   2HB   PRO  80          2HB       PRO  80  -9.034  11.635  25.011
  556   1HG   PRO  80          1HG       PRO  80 -10.898  10.315  26.449
  557   2HG   PRO  80          2HG       PRO  80 -11.442  11.470  25.194
  558   1HD   PRO  80          1HD       PRO  80 -11.272   8.460  25.016
  559   2HD   PRO  80          2HD       PRO  80 -12.576   9.562  24.480
  560    H    GLY  81           H        GLY  81  -7.860  11.764  22.208
  561   1HA   GLY  81          1HA       GLY  81  -6.614   9.779  20.604
  562   2HA   GLY  81          2HA       GLY  81  -5.993  11.387  20.982
  563    H    THR  82           H        THR  82  -6.403   8.155  22.495
  564    HA   THR  82           HA       THR  82  -3.554   8.017  23.050
  565    HB   THR  82           HB       THR  82  -4.271   9.193  25.051
  566    HG1  THR  82           HG1      THR  82  -3.519   7.659  26.525
  567   1HG2  THR  82          1HG2      THR  82  -6.686   8.515  25.096
  568   2HG2  THR  82          2HG2      THR  82  -6.196   6.890  25.612
  569   3HG2  THR  82          3HG2      THR  82  -5.872   8.287  26.651
  570    H    ARG  83           H        ARG  83  -2.936   5.894  22.804
  571    HA   ARG  83           HA       ARG  83  -4.969   4.179  21.696
  572   1HB   ARG  83          1HB       ARG  83  -2.675   4.500  20.733
  573   2HB   ARG  83          2HB       ARG  83  -2.006   3.656  22.129
  574   1HG   ARG  83          1HG       ARG  83  -2.057   2.132  20.329
  575   2HG   ARG  83          2HG       ARG  83  -3.320   1.589  21.428
  576   1HD   ARG  83          1HD       ARG  83  -3.802   3.320  18.963
  577   2HD   ARG  83          2HD       ARG  83  -3.871   1.549  18.942
  578    HE   ARG  83           HE       ARG  83  -5.603   2.060  20.931
  579   1HH1  ARG  83          1HH1      ARG  83  -5.424   3.238  17.569
  580   2HH1  ARG  83          2HH1      ARG  83  -7.124   3.692  17.565
  581   1HH2  ARG  83          1HH2      ARG  83  -7.831   2.616  20.786
  582   2HH2  ARG  83          2HH2      ARG  83  -8.424   3.371  19.312
  583    H    ASN  84           H        ASN  84  -6.046   4.229  23.881
  584    HA   ASN  84           HA       ASN  84  -5.118   2.014  25.664
  585   1HB   ASN  84          1HB       ASN  84  -5.272   3.980  26.922
  586   2HB   ASN  84          2HB       ASN  84  -6.828   4.432  26.247
  587   1HD2  ASN  84          2HD2      ASN  84  -5.271   1.671  28.030
  588   2HD2  ASN  84          1HD2      ASN  84  -6.684   1.349  29.018
  589    HA   PRO  85           HA       PRO  85  -9.542   0.576  24.856
  590   1HB   PRO  85          1HB       PRO  85 -11.312   1.949  23.300
  591   2HB   PRO  85          2HB       PRO  85 -11.098   2.290  25.042
  592   1HG   PRO  85          1HG       PRO  85  -9.802   3.749  22.715
  593   2HG   PRO  85          2HG       PRO  85 -10.682   4.451  24.110
  594   1HD   PRO  85          1HD       PRO  85  -8.002   4.310  24.093
  595   2HD   PRO  85          2HD       PRO  85  -8.932   3.985  25.585
  Start of MODEL   11
    1   1H    LYS   1          1H        LYS   1   6.954  12.596 -11.897
    2   2H    LYS   1          2H        LYS   1   6.295  13.106 -13.317
    3   3H    LYS   1          3H        LYS   1   5.969  13.921 -11.918
    4    HA   LYS   1           HA       LYS   1   4.838  12.046 -11.029
    5   1HB   LYS   1          1HB       LYS   1   3.515  13.725 -12.144
    6   2HB   LYS   1          2HB       LYS   1   3.879  13.045 -13.734
    7   1HG   LYS   1          1HG       LYS   1   1.596  12.517 -12.959
    8   2HG   LYS   1          2HG       LYS   1   2.557  11.070 -13.289
    9   1HD   LYS   1          1HD       LYS   1   2.938  10.716 -10.889
   10   2HD   LYS   1          2HD       LYS   1   2.173  12.273 -10.504
   11   1HE   LYS   1          1HE       LYS   1   0.716  10.333 -10.057
   12   2HE   LYS   1          2HE       LYS   1  -0.001  11.417 -11.262
   13   1HZ   LYS   1          1HZ       LYS   1   1.516   8.988 -11.917
   14   2HZ   LYS   1          2HZ       LYS   1  -0.139   9.057 -11.812
   15   3HZ   LYS   1          3HZ       LYS   1   0.659   9.932 -12.956
   16    H    ALA   2           H        ALA   2   5.606   9.972 -10.872
   17    HA   ALA   2           HA       ALA   2   6.333   8.373 -13.187
   18   1HB   ALA   2          1HB       ALA   2   7.308   8.040 -10.906
   19   2HB   ALA   2          2HB       ALA   2   5.694   7.537 -10.346
   20   3HB   ALA   2          3HB       ALA   2   6.557   6.564 -11.553
   21    H    THR   3           H        THR   3   5.181   6.234 -13.628
   22    HA   THR   3           HA       THR   3   2.404   6.763 -14.212
   23    HB   THR   3           HB       THR   3   2.636   4.464 -15.253
   24    HG1  THR   3           HG1      THR   3   4.213   3.699 -13.831
   25   1HG2  THR   3          1HG2      THR   3   3.150   6.514 -16.552
   26   2HG2  THR   3          2HG2      THR   3   4.831   6.469 -15.976
   27   3HG2  THR   3          3HG2      THR   3   4.209   5.163 -17.002
   28    H    MET   4           H        MET   4   2.148   7.009 -11.704
   29    HA   MET   4           HA       MET   4   1.118   4.430 -10.596
   30   1HB   MET   4          1HB       MET   4   1.983   7.055  -9.336
   31   2HB   MET   4          2HB       MET   4   0.878   5.968  -8.485
   32   1HG   MET   4          1HG       MET   4   3.133   5.549  -7.765
   33   2HG   MET   4          2HG       MET   4   2.459   4.138  -8.580
   34   1HE   MET   4          1HE       MET   4   5.503   4.448  -7.781
   35   2HE   MET   4          2HE       MET   4   4.840   3.026  -8.624
   36   3HE   MET   4          3HE       MET   4   6.293   3.839  -9.254
   37    H    GLN   5           H        GLN   5   0.070   6.609 -12.585
   38    HA   GLN   5           HA       GLN   5  -1.906   7.316 -13.374
   39   1HB   GLN   5          1HB       GLN   5  -2.723   4.773 -11.925
   40   2HB   GLN   5          2HB       GLN   5  -3.824   5.699 -12.946
   41   1HG   GLN   5          1HG       GLN   5  -2.773   3.848 -14.198
   42   2HG   GLN   5          2HG       GLN   5  -2.413   5.432 -14.889
   43   1HE2  GLN   5          2HE2      GLN   5  -1.014   2.890 -12.717
   44   2HE2  GLN   5          1HE2      GLN   5   0.657   3.336 -13.069
   45    H    CYS   6           H        CYS   6  -2.859   6.317 -10.075
   46    HA   CYS   6           HA       CYS   6  -4.627   7.152  -8.825
   47   1HB   CYS   6          1HB       CYS   6  -3.699   9.047  -7.592
   48   2HB   CYS   6          2HB       CYS   6  -2.581   7.729  -7.843
   49    H    GLY   7           H        GLY   7  -4.269  10.511  -9.031
   50   1HA   GLY   7          1HA       GLY   7  -5.525  12.112 -10.154
   51   2HA   GLY   7          2HA       GLY   7  -6.564  10.874 -10.865
   52    H    GLU   8           H        GLU   8  -6.603   9.614  -7.956
   53    HA   GLU   8           HA       GLU   8  -9.195  10.818  -7.411
   54   1HB   GLU   8          1HB       GLU   8  -7.730   8.570  -5.979
   55   2HB   GLU   8          2HB       GLU   8  -9.435   8.995  -5.815
   56   1HG   GLU   8          1HG       GLU   8  -9.790   8.499  -8.235
   57   2HG   GLU   8          2HG       GLU   8  -8.096   8.006  -8.384
   58    H    ASN   9           H        ASN   9  -7.669  12.894  -6.969
   59    HA   ASN   9           HA       ASN   9  -6.950  14.476  -5.527
   60   1HB   ASN   9          1HB       ASN   9  -9.234  14.119  -4.563
   61   2HB   ASN   9          2HB       ASN   9  -8.541  13.003  -3.382
   62   1HD2  ASN   9          2HD2      ASN   9  -9.442  14.540  -1.664
   63   2HD2  ASN   9          1HD2      ASN   9  -8.573  16.021  -1.395
   64    H    GLU  10           H        GLU  10  -5.120  12.461  -6.091
   65    HA   GLU  10           HA       GLU  10  -3.565  12.138  -3.585
   66   1HB   GLU  10          1HB       GLU  10  -3.823  10.392  -6.033
   67   2HB   GLU  10          2HB       GLU  10  -2.699  10.061  -4.722
   68   1HG   GLU  10          1HG       GLU  10  -4.643   9.691  -3.189
   69   2HG   GLU  10          2HG       GLU  10  -5.742  10.054  -4.507
   70    H    LYS  11           H        LYS  11  -1.216  12.313  -4.019
   71    HA   LYS  11           HA       LYS  11  -0.458  13.168  -6.745
   72   1HB   LYS  11          1HB       LYS  11   0.840  15.011  -6.025
   73   2HB   LYS  11          2HB       LYS  11  -0.840  15.235  -5.515
   74   1HG   LYS  11          1HG       LYS  11  -0.212  14.570  -3.188
   75   2HG   LYS  11          2HG       LYS  11   1.427  14.213  -3.711
   76   1HD   LYS  11          1HD       LYS  11   1.536  16.298  -2.634
   77   2HD   LYS  11          2HD       LYS  11   1.786  16.571  -4.362
   78   1HE   LYS  11          1HE       LYS  11  -0.591  17.339  -4.564
   79   2HE   LYS  11          2HE       LYS  11  -0.804  17.065  -2.819
   80   1HZ   LYS  11          1HZ       LYS  11   0.884  18.690  -2.421
   81   2HZ   LYS  11          2HZ       LYS  11   1.088  18.941  -4.037
   82   3HZ   LYS  11          3HZ       LYS  11  -0.341  19.334  -3.317
   83    H    TYR  12           H        TYR  12   1.711  12.831  -7.226
   84    HA   TYR  12           HA       TYR  12   2.876  10.433  -6.081
   85   1HB   TYR  12          1HB       TYR  12   2.775  10.972  -8.481
   86   2HB   TYR  12          2HB       TYR  12   3.913  12.296  -8.224
   87    HD1  TYR  12           HD1      TYR  12   3.447   8.586  -7.898
   88    HD2  TYR  12           HD2      TYR  12   6.286  11.824  -8.134
   89    HE1  TYR  12           HE1      TYR  12   5.324   6.974  -7.692
   90    HE2  TYR  12           HE2      TYR  12   8.142  10.213  -7.969
   91    HH   TYR  12           HH       TYR  12   8.733   8.018  -7.646
   92    H    ASP  13           H        ASP  13   2.907  11.509  -3.897
   93    HA   ASP  13           HA       ASP  13   5.733  12.105  -3.415
   94   1HB   ASP  13          1HB       ASP  13   3.636  14.013  -2.334
   95   2HB   ASP  13          2HB       ASP  13   5.357  13.979  -1.933
   96    H    SER  14           H        SER  14   4.222   9.694  -2.812
   97    HA   SER  14           HA       SER  14   3.172   9.746  -0.247
   98   1HB   SER  14          1HB       SER  14   3.689   7.421   0.025
   99   2HB   SER  14          2HB       SER  14   3.155   7.691  -1.628
  100    HG   SER  14           HG       SER  14   5.351   6.476  -0.903
  101    H    CYS  15           H        CYS  15   3.853   9.891   1.767
  102    HA   CYS  15           HA       CYS  15   6.618  10.468   2.559
  103   1HB   CYS  15          1HB       CYS  15   3.976  10.227   3.903
  104   2HB   CYS  15          2HB       CYS  15   5.441  10.042   4.853
  105    H    GLY  16           H        GLY  16   7.221   8.577   1.199
  106   1HA   GLY  16          1HA       GLY  16   8.174   6.408   1.237
  107   2HA   GLY  16          2HA       GLY  16   7.611   6.198   2.925
  108    H    SER  17           H        SER  17   5.024   6.308   2.946
  109    HA   SER  17           HA       SER  17   3.723   5.112   0.665
  110   1HB   SER  17          1HB       SER  17   4.675   3.470   3.045
  111   2HB   SER  17          2HB       SER  17   3.250   2.938   2.133
  112    HG   SER  17           HG       SER  17   5.559   3.611   0.694
  113    H    LYS  18           H        LYS  18   1.458   4.053   1.989
  114    HA   LYS  18           HA       LYS  18   0.281   6.325   3.408
  115   1HB   LYS  18          1HB       LYS  18  -0.714   3.490   2.920
  116   2HB   LYS  18          2HB       LYS  18  -1.665   4.830   3.584
  117   1HG   LYS  18          1HG       LYS  18  -1.201   6.123   1.460
  118   2HG   LYS  18          2HG       LYS  18  -0.489   4.652   0.772
  119   1HD   LYS  18          1HD       LYS  18  -3.345   4.980   1.794
  120   2HD   LYS  18          2HD       LYS  18  -2.833   4.951   0.094
  121   1HE   LYS  18          1HE       LYS  18  -1.958   2.607   0.459
  122   2HE   LYS  18          2HE       LYS  18  -2.669   2.639   2.086
  123   1HZ   LYS  18          1HZ       LYS  18  -4.157   2.966  -0.418
  124   2HZ   LYS  18          2HZ       LYS  18  -4.095   1.600   0.498
  125   3HZ   LYS  18          3HZ       LYS  18  -4.809   2.952   1.098
  126    H    GLU  19           H        GLU  19   2.280   6.123   4.925
  127    HA   GLU  19           HA       GLU  19   1.850   4.162   7.135
  128   1HB   GLU  19          1HB       GLU  19   4.134   5.026   7.890
  129   2HB   GLU  19          2HB       GLU  19   4.030   4.041   6.459
  130   1HG   GLU  19          1HG       GLU  19   5.632   5.909   6.244
  131   2HG   GLU  19          2HG       GLU  19   4.437   5.801   4.968
  132    H    CYS  20           H        CYS  20   3.371   6.613   8.560
  133    HA   CYS  20           HA       CYS  20   1.111   7.321  10.170
  134   1HB   CYS  20          1HB       CYS  20   2.802   8.388  11.522
  135   2HB   CYS  20          2HB       CYS  20   3.496   6.891  10.875
  136    H    ASP  21           H        ASP  21   1.911   8.594   7.165
  137    HA   ASP  21           HA       ASP  21   1.783  11.418   7.806
  138   1HB   ASP  21          1HB       ASP  21   3.096  10.643   5.968
  139   2HB   ASP  21          2HB       ASP  21   1.690   9.855   5.216
  140    H    LYS  22           H        LYS  22  -0.087  12.346   8.425
  141    HA   LYS  22           HA       LYS  22  -2.308  12.636   8.851
  142   1HB   LYS  22          1HB       LYS  22  -2.123  12.916   5.832
  143   2HB   LYS  22          2HB       LYS  22  -3.387  13.612   6.864
  144   1HG   LYS  22          1HG       LYS  22  -1.659  14.842   8.163
  145   2HG   LYS  22          2HG       LYS  22  -0.413  14.253   7.045
  146   1HD   LYS  22          1HD       LYS  22  -1.516  15.349   5.166
  147   2HD   LYS  22          2HD       LYS  22  -2.848  15.883   6.211
  148   1HE   LYS  22          1HE       LYS  22  -1.212  17.176   7.603
  149   2HE   LYS  22          2HE       LYS  22   0.090  16.700   6.496
  150   1HZ   LYS  22          1HZ       LYS  22  -2.295  18.238   5.738
  151   2HZ   LYS  22          2HZ       LYS  22  -0.813  18.882   6.055
  152   3HZ   LYS  22          3HZ       LYS  22  -1.012  17.890   4.762
  153    H    LYS  23           H        LYS  23  -1.982   9.930   8.973
  154    HA   LYS  23           HA       LYS  23  -4.327   8.635   7.735
  155   1HB   LYS  23          1HB       LYS  23  -3.594   6.802   9.488
  156   2HB   LYS  23          2HB       LYS  23  -2.752   7.057   7.974
  157   1HG   LYS  23          1HG       LYS  23  -1.180   6.706   9.750
  158   2HG   LYS  23          2HG       LYS  23  -0.970   8.246   8.969
  159   1HD   LYS  23          1HD       LYS  23  -0.658   8.678  11.303
  160   2HD   LYS  23          2HD       LYS  23  -2.266   9.312  10.961
  161   1HE   LYS  23          1HE       LYS  23  -2.293   8.096  13.037
  162   2HE   LYS  23          2HE       LYS  23  -3.260   7.190  11.867
  163   1HZ   LYS  23          1HZ       LYS  23  -0.489   6.649  12.644
  164   2HZ   LYS  23          2HZ       LYS  23  -1.816   5.787  13.115
  165   3HZ   LYS  23          3HZ       LYS  23  -1.349   5.768  11.535
  166    H    CYS  24           H        CYS  24  -5.371  10.738   8.583
  167    HA   CYS  24           HA       CYS  24  -6.939  11.691   9.922
  168   1HB   CYS  24          1HB       CYS  24  -8.334   9.921   9.456
  169   2HB   CYS  24          2HB       CYS  24  -7.470   8.760  10.461
  170    H    LYS  25           H        LYS  25  -6.120   9.188  12.297
  171    HA   LYS  25           HA       LYS  25  -4.419  10.646  13.943
  172   1HB   LYS  25          1HB       LYS  25  -6.206  12.229  14.391
  173   2HB   LYS  25          2HB       LYS  25  -7.367  10.940  14.696
  174   1HG   LYS  25          1HG       LYS  25  -6.454  12.236  16.703
  175   2HG   LYS  25          2HG       LYS  25  -6.435  10.485  16.856
  176   1HD   LYS  25          1HD       LYS  25  -4.041  10.434  16.213
  177   2HD   LYS  25          2HD       LYS  25  -4.056  12.207  16.059
  178   1HE   LYS  25          1HE       LYS  25  -4.536  12.389  18.479
  179   2HE   LYS  25          2HE       LYS  25  -4.689  10.622  18.599
  180   1HZ   LYS  25          1HZ       LYS  25  -2.407  10.424  17.955
  181   2HZ   LYS  25          2HZ       LYS  25  -2.242  12.063  17.873
  182   3HZ   LYS  25          3HZ       LYS  25  -2.557  11.338  19.319
  183    H    TYR  26           H        TYR  26  -7.188   9.087  15.440
  184    HA   TYR  26           HA       TYR  26  -5.654   6.844  16.290
  185   1HB   TYR  26          1HB       TYR  26  -7.965   5.851  16.806
  186   2HB   TYR  26          2HB       TYR  26  -7.304   7.187  17.723
  187    HD1  TYR  26           HD1      TYR  26  -8.838   8.196  14.495
  188    HD2  TYR  26           HD2      TYR  26  -9.538   7.391  18.676
  189    HE1  TYR  26           HE1      TYR  26 -10.830   9.602  14.424
  190    HE2  TYR  26           HE2      TYR  26 -11.611   8.716  18.568
  191    HH   TYR  26           HH       TYR  26 -12.937  10.104  15.575
  192    H    ASP  27           H        ASP  27  -5.412   4.880  15.467
  193    HA   ASP  27           HA       ASP  27  -6.582   4.229  12.792
  194   1HB   ASP  27          1HB       ASP  27  -4.483   3.499  11.956
  195   2HB   ASP  27          2HB       ASP  27  -4.235   5.105  12.609
  196    H    GLY  28           H        GLY  28  -5.949   1.766  12.357
  197   1HA   GLY  28          1HA       GLY  28  -6.353  -0.413  12.927
  198   2HA   GLY  28          2HA       GLY  28  -5.622  -0.046  14.500
  199    H    VAL  29           H        VAL  29  -8.575   0.684  12.691
  200    HA   VAL  29           HA       VAL  29 -10.696   0.866  13.096
  201    HB   VAL  29           HB       VAL  29 -11.954  -0.359  14.762
  202   1HG1  VAL  29          1HG1      VAL  29 -11.466  -1.246  12.511
  203   2HG1  VAL  29          2HG1      VAL  29  -9.997  -2.026  13.131
  204   3HG1  VAL  29          3HG1      VAL  29 -11.594  -2.543  13.707
  205   1HG2  VAL  29          1HG2      VAL  29 -10.277  -0.646  16.602
  206   2HG2  VAL  29          2HG2      VAL  29 -11.102  -2.117  16.093
  207   3HG2  VAL  29          3HG2      VAL  29  -9.446  -1.845  15.569
  208    H    GLU  30           H        GLU  30  -9.184   1.095  16.302
  209    HA   GLU  30           HA       GLU  30  -9.232   3.912  16.319
  210   1HB   GLU  30          1HB       GLU  30 -10.810   4.343  18.179
  211   2HB   GLU  30          2HB       GLU  30 -11.639   3.756  16.742
  212   1HG   GLU  30          1HG       GLU  30 -11.881   1.526  17.692
  213   2HG   GLU  30          2HG       GLU  30 -10.853   1.945  19.073
  214    H    GLU  31           H        GLU  31  -7.407   1.621  16.848
  215    HA   GLU  31           HA       GLU  31  -7.215   1.380  19.796
  216   1HB   GLU  31          1HB       GLU  31  -5.795   0.021  17.481
  217   2HB   GLU  31          2HB       GLU  31  -5.388  -0.251  19.182
  218   1HG   GLU  31          1HG       GLU  31  -7.626  -1.064  19.681
  219   2HG   GLU  31          2HG       GLU  31  -8.183  -0.697  18.047
  220    H    GLU  32           H        GLU  32  -6.854   3.849  19.561
  221    HA   GLU  32           HA       GLU  32  -5.470   5.683  19.691
  222   1HB   GLU  32          1HB       GLU  32  -3.342   3.714  20.630
  223   2HB   GLU  32          2HB       GLU  32  -3.413   5.465  20.933
  224   1HG   GLU  32          1HG       GLU  32  -5.539   5.150  22.192
  225   2HG   GLU  32          2HG       GLU  32  -5.378   3.396  21.994
  226    H    ASP  33           H        ASP  33  -2.465   5.432  19.166
  227    HA   ASP  33           HA       ASP  33  -2.245   4.494  16.468
  228   1HB   ASP  33          1HB       ASP  33  -1.743   6.769  15.458
  229   2HB   ASP  33          2HB       ASP  33  -3.426   6.366  15.760
  230    H    ASP  34           H        ASP  34  -0.516   3.377  17.186
  231    HA   ASP  34           HA       ASP  34   1.783   4.396  18.508
  232   1HB   ASP  34          1HB       ASP  34   1.419   2.003  18.209
  233   2HB   ASP  34          2HB       ASP  34   1.477   2.167  16.445
  234    H    GLU  35           H        GLU  35   0.957   4.192  15.038
  235    HA   GLU  35           HA       GLU  35   3.297   5.699  14.136
  236   1HB   GLU  35          1HB       GLU  35   0.712   4.765  12.820
  237   2HB   GLU  35          2HB       GLU  35   1.909   5.762  11.992
  238   1HG   GLU  35          1HG       GLU  35   3.650   4.018  12.464
  239   2HG   GLU  35          2HG       GLU  35   2.383   2.987  13.149
  240    H    GLU  36           H        GLU  36   2.734   7.273  15.996
  241    HA   GLU  36           HA       GLU  36   0.609   8.997  15.992
  242   1HB   GLU  36          1HB       GLU  36   3.482   9.441  16.782
  243   2HB   GLU  36          2HB       GLU  36   2.192  10.630  17.104
  244   1HG   GLU  36          1HG       GLU  36   0.933   8.864  18.349
  245   2HG   GLU  36          2HG       GLU  36   2.299   7.758  18.126
  246    HA   PRO  37           HA       PRO  37   0.541  10.873  12.042
  247   1HB   PRO  37          1HB       PRO  37  -0.282  13.287  13.668
  248   2HB   PRO  37          2HB       PRO  37  -0.871  12.795  12.049
  249   1HG   PRO  37          1HG       PRO  37  -2.246  12.046  14.259
  250   2HG   PRO  37          2HG       PRO  37  -1.943  10.853  12.964
  251   1HD   PRO  37          1HD       PRO  37  -0.587  11.088  15.631
  252   2HD   PRO  37          2HD       PRO  37  -0.956   9.646  14.630
  253    H    ASN  38           H        ASN  38   2.344  11.209  10.958
  254    HA   ASN  38           HA       ASN  38   4.136  12.174  10.015
  255   1HB   ASN  38          1HB       ASN  38   2.619  14.640  10.957
  256   2HB   ASN  38          2HB       ASN  38   4.036  14.719   9.915
  257   1HD2  ASN  38          2HD2      ASN  38   3.897  14.122   7.729
  258   2HD2  ASN  38          1HD2      ASN  38   2.358  13.738   6.983
  259    H    VAL  39           H        VAL  39   3.868  14.388  12.814
  260    HA   VAL  39           HA       VAL  39   6.604  15.096  12.586
  261    HB   VAL  39           HB       VAL  39   4.620  15.705  14.791
  262   1HG1  VAL  39          1HG1      VAL  39   7.407  16.843  14.278
  263   2HG1  VAL  39          2HG1      VAL  39   6.212  17.515  15.405
  264   3HG1  VAL  39          3HG1      VAL  39   6.909  15.922  15.713
  265   1HG2  VAL  39          1HG2      VAL  39   5.664  17.308  12.430
  266   2HG2  VAL  39          2HG2      VAL  39   4.035  16.617  12.586
  267   3HG2  VAL  39          3HG2      VAL  39   4.560  17.893  13.689
  268    HA   PRO  40           HA       PRO  40   7.916  12.719  16.482
  269   1HB   PRO  40          1HB       PRO  40   6.235  10.800  17.575
  270   2HB   PRO  40          2HB       PRO  40   6.305  12.505  18.102
  271   1HG   PRO  40          1HG       PRO  40   4.395  11.287  16.088
  272   2HG   PRO  40          2HG       PRO  40   3.984  12.300  17.510
  273   1HD   PRO  40          1HD       PRO  40   4.145  13.363  15.062
  274   2HD   PRO  40          2HD       PRO  40   4.905  14.224  16.440
  275    H    CYS  41           H        CYS  41   5.671  10.897  14.380
  276    HA   CYS  41           HA       CYS  41   7.057   8.476  14.059
  277   1HB   CYS  41          1HB       CYS  41   4.876   8.733  13.119
  278   2HB   CYS  41          2HB       CYS  41   5.355  10.190  12.240
  279    H    LEU  42           H        LEU  42   7.442  11.542  12.235
  280    HA   LEU  42           HA       LEU  42   9.152  12.510  11.330
  281   1HB   LEU  42          1HB       LEU  42  10.303  11.623  13.383
  282   2HB   LEU  42          2HB       LEU  42  10.975  10.324  12.392
  283    HG   LEU  42           HG       LEU  42  12.241  11.953  11.056
  284   1HD1  LEU  42          1HD1      LEU  42  10.913  14.031  12.856
  285   2HD1  LEU  42          2HD1      LEU  42  12.350  14.343  11.859
  286   3HD1  LEU  42          3HD1      LEU  42  10.821  13.939  11.081
  287   1HD2  LEU  42          1HD2      LEU  42  13.200  11.009  13.120
  288   2HD2  LEU  42          2HD2      LEU  42  13.791  12.653  12.813
  289   3HD2  LEU  42          3HD2      LEU  42  12.548  12.375  14.051
  290    H    VAL  43           H        VAL  43   8.154   9.550  10.091
  291    HA   VAL  43           HA       VAL  43  10.057   9.488   7.861
  292    HB   VAL  43           HB       VAL  43   7.376   8.055   7.888
  293   1HG1  VAL  43          1HG1      VAL  43   9.991   7.521   6.455
  294   2HG1  VAL  43          2HG1      VAL  43   8.557   6.475   6.446
  295   3HG1  VAL  43          3HG1      VAL  43   8.463   8.077   5.726
  296   1HG2  VAL  43          1HG2      VAL  43  10.074   7.125   8.993
  297   2HG2  VAL  43          2HG2      VAL  43   8.626   7.417   9.972
  298   3HG2  VAL  43          3HG2      VAL  43   8.633   6.109   8.790
  299    H    ARG  44           H        ARG  44   9.623  11.956   7.833
  300    HA   ARG  44           HA       ARG  44   7.176  12.807   6.495
  301   1HB   ARG  44          1HB       ARG  44   8.115  14.053   8.344
  302   2HB   ARG  44          2HB       ARG  44   9.651  14.262   7.499
  303   1HG   ARG  44          1HG       ARG  44   8.195  16.288   7.605
  304   2HG   ARG  44          2HG       ARG  44   8.738  15.856   6.000
  305   1HD   ARG  44          1HD       ARG  44   6.430  14.738   5.639
  306   2HD   ARG  44          2HD       ARG  44   5.985  15.362   7.231
  307    HE   ARG  44           HE       ARG  44   5.652  17.418   6.286
  308   1HH1  ARG  44          1HH1      ARG  44   7.778  15.557   4.124
  309   2HH1  ARG  44          2HH1      ARG  44   7.641  16.695   2.810
  310   1HH2  ARG  44          1HH2      ARG  44   5.502  18.907   4.569
  311   2HH2  ARG  44          2HH2      ARG  44   6.348  18.629   3.072
  312    H    VAL  45           H        VAL  45   9.329  11.073   5.115
  313    HA   VAL  45           HA       VAL  45  10.474  12.732   3.020
  314    HB   VAL  45           HB       VAL  45  11.216  10.513   2.118
  315   1HG1  VAL  45          1HG1      VAL  45  12.619  11.847   3.628
  316   2HG1  VAL  45          2HG1      VAL  45  11.882  11.061   5.040
  317   3HG1  VAL  45          3HG1      VAL  45  12.852  10.112   3.897
  318   1HG2  VAL  45          1HG2      VAL  45   9.341   9.081   3.157
  319   2HG2  VAL  45          2HG2      VAL  45  10.986   8.486   3.389
  320   3HG2  VAL  45          3HG2      VAL  45  10.158   9.309   4.711
  321    H    CYS  46           H        CYS  46   8.064  13.523   2.701
  322    HA   CYS  46           HA       CYS  46   6.377  11.864   1.000
  323   1HB   CYS  46          1HB       CYS  46   6.282  14.649   1.986
  324   2HB   CYS  46          2HB       CYS  46   5.392  14.234   0.526
  325    H    HIS  47           H        HIS  47   7.302  11.056  -0.732
  326    HA   HIS  47           HA       HIS  47   8.456  12.879  -2.771
  327   1HB   HIS  47          1HB       HIS  47  10.547  11.781  -2.836
  328   2HB   HIS  47          2HB       HIS  47  10.267  12.190  -1.146
  329    HD1  HIS  47           HD1      HIS  47   8.751   9.708  -0.064
  330    HD2  HIS  47           HD2      HIS  47  11.774   9.501  -2.977
  331    HE1  HIS  47           HE1      HIS  47   9.447   7.265  -0.209
  332    H    GLN  48           H        GLN  48   7.378   9.513  -2.006
  333    HA   GLN  48           HA       GLN  48   7.840   8.813  -4.814
  334   1HB   GLN  48          1HB       GLN  48   8.896   7.691  -3.044
  335   2HB   GLN  48          2HB       GLN  48   7.404   6.961  -2.467
  336   1HG   GLN  48          1HG       GLN  48   7.278   5.843  -4.759
  337   2HG   GLN  48          2HG       GLN  48   8.799   6.648  -5.173
  338   1HE2  GLN  48          2HE2      GLN  48  10.309   6.340  -2.717
  339   2HE2  GLN  48          1HE2      GLN  48  10.545   4.616  -2.528
  340    H    ASP  49           H        ASP  49   5.610   6.833  -3.301
  341    HA   ASP  49           HA       ASP  49   4.132   6.463  -5.618
  342   1HB   ASP  49          1HB       ASP  49   4.424   4.815  -3.855
  343   2HB   ASP  49          2HB       ASP  49   3.576   5.795  -2.690
  344    H    CYS  50           H        CYS  50   1.785   6.824  -6.102
  345    HA   CYS  50           HA       CYS  50   1.119   9.586  -5.410
  346   1HB   CYS  50          1HB       CYS  50   0.887   8.724  -7.777
  347   2HB   CYS  50          2HB       CYS  50  -0.521   7.821  -7.166
  348    H    VAL  51           H        VAL  51   0.075  10.025  -3.584
  349    HA   VAL  51           HA       VAL  51  -2.176   8.298  -2.725
  350    HB   VAL  51           HB       VAL  51  -1.262   8.244  -0.414
  351   1HG1  VAL  51          1HG1      VAL  51  -1.004   6.277  -1.892
  352   2HG1  VAL  51          2HG1      VAL  51   0.590   6.876  -2.398
  353   3HG1  VAL  51          3HG1      VAL  51   0.312   6.431  -0.711
  354   1HG2  VAL  51          1HG2      VAL  51   0.385  10.179  -0.722
  355   2HG2  VAL  51          2HG2      VAL  51   1.078   8.724   0.023
  356   3HG2  VAL  51          3HG2      VAL  51   1.374   9.099  -1.691
  357    H    CYS  52           H        CYS  52  -3.415   9.357  -1.023
  358    HA   CYS  52           HA       CYS  52  -4.601  11.627  -1.395
  359   1HB   CYS  52          1HB       CYS  52  -5.214  10.346   0.447
  360   2HB   CYS  52          2HB       CYS  52  -3.667  10.595   1.270
  361    H    GLU  53           H        GLU  53  -4.201  13.612  -1.913
  362    HA   GLU  53           HA       GLU  53  -1.776  15.018  -1.687
  363   1HB   GLU  53          1HB       GLU  53  -4.663  15.975  -1.789
  364   2HB   GLU  53          2HB       GLU  53  -3.266  17.059  -1.896
  365   1HG   GLU  53          1HG       GLU  53  -2.468  15.862  -3.912
  366   2HG   GLU  53          2HG       GLU  53  -3.790  14.716  -3.780
  367    H    GLU  54           H        GLU  54  -0.669  15.440   0.060
  368    HA   GLU  54           HA       GLU  54  -1.599  15.200   2.695
  369   1HB   GLU  54          1HB       GLU  54   0.984  16.352   1.546
  370   2HB   GLU  54          2HB       GLU  54   0.670  16.123   3.266
  371   1HG   GLU  54          1HG       GLU  54   1.861  14.223   2.618
  372   2HG   GLU  54          2HG       GLU  54   0.191  13.706   2.869
  373    H    GLY  55           H        GLY  55  -3.383  16.581   2.397
  374   1HA   GLY  55          1HA       GLY  55  -3.120  19.200   3.723
  375   2HA   GLY  55          2HA       GLY  55  -3.893  19.173   2.117
  376    H    PHE  56           H        PHE  56  -5.142  16.649   2.130
  377    HA   PHE  56           HA       PHE  56  -7.208  16.933   4.254
  378   1HB   PHE  56          1HB       PHE  56  -7.226  14.915   2.046
  379   2HB   PHE  56          2HB       PHE  56  -8.555  15.602   2.923
  380    HD1  PHE  56           HD1      PHE  56  -6.074  16.279   0.234
  381    HD2  PHE  56           HD2      PHE  56  -9.703  17.603   2.163
  382    HE1  PHE  56           HE1      PHE  56  -6.540  17.745  -1.674
  383    HE2  PHE  56           HE2      PHE  56 -10.168  19.083   0.235
  384    HZ   PHE  56           HZ       PHE  56  -8.579  19.187  -1.679
  385    H    TYR  57           H        TYR  57  -7.896  14.313   4.718
  386    HA   TYR  57           HA       TYR  57  -5.380  13.080   5.779
  387   1HB   TYR  57          1HB       TYR  57  -8.235  13.045   6.816
  388   2HB   TYR  57          2HB       TYR  57  -6.917  12.075   7.458
  389    HD1  TYR  57           HD1      TYR  57  -8.148  15.572   6.992
  390    HD2  TYR  57           HD2      TYR  57  -5.191  13.053   8.873
  391    HE1  TYR  57           HE1      TYR  57  -7.220  17.532   8.196
  392    HE2  TYR  57           HE2      TYR  57  -4.392  14.973  10.195
  393    HH   TYR  57           HH       TYR  57  -4.608  17.232  10.609
  394    H    ARG  58           H        ARG  58  -5.123  10.844   5.531
  395    HA   ARG  58           HA       ARG  58  -6.654   9.688   3.260
  396   1HB   ARG  58          1HB       ARG  58  -4.999   7.734   3.686
  397   2HB   ARG  58          2HB       ARG  58  -4.558   9.198   2.811
  398   1HG   ARG  58          1HG       ARG  58  -3.326  10.015   4.812
  399   2HG   ARG  58          2HG       ARG  58  -3.820   8.537   5.670
  400   1HD   ARG  58          1HD       ARG  58  -1.565   8.221   4.780
  401   2HD   ARG  58          2HD       ARG  58  -2.691   7.160   3.950
  402    HE   ARG  58           HE       ARG  58  -2.481   8.346   1.975
  403   1HH1  ARG  58          1HH1      ARG  58  -0.854  10.143   4.589
  404   2HH1  ARG  58          2HH1      ARG  58   0.002  11.189   3.473
  405   1HH2  ARG  58          1HH2      ARG  58  -1.584   9.958   0.608
  406   2HH2  ARG  58          2HH2      ARG  58  -0.528  11.187   1.226
  407    H    ASN  59           H        ASN  59  -8.584   9.885   4.558
  408    HA   ASN  59           HA       ASN  59  -8.994   8.215   6.886
  409   1HB   ASN  59          1HB       ASN  59 -11.175   9.239   5.028
  410   2HB   ASN  59          2HB       ASN  59 -11.294   8.860   6.744
  411   1HD2  ASN  59          2HD2      ASN  59 -10.328  11.200   4.353
  412   2HD2  ASN  59          1HD2      ASN  59  -9.999  12.531   5.450
  413    H    LYS  60           H        LYS  60 -10.538   6.399   6.973
  414    HA   LYS  60           HA       LYS  60 -11.190   4.329   6.511
  415   1HB   LYS  60          1HB       LYS  60 -12.052   5.287   3.772
  416   2HB   LYS  60          2HB       LYS  60 -12.780   4.074   4.824
  417   1HG   LYS  60          1HG       LYS  60 -13.214   5.990   6.476
  418   2HG   LYS  60          2HG       LYS  60 -12.723   7.089   5.161
  419   1HD   LYS  60          1HD       LYS  60 -14.539   6.042   3.730
  420   2HD   LYS  60          2HD       LYS  60 -15.013   5.071   5.135
  421   1HE   LYS  60          1HE       LYS  60 -16.487   6.989   5.005
  422   2HE   LYS  60          2HE       LYS  60 -15.445   7.179   6.424
  423   1HZ   LYS  60          1HZ       LYS  60 -15.036   8.477   3.816
  424   2HZ   LYS  60          2HZ       LYS  60 -15.633   9.197   5.177
  425   3HZ   LYS  60          3HZ       LYS  60 -14.083   8.668   5.151
  426    H    ASP  61           H        ASP  61  -9.961   5.232   3.312
  427    HA   ASP  61           HA       ASP  61  -7.732   3.495   3.356
  428   1HB   ASP  61          1HB       ASP  61  -9.320   1.698   2.844
  429   2HB   ASP  61          2HB       ASP  61 -10.016   2.650   1.519
  430    H    ASP  62           H        ASP  62  -6.805   5.479   2.944
  431    HA   ASP  62           HA       ASP  62  -6.265   7.421   1.994
  432   1HB   ASP  62          1HB       ASP  62  -5.259   5.477   0.515
  433   2HB   ASP  62          2HB       ASP  62  -6.319   6.138  -0.727
  434    H    LYS  63           H        LYS  63  -9.090   7.254   2.344
  435    HA   LYS  63           HA       LYS  63 -10.276   8.718   0.089
  436   1HB   LYS  63          1HB       LYS  63 -11.315   8.288   2.913
  437   2HB   LYS  63          2HB       LYS  63 -12.205   8.979   1.568
  438   1HG   LYS  63          1HG       LYS  63 -11.137   6.134   1.791
  439   2HG   LYS  63          2HG       LYS  63 -12.816   6.634   1.948
  440   1HD   LYS  63          1HD       LYS  63 -11.057   6.692  -0.550
  441   2HD   LYS  63          2HD       LYS  63 -12.401   5.609  -0.230
  442   1HE   LYS  63          1HE       LYS  63 -12.603   8.623  -0.703
  443   2HE   LYS  63          2HE       LYS  63 -13.091   7.334  -1.806
  444   1HZ   LYS  63          1HZ       LYS  63 -14.719   6.646  -0.197
  445   2HZ   LYS  63          2HZ       LYS  63 -14.276   7.862   0.826
  446   3HZ   LYS  63          3HZ       LYS  63 -14.950   8.217  -0.634
  447    H    CYS  64           H        CYS  64  -8.589  10.188  -0.072
  448    HA   CYS  64           HA       CYS  64  -7.858  12.172   1.721
  449   1HB   CYS  64          1HB       CYS  64  -7.131  11.575  -0.757
  450   2HB   CYS  64          2HB       CYS  64  -8.133  12.931  -1.150
  451    H    VAL  65           H        VAL  65  -9.682  12.644   2.991
  452    HA   VAL  65           HA       VAL  65 -11.009  15.088   2.027
  453    HB   VAL  65           HB       VAL  65 -13.163  14.507   3.029
  454   1HG1  VAL  65          1HG1      VAL  65 -12.791  14.220   0.591
  455   2HG1  VAL  65          2HG1      VAL  65 -12.388  12.509   0.869
  456   3HG1  VAL  65          3HG1      VAL  65 -14.011  13.114   1.247
  457   1HG2  VAL  65          1HG2      VAL  65 -12.375  12.717   4.572
  458   2HG2  VAL  65          2HG2      VAL  65 -13.793  12.257   3.621
  459   3HG2  VAL  65          3HG2      VAL  65 -12.199  11.624   3.188
  460    H    SER  66           H        SER  66 -11.924  16.368   3.847
  461    HA   SER  66           HA       SER  66  -9.878  17.102   5.451
  462   1HB   SER  66          1HB       SER  66 -12.795  17.681   6.012
  463   2HB   SER  66          2HB       SER  66 -11.418  18.799   6.135
  464    HG   SER  66           HG       SER  66 -12.732  19.058   4.224
  465    H    ALA  67           H        ALA  67  -9.857  17.539   7.775
  466    HA   ALA  67           HA       ALA  67  -9.836  15.433   9.514
  467   1HB   ALA  67          1HB       ALA  67  -8.837  17.623   9.990
  468   2HB   ALA  67          2HB       ALA  67 -10.453  18.338  10.169
  469   3HB   ALA  67          3HB       ALA  67  -9.888  17.107  11.317
  470    H    GLU  68           H        GLU  68 -12.444  17.628   8.798
  471    HA   GLU  68           HA       GLU  68 -14.588  17.124  10.372
  472   1HB   GLU  68          1HB       GLU  68 -14.697  17.042   7.321
  473   2HB   GLU  68          2HB       GLU  68 -15.989  17.514   8.423
  474   1HG   GLU  68          1HG       GLU  68 -14.699  19.501   9.128
  475   2HG   GLU  68          2HG       GLU  68 -13.363  19.063   8.054
  476    H    ASP  69           H        ASP  69 -13.428  14.960   7.747
  477    HA   ASP  69           HA       ASP  69 -15.485  12.939   8.264
  478   1HB   ASP  69          1HB       ASP  69 -14.538  13.319   5.991
  479   2HB   ASP  69          2HB       ASP  69 -12.946  12.830   6.619
  480    H    CYS  70           H        CYS  70 -11.918  13.233   8.656
  481    HA   CYS  70           HA       CYS  70 -11.234  10.819   9.697
  482   1HB   CYS  70          1HB       CYS  70  -9.462  12.376   9.454
  483   2HB   CYS  70          2HB       CYS  70 -10.295  13.588  10.419
  484    H    GLU  71           H        GLU  71 -12.381  13.543  11.748
  485    HA   GLU  71           HA       GLU  71 -12.332  12.194  14.211
  486   1HB   GLU  71          1HB       GLU  71 -14.181  14.376  13.155
  487   2HB   GLU  71          2HB       GLU  71 -14.351  13.697  14.776
  488   1HG   GLU  71          1HG       GLU  71 -13.059  15.623  15.079
  489   2HG   GLU  71          2HG       GLU  71 -11.937  14.274  15.248
  490    H    LEU  72           H        LEU  72 -14.733  11.958  11.638
  491    HA   LEU  72           HA       LEU  72 -16.668  10.491  13.336
  492   1HB   LEU  72          1HB       LEU  72 -16.888  11.536  10.490
  493   2HB   LEU  72          2HB       LEU  72 -18.198  10.849  11.455
  494    HG   LEU  72           HG       LEU  72 -16.695  13.436  12.096
  495   1HD1  LEU  72          1HD1      LEU  72 -18.124  13.598  10.092
  496   2HD1  LEU  72          2HD1      LEU  72 -19.506  12.971  11.018
  497   3HD1  LEU  72          3HD1      LEU  72 -18.785  14.541  11.438
  498   1HD2  LEU  72          1HD2      LEU  72 -19.102  12.126  13.443
  499   2HD2  LEU  72          2HD2      LEU  72 -17.506  12.416  14.172
  500   3HD2  LEU  72          3HD2      LEU  72 -18.540  13.782  13.748
  501    H    ASP  73           H        ASP  73 -14.299   9.934  10.835
  502    HA   ASP  73           HA       ASP  73 -15.168   7.645   9.565
  503   1HB   ASP  73          1HB       ASP  73 -13.125   8.885   9.046
  504   2HB   ASP  73          2HB       ASP  73 -12.380   8.351  10.550
  505    H    ASN  74           H        ASN  74 -13.834   7.925  12.835
  506    HA   ASN  74           HA       ASN  74 -13.520   5.296  13.648
  507   1HB   ASN  74          1HB       ASN  74 -13.180   7.481  14.929
  508   2HB   ASN  74          2HB       ASN  74 -14.889   7.397  15.359
  509   1HD2  ASN  74          2HD2      ASN  74 -15.087   4.476  15.886
  510   2HD2  ASN  74          1HD2      ASN  74 -14.098   4.219  17.301
  511    H    MET  75           H        MET  75 -16.622   6.950  13.004
  512    HA   MET  75           HA       MET  75 -18.338   5.153  14.381
  513   1HB   MET  75          1HB       MET  75 -18.860   7.435  13.464
  514   2HB   MET  75          2HB       MET  75 -18.895   6.733  11.835
  515   1HG   MET  75          1HG       MET  75 -20.712   5.170  12.638
  516   2HG   MET  75          2HG       MET  75 -20.702   6.029  14.182
  517   1HE   MET  75          1HE       MET  75 -21.241   8.674  14.347
  518   2HE   MET  75          2HE       MET  75 -20.262   9.130  12.926
  519   3HE   MET  75          3HE       MET  75 -21.970   9.605  13.017
  520    H    ASP  76           H        ASP  76 -16.868   5.086  11.124
  521    HA   ASP  76           HA       ASP  76 -18.168   2.475  10.537
  522   1HB   ASP  76          1HB       ASP  76 -17.446   2.675   8.322
  523   2HB   ASP  76          2HB       ASP  76 -18.168   4.221   8.784
  524    H    PHE  77           H        PHE  77 -15.249   3.868  11.661
  525    HA   PHE  77           HA       PHE  77 -13.737   2.928  13.005
  526   1HB   PHE  77          1HB       PHE  77 -14.325   0.193  11.837
  527   2HB   PHE  77          2HB       PHE  77 -13.139   0.565  13.052
  528    HD1  PHE  77           HD1      PHE  77 -13.878   1.742  15.238
  529    HD2  PHE  77           HD2      PHE  77 -16.615  -0.225  12.539
  530    HE1  PHE  77           HE1      PHE  77 -15.581   1.640  17.031
  531    HE2  PHE  77           HE2      PHE  77 -18.329  -0.271  14.323
  532    HZ   PHE  77           HZ       PHE  77 -17.814   0.648  16.577
  533    H    ILE  78           H        ILE  78 -11.625   3.252  12.730
  534    HA   ILE  78           HA       ILE  78 -10.848   3.754   9.953
  535    HB   ILE  78           HB       ILE  78  -9.271   4.366  12.475
  536   1HG1  ILE  78          1HG1      ILE  78 -11.736   5.631  11.297
  537   2HG1  ILE  78          2HG1      ILE  78 -11.258   5.408  12.982
  538   1HG2  ILE  78          1HG2      ILE  78  -8.065   4.496  10.302
  539   2HG2  ILE  78          2HG2      ILE  78  -9.307   5.599   9.679
  540   3HG2  ILE  78          3HG2      ILE  78  -8.257   6.085  11.028
  541   1HD1  ILE  78          1HD1      ILE  78  -9.567   7.225  12.669
  542   2HD1  ILE  78          2HD1      ILE  78 -10.230   7.511  11.049
  543   3HD1  ILE  78          3HD1      ILE  78 -11.248   7.758  12.478
  544    H    TYR  79           H        TYR  79 -10.958   1.459   9.479
  545    HA   TYR  79           HA       TYR  79  -9.539  -0.563  10.573
  546   1HB   TYR  79          1HB       TYR  79 -10.000  -0.235   7.590
  547   2HB   TYR  79          2HB       TYR  79  -9.562  -1.723   8.412
  548    HD1  TYR  79           HD1      TYR  79 -11.118  -2.694  10.175
  549    HD2  TYR  79           HD2      TYR  79 -12.296   0.497   7.523
  550    HE1  TYR  79           HE1      TYR  79 -13.491  -3.013  10.832
  551    HE2  TYR  79           HE2      TYR  79 -14.646   0.198   8.207
  552    HH   TYR  79           HH       TYR  79 -15.926  -0.646   9.985
  553    HA   PRO  80           HA       PRO  80  -5.632   0.170   7.787
  554   1HB   PRO  80          1HB       PRO  80  -5.463   3.169   8.129
  555   2HB   PRO  80          2HB       PRO  80  -4.836   2.156   6.789
  556   1HG   PRO  80          1HG       PRO  80  -7.159   3.503   6.463
  557   2HG   PRO  80          2HG       PRO  80  -7.044   1.801   5.926
  558   1HD   PRO  80          1HD       PRO  80  -8.227   2.872   8.485
  559   2HD   PRO  80          2HD       PRO  80  -8.915   1.663   7.370
  560    H    GLY  81           H        GLY  81  -3.775  -0.220   8.932
  561   1HA   GLY  81          1HA       GLY  81  -2.286   0.156  10.843
  562   2HA   GLY  81          2HA       GLY  81  -3.699   0.588  11.830
  563    H    THR  82           H        THR  82  -5.536  -1.346  10.714
  564    HA   THR  82           HA       THR  82  -4.744  -3.809  12.041
  565    HB   THR  82           HB       THR  82  -7.109  -3.433  10.160
  566    HG1  THR  82           HG1      THR  82  -7.327  -1.795  11.530
  567   1HG2  THR  82          1HG2      THR  82  -6.654  -5.738  10.996
  568   2HG2  THR  82          2HG2      THR  82  -6.691  -5.124  12.668
  569   3HG2  THR  82          3HG2      THR  82  -8.155  -5.069  11.666
  570    H    ARG  83           H        ARG  83  -2.712  -3.836  10.730
  571    HA   ARG  83           HA       ARG  83  -1.365  -4.882   9.329
  572   1HB   ARG  83          1HB       ARG  83  -2.739  -6.870   9.505
  573   2HB   ARG  83          2HB       ARG  83  -3.810  -6.320   8.219
  574   1HG   ARG  83          1HG       ARG  83  -2.326  -8.059   7.457
  575   2HG   ARG  83          2HG       ARG  83  -2.075  -6.573   6.544
  576   1HD   ARG  83          1HD       ARG  83  -0.316  -7.429   8.885
  577   2HD   ARG  83          2HD       ARG  83   0.021  -7.870   7.195
  578    HE   ARG  83           HE       ARG  83  -0.322  -5.171   7.036
  579   1HH1  ARG  83          1HH1      ARG  83   1.934  -7.142   8.906
  580   2HH1  ARG  83          2HH1      ARG  83   2.913  -5.777   9.377
  581   1HH2  ARG  83          1HH2      ARG  83   0.759  -3.464   7.720
  582   2HH2  ARG  83          2HH2      ARG  83   2.276  -3.586   8.597
  583    H    ASN  84           H        ASN  84  -4.294  -4.020   7.424
  584    HA   ASN  84           HA       ASN  84  -3.003  -3.172   5.067
  585   1HB   ASN  84          1HB       ASN  84  -5.402  -3.457   5.170
  586   2HB   ASN  84          2HB       ASN  84  -5.563  -2.182   6.388
  587   1HD2  ASN  84          2HD2      ASN  84  -5.084   0.086   5.729
  588   2HD2  ASN  84          1HD2      ASN  84  -5.205   0.510   4.034
  589    HA   PRO  85           HA       PRO  85  -0.806   0.290   6.906
  590   1HB   PRO  85          1HB       PRO  85   0.225   1.515   4.682
  591   2HB   PRO  85          2HB       PRO  85   0.804  -0.058   5.293
  592   1HG   PRO  85          1HG       PRO  85  -1.197   0.441   3.074
  593   2HG   PRO  85          2HG       PRO  85   0.223  -0.644   3.044
  594   1HD   PRO  85          1HD       PRO  85  -2.299  -1.539   3.580
  595   2HD   PRO  85          2HD       PRO  85  -0.874  -2.245   4.415
  Start of MODEL   12
    1   1H    LYS   1          1H        LYS   1   7.995  19.221  -4.923
    2   2H    LYS   1          2H        LYS   1   6.896  19.717  -3.801
    3   3H    LYS   1          3H        LYS   1   8.488  19.586  -3.392
    4    HA   LYS   1           HA       LYS   1   8.468  17.250  -3.717
    5   1HB   LYS   1          1HB       LYS   1   8.020  18.130  -1.493
    6   2HB   LYS   1          2HB       LYS   1   6.294  18.260  -1.838
    7   1HG   LYS   1          1HG       LYS   1   6.097  15.836  -2.093
    8   2HG   LYS   1          2HG       LYS   1   7.836  15.613  -1.875
    9   1HD   LYS   1          1HD       LYS   1   6.259  17.043   0.290
   10   2HD   LYS   1          2HD       LYS   1   6.041  15.308   0.093
   11   1HE   LYS   1          1HE       LYS   1   7.726  15.724   1.784
   12   2HE   LYS   1          2HE       LYS   1   8.429  14.878   0.400
   13   1HZ   LYS   1          1HZ       LYS   1   8.626  17.767   0.913
   14   2HZ   LYS   1          2HZ       LYS   1   9.812  16.658   1.196
   15   3HZ   LYS   1          3HZ       LYS   1   9.320  16.959  -0.345
   16    H    ALA   2           H        ALA   2   5.015  18.341  -3.661
   17    HA   ALA   2           HA       ALA   2   4.214  15.912  -4.934
   18   1HB   ALA   2          1HB       ALA   2   2.813  16.964  -3.277
   19   2HB   ALA   2          2HB       ALA   2   2.577  18.381  -4.334
   20   3HB   ALA   2          3HB       ALA   2   1.981  16.775  -4.828
   21    H    THR   3           H        THR   3   5.595  16.066  -6.847
   22    HA   THR   3           HA       THR   3   5.247  18.002  -8.903
   23    HB   THR   3           HB       THR   3   6.362  16.078 -10.238
   24    HG1  THR   3           HG1      THR   3   7.061  14.364  -8.859
   25   1HG2  THR   3          1HG2      THR   3   7.676  17.870  -9.128
   26   2HG2  THR   3          2HG2      THR   3   7.661  16.950  -7.609
   27   3HG2  THR   3          3HG2      THR   3   8.502  16.305  -9.032
   28    H    MET   4           H        MET   4   4.422  14.549  -9.286
   29    HA   MET   4           HA       MET   4   2.366  15.293 -11.224
   30   1HB   MET   4          1HB       MET   4   1.884  12.882 -11.415
   31   2HB   MET   4          2HB       MET   4   3.486  13.413 -11.899
   32   1HG   MET   4          1HG       MET   4   2.991  12.173  -9.187
   33   2HG   MET   4          2HG       MET   4   3.203  11.193 -10.622
   34   1HE   MET   4          1HE       MET   4   5.363  10.888 -12.017
   35   2HE   MET   4          2HE       MET   4   5.526  12.634 -12.342
   36   3HE   MET   4          3HE       MET   4   6.893  11.724 -11.674
   37    H    GLN   5           H        GLN   5   0.369  15.868 -10.790
   38    HA   GLN   5           HA       GLN   5  -0.896  15.408  -8.192
   39   1HB   GLN   5          1HB       GLN   5  -2.138  16.563 -10.706
   40   2HB   GLN   5          2HB       GLN   5  -2.684  16.718  -9.031
   41   1HG   GLN   5          1HG       GLN   5  -0.260  17.995 -10.348
   42   2HG   GLN   5          2HG       GLN   5  -1.693  18.786  -9.702
   43   1HE2  GLN   5          2HE2      GLN   5   1.529  17.837  -9.017
   44   2HE2  GLN   5          1HE2      GLN   5   1.525  18.207  -7.329
   45    H    CYS   6           H        CYS   6  -0.376  12.958  -8.763
   46    HA   CYS   6           HA       CYS   6  -1.144  11.446 -10.739
   47   1HB   CYS   6          1HB       CYS   6  -1.075   9.563  -9.366
   48   2HB   CYS   6          2HB       CYS   6  -0.124  10.773  -8.505
   49    H    GLY   7           H        GLY   7  -3.648  12.494  -8.375
   50   1HA   GLY   7          1HA       GLY   7  -5.710  11.696 -10.384
   51   2HA   GLY   7          2HA       GLY   7  -5.831  11.025  -8.748
   52    H    GLU   8           H        GLU   8  -4.519  14.230  -9.361
   53    HA   GLU   8           HA       GLU   8  -5.056  16.253  -8.694
   54   1HB   GLU   8          1HB       GLU   8  -6.766  15.984 -10.491
   55   2HB   GLU   8          2HB       GLU   8  -7.963  15.507  -9.274
   56   1HG   GLU   8          1HG       GLU   8  -7.724  17.719  -8.168
   57   2HG   GLU   8          2HG       GLU   8  -6.482  18.177  -9.347
   58    H    ASN   9           H        ASN   9  -7.738  14.367  -7.270
   59    HA   ASN   9           HA       ASN   9  -7.633  15.724  -4.714
   60   1HB   ASN   9          1HB       ASN   9  -8.703  12.976  -5.467
   61   2HB   ASN   9          2HB       ASN   9  -8.969  13.784  -3.918
   62   1HD2  ASN   9          2HD2      ASN   9  -9.950  16.160  -4.160
   63   2HD2  ASN   9          1HD2      ASN   9 -11.260  16.238  -5.328
   64    H    GLU  10           H        GLU  10  -5.462  13.602  -6.271
   65    HA   GLU  10           HA       GLU  10  -4.021  13.158  -3.764
   66   1HB   GLU  10          1HB       GLU  10  -4.366  11.041  -5.933
   67   2HB   GLU  10          2HB       GLU  10  -3.501  10.870  -4.388
   68   1HG   GLU  10          1HG       GLU  10  -5.792  11.380  -3.293
   69   2HG   GLU  10          2HG       GLU  10  -6.486  11.200  -4.917
   70    H    LYS  11           H        LYS  11  -1.775  13.262  -4.044
   71    HA   LYS  11           HA       LYS  11  -0.633  13.936  -6.643
   72   1HB   LYS  11          1HB       LYS  11   0.079  16.150  -5.890
   73   2HB   LYS  11          2HB       LYS  11  -1.678  16.044  -5.730
   74   1HG   LYS  11          1HG       LYS  11  -1.377  15.460  -3.284
   75   2HG   LYS  11          2HG       LYS  11   0.363  15.719  -3.477
   76   1HD   LYS  11          1HD       LYS  11  -0.290  18.077  -4.385
   77   2HD   LYS  11          2HD       LYS  11  -1.876  17.753  -3.686
   78   1HE   LYS  11          1HE       LYS  11   0.831  17.902  -2.275
   79   2HE   LYS  11          2HE       LYS  11  -0.560  18.962  -2.038
   80   1HZ   LYS  11          1HZ       LYS  11  -0.422  16.099  -1.334
   81   2HZ   LYS  11          2HZ       LYS  11  -0.288  17.352  -0.279
   82   3HZ   LYS  11          3HZ       LYS  11  -1.710  17.077  -1.058
   83    H    TYR  12           H        TYR  12   1.698  14.093  -6.589
   84    HA   TYR  12           HA       TYR  12   2.774  11.892  -5.488
   85   1HB   TYR  12          1HB       TYR  12   3.689  13.185  -7.343
   86   2HB   TYR  12          2HB       TYR  12   4.426  14.297  -6.223
   87    HD1  TYR  12           HD1      TYR  12   4.447  10.854  -7.516
   88    HD2  TYR  12           HD2      TYR  12   6.353  13.613  -4.812
   89    HE1  TYR  12           HE1      TYR  12   6.321   9.277  -7.230
   90    HE2  TYR  12           HE2      TYR  12   8.133  11.936  -4.378
   91    HH   TYR  12           HH       TYR  12   7.828   8.653  -5.460
   92    H    ASP  13           H        ASP  13   3.949  11.230  -3.728
   93    HA   ASP  13           HA       ASP  13   5.262  12.921  -1.856
   94   1HB   ASP  13          1HB       ASP  13   2.963  13.304  -0.960
   95   2HB   ASP  13          2HB       ASP  13   2.735  11.540  -0.893
   96    H    SER  14           H        SER  14   7.030  11.517  -2.060
   97    HA   SER  14           HA       SER  14   6.643   8.627  -1.735
   98   1HB   SER  14          1HB       SER  14   8.568   9.772  -3.034
   99   2HB   SER  14          2HB       SER  14   9.305  10.004  -1.436
  100    HG   SER  14           HG       SER  14   9.842   7.982  -2.487
  101    H    CYS  15           H        CYS  15   7.532   7.515   0.138
  102    HA   CYS  15           HA       CYS  15   8.405   7.238   2.305
  103   1HB   CYS  15          1HB       CYS  15   7.802  10.129   2.997
  104   2HB   CYS  15          2HB       CYS  15   8.744   8.969   3.892
  105    H    GLY  16           H        GLY  16   5.893   6.565   1.357
  106   1HA   GLY  16          1HA       GLY  16   4.458   6.481   3.902
  107   2HA   GLY  16          2HA       GLY  16   3.847   7.696   2.748
  108    H    SER  17           H        SER  17   3.836   4.335   3.638
  109    HA   SER  17           HA       SER  17   2.459   3.218   1.381
  110   1HB   SER  17          1HB       SER  17   1.573   1.748   3.355
  111   2HB   SER  17          2HB       SER  17   3.324   1.753   3.059
  112    HG   SER  17           HG       SER  17   2.863   2.123   5.281
  113    H    LYS  18           H        LYS  18   1.458   4.478   4.515
  114    HA   LYS  18           HA       LYS  18  -0.648   6.213   3.348
  115   1HB   LYS  18          1HB       LYS  18  -2.284   5.598   5.080
  116   2HB   LYS  18          2HB       LYS  18  -1.920   4.235   4.014
  117   1HG   LYS  18          1HG       LYS  18  -0.526   3.181   5.716
  118   2HG   LYS  18          2HG       LYS  18  -0.616   4.618   6.746
  119   1HD   LYS  18          1HD       LYS  18  -2.113   2.935   7.619
  120   2HD   LYS  18          2HD       LYS  18  -3.050   4.316   7.030
  121   1HE   LYS  18          1HE       LYS  18  -3.611   3.079   4.959
  122   2HE   LYS  18          2HE       LYS  18  -2.594   1.721   5.472
  123   1HZ   LYS  18          1HZ       LYS  18  -4.996   2.699   6.866
  124   2HZ   LYS  18          2HZ       LYS  18  -4.896   1.362   5.908
  125   3HZ   LYS  18          3HZ       LYS  18  -4.061   1.419   7.330
  126    H    GLU  19           H        GLU  19   1.711   6.770   3.794
  127    HA   GLU  19           HA       GLU  19   3.232   8.074   4.773
  128   1HB   GLU  19          1HB       GLU  19   2.441  10.412   4.350
  129   2HB   GLU  19          2HB       GLU  19   2.369   9.254   3.071
  130   1HG   GLU  19          1HG       GLU  19   0.443  10.473   2.823
  131   2HG   GLU  19          2HG       GLU  19  -0.089   8.904   3.390
  132    H    CYS  20           H        CYS  20   0.645   8.151   7.119
  133    HA   CYS  20           HA       CYS  20   0.586   9.027   9.193
  134   1HB   CYS  20          1HB       CYS  20   2.446   7.351   9.425
  135   2HB   CYS  20          2HB       CYS  20   3.570   8.715   9.350
  136    H    ASP  21           H        ASP  21   1.020  10.740   6.841
  137    HA   ASP  21           HA       ASP  21   2.538  13.122   7.747
  138   1HB   ASP  21          1HB       ASP  21   3.215  12.203   5.558
  139   2HB   ASP  21          2HB       ASP  21   1.555  12.240   4.992
  140    H    LYS  22           H        LYS  22  -0.234  13.041   5.502
  141    HA   LYS  22           HA       LYS  22  -1.827  14.758   7.336
  142   1HB   LYS  22          1HB       LYS  22  -2.274  13.912   4.449
  143   2HB   LYS  22          2HB       LYS  22  -3.311  14.988   5.406
  144   1HG   LYS  22          1HG       LYS  22  -1.349  16.523   5.734
  145   2HG   LYS  22          2HG       LYS  22  -0.414  15.530   4.616
  146   1HD   LYS  22          1HD       LYS  22  -2.989  17.052   4.013
  147   2HD   LYS  22          2HD       LYS  22  -1.359  17.485   3.474
  148   1HE   LYS  22          1HE       LYS  22  -3.029  15.082   2.597
  149   2HE   LYS  22          2HE       LYS  22  -2.552  16.475   1.636
  150   1HZ   LYS  22          1HZ       LYS  22  -0.265  15.787   1.872
  151   2HZ   LYS  22          2HZ       LYS  22  -0.743  14.430   2.679
  152   3HZ   LYS  22          3HZ       LYS  22  -1.212  14.669   1.111
  153    H    LYS  23           H        LYS  23  -1.578  12.724   8.692
  154    HA   LYS  23           HA       LYS  23  -3.228  10.450   7.878
  155   1HB   LYS  23          1HB       LYS  23  -2.478   9.347   9.794
  156   2HB   LYS  23          2HB       LYS  23  -1.123  10.164   9.017
  157   1HG   LYS  23          1HG       LYS  23  -2.544  11.046  11.588
  158   2HG   LYS  23          2HG       LYS  23  -1.023  10.163  11.476
  159   1HD   LYS  23          1HD       LYS  23  -0.098  12.131  10.134
  160   2HD   LYS  23          2HD       LYS  23  -1.535  13.046  10.682
  161   1HE   LYS  23          1HE       LYS  23  -0.868  12.504  13.044
  162   2HE   LYS  23          2HE       LYS  23   0.580  11.696  12.408
  163   1HZ   LYS  23          1HZ       LYS  23   1.249  13.752  11.427
  164   2HZ   LYS  23          2HZ       LYS  23  -0.060  14.529  12.058
  165   3HZ   LYS  23          3HZ       LYS  23   1.084  13.892  13.065
  166    H    CYS  24           H        CYS  24  -5.103   9.713   8.880
  167    HA   CYS  24           HA       CYS  24  -6.860  11.718  10.076
  168   1HB   CYS  24          1HB       CYS  24  -7.877   9.969   8.817
  169   2HB   CYS  24          2HB       CYS  24  -7.045   8.709   9.760
  170    H    LYS  25           H        LYS  25  -6.380  12.430  12.066
  171    HA   LYS  25           HA       LYS  25  -4.620  11.096  13.807
  172   1HB   LYS  25          1HB       LYS  25  -4.961  12.917  15.327
  173   2HB   LYS  25          2HB       LYS  25  -4.564  13.434  13.697
  174   1HG   LYS  25          1HG       LYS  25  -7.341  13.530  14.973
  175   2HG   LYS  25          2HG       LYS  25  -6.201  14.854  14.936
  176   1HD   LYS  25          1HD       LYS  25  -7.720  13.652  12.606
  177   2HD   LYS  25          2HD       LYS  25  -7.842  15.253  13.295
  178   1HE   LYS  25          1HE       LYS  25  -5.422  14.237  11.721
  179   2HE   LYS  25          2HE       LYS  25  -6.636  15.402  11.191
  180   1HZ   LYS  25          1HZ       LYS  25  -5.930  16.830  12.995
  181   2HZ   LYS  25          2HZ       LYS  25  -4.741  15.760  13.402
  182   3HZ   LYS  25          3HZ       LYS  25  -4.710  16.504  11.937
  183    H    TYR  26           H        TYR  26  -6.025   9.046  13.724
  184    HA   TYR  26           HA       TYR  26  -7.990   8.813  15.923
  185   1HB   TYR  26          1HB       TYR  26  -6.457   6.802  14.215
  186   2HB   TYR  26          2HB       TYR  26  -7.514   6.344  15.549
  187    HD1  TYR  26           HD1      TYR  26  -9.379   8.988  14.314
  188    HD2  TYR  26           HD2      TYR  26  -8.053   5.034  13.176
  189    HE1  TYR  26           HE1      TYR  26 -11.558   8.541  13.363
  190    HE2  TYR  26           HE2      TYR  26 -10.201   4.686  11.982
  191    HH   TYR  26           HH       TYR  26 -12.737   7.165  11.861
  192    H    ASP  27           H        ASP  27  -6.488  10.172  17.180
  193    HA   ASP  27           HA       ASP  27  -4.503   8.551  18.700
  194   1HB   ASP  27          1HB       ASP  27  -5.309  11.489  18.872
  195   2HB   ASP  27          2HB       ASP  27  -4.176  10.654  19.936
  196    H    GLY  28           H        GLY  28  -4.926   8.396  21.056
  197   1HA   GLY  28          1HA       GLY  28  -7.303   7.408  21.874
  198   2HA   GLY  28          2HA       GLY  28  -6.232   8.282  22.970
  199    H    VAL  29           H        VAL  29  -9.236   8.316  21.279
  200    HA   VAL  29           HA       VAL  29 -11.103   9.484  21.458
  201    HB   VAL  29           HB       VAL  29 -10.025  10.862  23.933
  202   1HG1  VAL  29          1HG1      VAL  29 -12.825   9.947  23.106
  203   2HG1  VAL  29          2HG1      VAL  29 -12.403  10.641  24.683
  204   3HG1  VAL  29          3HG1      VAL  29 -12.288  11.633  23.240
  205   1HG2  VAL  29          1HG2      VAL  29 -11.167   8.046  23.673
  206   2HG2  VAL  29          2HG2      VAL  29  -9.544   8.479  24.261
  207   3HG2  VAL  29          3HG2      VAL  29 -10.960   8.913  25.208
  208    H    GLU  30           H        GLU  30  -8.653  10.546  20.073
  209    HA   GLU  30           HA       GLU  30  -7.798  12.337  19.098
  210   1HB   GLU  30          1HB       GLU  30 -10.390  12.322  18.347
  211   2HB   GLU  30          2HB       GLU  30 -10.361  13.902  19.144
  212   1HG   GLU  30          1HG       GLU  30  -8.327  14.451  17.696
  213   2HG   GLU  30          2HG       GLU  30  -8.573  12.885  16.890
  214    H    GLU  31           H        GLU  31  -8.038  12.248  22.129
  215    HA   GLU  31           HA       GLU  31  -7.742  15.135  22.835
  216   1HB   GLU  31          1HB       GLU  31  -8.113  12.624  24.532
  217   2HB   GLU  31          2HB       GLU  31  -7.770  14.240  25.168
  218   1HG   GLU  31          1HG       GLU  31  -9.840  15.111  24.104
  219   2HG   GLU  31          2HG       GLU  31 -10.226  13.484  23.535
  220    H    GLU  32           H        GLU  32  -6.155  11.920  22.990
  221    HA   GLU  32           HA       GLU  32  -3.646  12.981  24.045
  222   1HB   GLU  32          1HB       GLU  32  -4.277  10.361  22.635
  223   2HB   GLU  32          2HB       GLU  32  -2.807  10.732  23.554
  224   1HG   GLU  32          1HG       GLU  32  -4.142  10.954  25.626
  225   2HG   GLU  32          2HG       GLU  32  -5.624  10.577  24.729
  226    H    ASP  33           H        ASP  33  -3.953  14.736  22.125
  227    HA   ASP  33           HA       ASP  33  -3.439  13.856  19.448
  228   1HB   ASP  33          1HB       ASP  33  -3.612  16.171  18.858
  229   2HB   ASP  33          2HB       ASP  33  -4.880  15.768  20.019
  230    H    ASP  34           H        ASP  34  -1.327  12.735  20.492
  231    HA   ASP  34           HA       ASP  34   1.061  14.398  20.358
  232   1HB   ASP  34          1HB       ASP  34   2.301  12.271  20.329
  233   2HB   ASP  34          2HB       ASP  34   1.193  12.444  21.693
  234    H    GLU  35           H        GLU  35  -0.745  12.335  18.070
  235    HA   GLU  35           HA       GLU  35  -0.576  12.091  15.805
  236   1HB   GLU  35          1HB       GLU  35  -0.353  15.107  16.156
  237   2HB   GLU  35          2HB       GLU  35  -0.735  14.295  14.633
  238   1HG   GLU  35          1HG       GLU  35  -2.684  13.182  15.732
  239   2HG   GLU  35          2HG       GLU  35  -2.371  14.122  17.198
  240    H    GLU  36           H        GLU  36   1.649  11.082  16.393
  241    HA   GLU  36           HA       GLU  36   4.133  12.291  15.936
  242   1HB   GLU  36          1HB       GLU  36   3.227   9.458  15.289
  243   2HB   GLU  36          2HB       GLU  36   4.910   9.990  15.402
  244   1HG   GLU  36          1HG       GLU  36   4.598  10.558  17.787
  245   2HG   GLU  36          2HG       GLU  36   2.897  10.077  17.700
  246    HA   PRO  37           HA       PRO  37   3.342  12.845  11.493
  247   1HB   PRO  37          1HB       PRO  37   5.267  14.647  10.831
  248   2HB   PRO  37          2HB       PRO  37   3.853  15.065  11.839
  249   1HG   PRO  37          1HG       PRO  37   6.633  14.333  12.794
  250   2HG   PRO  37          2HG       PRO  37   5.649  15.742  13.278
  251   1HD   PRO  37          1HD       PRO  37   5.726  13.448  14.765
  252   2HD   PRO  37          2HD       PRO  37   4.235  14.409  14.609
  253    H    ASN  38           H        ASN  38   4.132  12.109   9.600
  254    HA   ASN  38           HA       ASN  38   5.330  10.216   8.645
  255   1HB   ASN  38          1HB       ASN  38   4.790  12.192   7.306
  256   2HB   ASN  38          2HB       ASN  38   6.303  12.967   7.788
  257   1HD2  ASN  38          2HD2      ASN  38   5.101   9.903   6.310
  258   2HD2  ASN  38          1HD2      ASN  38   6.371   9.735   5.133
  259    H    VAL  39           H        VAL  39   7.742  12.680   9.732
  260    HA   VAL  39           HA       VAL  39   9.931  10.936   9.024
  261    HB   VAL  39           HB       VAL  39   9.948  13.591  10.477
  262   1HG1  VAL  39          1HG1      VAL  39  12.234  11.885   9.386
  263   2HG1  VAL  39          2HG1      VAL  39  12.375  13.563   9.950
  264   3HG1  VAL  39          3HG1      VAL  39  11.960  12.285  11.096
  265   1HG2  VAL  39          1HG2      VAL  39  10.593  12.773   7.619
  266   2HG2  VAL  39          2HG2      VAL  39   9.170  13.698   8.141
  267   3HG2  VAL  39          3HG2      VAL  39  10.786  14.394   8.313
  268    HA   PRO  40           HA       PRO  40  10.613   9.997  13.632
  269   1HB   PRO  40          1HB       PRO  40   8.742  10.771  15.510
  270   2HB   PRO  40          2HB       PRO  40  10.200  11.712  15.087
  271   1HG   PRO  40          1HG       PRO  40   7.407  12.042  13.986
  272   2HG   PRO  40          2HG       PRO  40   8.475  13.321  14.638
  273   1HD   PRO  40          1HD       PRO  40   8.338  12.946  11.980
  274   2HD   PRO  40          2HD       PRO  40   9.932  13.169  12.750
  275    H    CYS  41           H        CYS  41   7.283  10.108  12.326
  276    HA   CYS  41           HA       CYS  41   6.429   7.655  13.592
  277   1HB   CYS  41          1HB       CYS  41   4.973   9.527  12.828
  278   2HB   CYS  41          2HB       CYS  41   5.312   9.060  11.156
  279    H    LEU  42           H        LEU  42   8.821   7.065  12.546
  280    HA   LEU  42           HA       LEU  42  10.100   5.881  11.213
  281   1HB   LEU  42          1HB       LEU  42   9.840   3.582  11.691
  282   2HB   LEU  42          2HB       LEU  42   9.501   4.595  13.076
  283    HG   LEU  42           HG       LEU  42   8.155   2.539  12.840
  284   1HD1  LEU  42          1HD1      LEU  42   7.409   4.510  14.221
  285   2HD1  LEU  42          2HD1      LEU  42   6.293   4.919  12.900
  286   3HD1  LEU  42          3HD1      LEU  42   6.150   3.370  13.719
  287   1HD2  LEU  42          1HD2      LEU  42   7.764   2.584  10.390
  288   2HD2  LEU  42          2HD2      LEU  42   6.290   2.347  11.343
  289   3HD2  LEU  42          3HD2      LEU  42   6.615   3.927  10.621
  290    H    VAL  43           H        VAL  43   7.344   6.350   9.365
  291    HA   VAL  43           HA       VAL  43   7.743   4.134   7.575
  292    HB   VAL  43           HB       VAL  43   5.594   5.044   8.172
  293   1HG1  VAL  43          1HG1      VAL  43   6.098   7.486   8.212
  294   2HG1  VAL  43          2HG1      VAL  43   6.203   7.476   6.444
  295   3HG1  VAL  43          3HG1      VAL  43   4.679   7.077   7.246
  296   1HG2  VAL  43          1HG2      VAL  43   5.788   3.722   6.142
  297   2HG2  VAL  43          2HG2      VAL  43   4.489   4.919   6.056
  298   3HG2  VAL  43          3HG2      VAL  43   5.998   5.203   5.178
  299    H    ARG  44           H        ARG  44  10.184   5.113   7.594
  300    HA   ARG  44           HA       ARG  44  10.631   7.135   5.537
  301   1HB   ARG  44          1HB       ARG  44  12.713   5.295   6.758
  302   2HB   ARG  44          2HB       ARG  44  12.944   6.885   6.032
  303   1HG   ARG  44          1HG       ARG  44  11.763   6.187   8.743
  304   2HG   ARG  44          2HG       ARG  44  13.171   7.175   8.365
  305   1HD   ARG  44          1HD       ARG  44  10.245   7.873   8.069
  306   2HD   ARG  44          2HD       ARG  44  11.469   8.675   9.051
  307    HE   ARG  44           HE       ARG  44  12.578   9.147   6.724
  308   1HH1  ARG  44          1HH1      ARG  44   9.092   9.422   7.534
  309   2HH1  ARG  44          2HH1      ARG  44   8.785  10.495   6.203
  310   1HH2  ARG  44          1HH2      ARG  44  12.086  10.524   4.986
  311   2HH2  ARG  44          2HH2      ARG  44  10.448  11.037   4.691
  312    H    VAL  45           H        VAL  45   9.174   4.827   4.588
  313    HA   VAL  45           HA       VAL  45  11.059   3.179   3.006
  314    HB   VAL  45           HB       VAL  45   9.403   2.023   4.256
  315   1HG1  VAL  45          1HG1      VAL  45   7.276   3.748   2.940
  316   2HG1  VAL  45          2HG1      VAL  45   6.947   2.225   3.783
  317   3HG1  VAL  45          3HG1      VAL  45   7.648   3.573   4.667
  318   1HG2  VAL  45          1HG2      VAL  45   9.978   1.191   1.963
  319   2HG2  VAL  45          2HG2      VAL  45   8.459   0.596   2.658
  320   3HG2  VAL  45          3HG2      VAL  45   8.415   1.849   1.418
  321    H    CYS  46           H        CYS  46  11.502   5.534   2.239
  322    HA   CYS  46           HA       CYS  46   9.640   6.919   0.600
  323   1HB   CYS  46          1HB       CYS  46  12.632   7.144   0.814
  324   2HB   CYS  46          2HB       CYS  46  11.591   8.344   0.045
  325    H    HIS  47           H        HIS  47   8.920   5.083  -0.780
  326    HA   HIS  47           HA       HIS  47  10.148   5.654  -3.418
  327   1HB   HIS  47          1HB       HIS  47  10.310   3.308  -4.051
  328   2HB   HIS  47          2HB       HIS  47  11.367   3.682  -2.691
  329    HD1  HIS  47           HD1      HIS  47   7.701   2.443  -2.907
  330    HD2  HIS  47           HD2      HIS  47  11.353   1.716  -0.961
  331    HE1  HIS  47           HE1      HIS  47   7.261   0.572  -1.186
  332    H    GLN  48           H        GLN  48   7.679   6.507  -2.269
  333    HA   GLN  48           HA       GLN  48   5.631   4.832  -3.684
  334   1HB   GLN  48          1HB       GLN  48   5.237   6.998  -1.600
  335   2HB   GLN  48          2HB       GLN  48   3.941   6.242  -2.496
  336   1HG   GLN  48          1HG       GLN  48   4.037   4.978  -0.543
  337   2HG   GLN  48          2HG       GLN  48   4.768   3.971  -1.777
  338   1HE2  GLN  48          2HE2      GLN  48   5.925   2.744  -0.123
  339   2HE2  GLN  48          1HE2      GLN  48   7.352   3.488   0.609
  340    H    ASP  49           H        ASP  49   3.767   6.135  -4.442
  341    HA   ASP  49           HA       ASP  49   4.629   8.090  -6.494
  342   1HB   ASP  49          1HB       ASP  49   3.449   6.205  -7.412
  343   2HB   ASP  49          2HB       ASP  49   2.110   6.404  -6.280
  344    H    CYS  50           H        CYS  50   1.319   8.093  -5.434
  345    HA   CYS  50           HA       CYS  50   1.709  10.715  -4.103
  346   1HB   CYS  50          1HB       CYS  50  -0.522  11.197  -5.118
  347   2HB   CYS  50          2HB       CYS  50   0.682  10.803  -6.345
  348    H    VAL  51           H        VAL  51  -0.050  11.498  -2.866
  349    HA   VAL  51           HA       VAL  51  -1.729   9.574  -1.427
  350    HB   VAL  51           HB       VAL  51  -1.073  10.314   0.763
  351   1HG1  VAL  51          1HG1      VAL  51   0.265   8.479  -0.189
  352   2HG1  VAL  51          2HG1      VAL  51   1.481   9.638  -0.763
  353   3HG1  VAL  51          3HG1      VAL  51   1.201   9.440   0.961
  354   1HG2  VAL  51          1HG2      VAL  51   0.664  12.338  -0.682
  355   2HG2  VAL  51          2HG2      VAL  51  -0.582  12.614   0.537
  356   3HG2  VAL  51          3HG2      VAL  51   0.951  11.888   1.013
  357    H    CYS  52           H        CYS  52  -2.957  11.311   0.279
  358    HA   CYS  52           HA       CYS  52  -4.725  12.558  -1.471
  359   1HB   CYS  52          1HB       CYS  52  -4.421  13.254   1.461
  360   2HB   CYS  52          2HB       CYS  52  -5.864  13.367   0.449
  361    H    GLU  53           H        GLU  53  -5.392  14.684  -1.855
  362    HA   GLU  53           HA       GLU  53  -3.400  16.722  -2.075
  363   1HB   GLU  53          1HB       GLU  53  -5.187  18.192  -2.726
  364   2HB   GLU  53          2HB       GLU  53  -5.398  16.637  -3.529
  365   1HG   GLU  53          1HG       GLU  53  -7.150  16.023  -1.867
  366   2HG   GLU  53          2HG       GLU  53  -6.918  17.559  -1.023
  367    H    GLU  54           H        GLU  54  -3.313  18.792  -0.972
  368    HA   GLU  54           HA       GLU  54  -3.568  18.626   1.888
  369   1HB   GLU  54          1HB       GLU  54  -3.223  20.997  -0.011
  370   2HB   GLU  54          2HB       GLU  54  -3.201  21.141   1.752
  371   1HG   GLU  54          1HG       GLU  54  -1.256  19.687   1.932
  372   2HG   GLU  54          2HG       GLU  54  -1.295  19.341   0.201
  373    H    GLY  55           H        GLY  55  -5.162  19.115   3.192
  374   1HA   GLY  55          1HA       GLY  55  -7.264  20.173   3.792
  375   2HA   GLY  55          2HA       GLY  55  -7.768  20.129   2.096
  376    H    PHE  56           H        PHE  56  -6.551  17.357   1.709
  377    HA   PHE  56           HA       PHE  56  -8.649  15.763   3.100
  378   1HB   PHE  56          1HB       PHE  56  -7.059  15.297   0.565
  379   2HB   PHE  56          2HB       PHE  56  -8.025  14.066   1.378
  380    HD1  PHE  56           HD1      PHE  56  -9.808  17.179   1.651
  381    HD2  PHE  56           HD2      PHE  56  -8.791  14.063  -1.158
  382    HE1  PHE  56           HE1      PHE  56 -11.905  17.581   0.442
  383    HE2  PHE  56           HE2      PHE  56 -10.946  14.420  -2.316
  384    HZ   PHE  56           HZ       PHE  56 -12.497  16.199  -1.542
  385    H    TYR  57           H        TYR  57  -7.956  13.706   3.943
  386    HA   TYR  57           HA       TYR  57  -5.099  13.506   4.715
  387   1HB   TYR  57          1HB       TYR  57  -7.580  13.418   6.496
  388   2HB   TYR  57          2HB       TYR  57  -6.018  12.789   6.989
  389    HD1  TYR  57           HD1      TYR  57  -7.635  15.989   5.779
  390    HD2  TYR  57           HD2      TYR  57  -4.559  14.179   8.186
  391    HE1  TYR  57           HE1      TYR  57  -7.030  18.204   6.660
  392    HE2  TYR  57           HE2      TYR  57  -3.942  16.405   9.067
  393    HH   TYR  57           HH       TYR  57  -5.639  19.390   8.078
  394    H    ARG  58           H        ARG  58  -4.579  11.207   5.193
  395    HA   ARG  58           HA       ARG  58  -6.053   9.601   3.222
  396   1HB   ARG  58          1HB       ARG  58  -4.260   7.956   3.553
  397   2HB   ARG  58          2HB       ARG  58  -3.654   9.573   3.243
  398   1HG   ARG  58          1HG       ARG  58  -2.323   8.419   4.887
  399   2HG   ARG  58          2HG       ARG  58  -3.057   9.853   5.613
  400   1HD   ARG  58          1HD       ARG  58  -4.657   8.501   6.813
  401   2HD   ARG  58          2HD       ARG  58  -4.187   7.032   5.903
  402    HE   ARG  58           HE       ARG  58  -1.870   7.653   7.044
  403   1HH1  ARG  58          1HH1      ARG  58  -5.211   7.083   8.223
  404   2HH1  ARG  58          2HH1      ARG  58  -4.673   6.409   9.732
  405   1HH2  ARG  58          1HH2      ARG  58  -1.218   6.754   9.021
  406   2HH2  ARG  58          2HH2      ARG  58  -2.378   6.187  10.194
  407    H    ASN  59           H        ASN  59  -7.743  10.180   5.385
  408    HA   ASN  59           HA       ASN  59  -9.117   9.207   6.927
  409   1HB   ASN  59          1HB       ASN  59  -9.542   8.649   4.373
  410   2HB   ASN  59          2HB       ASN  59  -9.353   6.982   4.887
  411   1HD2  ASN  59          2HD2      ASN  59 -11.607   9.187   4.162
  412   2HD2  ASN  59          1HD2      ASN  59 -12.868   8.887   5.364
  413    H    LYS  60           H        LYS  60  -9.830   6.371   7.098
  414    HA   LYS  60           HA       LYS  60  -7.849   5.290   8.878
  415   1HB   LYS  60          1HB       LYS  60  -9.264   3.309   8.861
  416   2HB   LYS  60          2HB       LYS  60 -10.205   4.793   9.042
  417   1HG   LYS  60          1HG       LYS  60 -10.758   4.628   6.522
  418   2HG   LYS  60          2HG       LYS  60  -9.923   3.076   6.531
  419   1HD   LYS  60          1HD       LYS  60 -12.278   2.679   6.711
  420   2HD   LYS  60          2HD       LYS  60 -11.492   2.200   8.217
  421   1HE   LYS  60          1HE       LYS  60 -13.643   3.363   8.580
  422   2HE   LYS  60          2HE       LYS  60 -12.321   4.235   9.346
  423   1HZ   LYS  60          1HZ       LYS  60 -13.511   4.896   6.738
  424   2HZ   LYS  60          2HZ       LYS  60 -13.838   5.642   8.168
  425   3HZ   LYS  60          3HZ       LYS  60 -12.334   5.767   7.501
  426    H    ASP  61           H        ASP  61  -8.570   4.904   5.419
  427    HA   ASP  61           HA       ASP  61  -5.971   3.649   4.913
  428   1HB   ASP  61          1HB       ASP  61  -7.418   1.737   5.571
  429   2HB   ASP  61          2HB       ASP  61  -8.583   2.192   4.314
  430    H    ASP  62           H        ASP  62  -6.032   5.863   4.001
  431    HA   ASP  62           HA       ASP  62  -6.056   7.327   2.350
  432   1HB   ASP  62          1HB       ASP  62  -4.422   5.515   1.631
  433   2HB   ASP  62          2HB       ASP  62  -5.668   4.961   0.499
  434    H    LYS  63           H        LYS  63  -8.749   6.413   2.977
  435    HA   LYS  63           HA       LYS  63 -10.201   6.812   0.429
  436   1HB   LYS  63          1HB       LYS  63 -11.307   6.870   3.253
  437   2HB   LYS  63          2HB       LYS  63 -12.196   6.697   1.750
  438   1HG   LYS  63          1HG       LYS  63 -10.326   4.700   3.102
  439   2HG   LYS  63          2HG       LYS  63 -12.061   4.558   2.870
  440   1HD   LYS  63          1HD       LYS  63  -9.941   4.479   0.664
  441   2HD   LYS  63          2HD       LYS  63 -10.799   3.103   1.346
  442   1HE   LYS  63          1HE       LYS  63 -12.971   4.036   0.540
  443   2HE   LYS  63          2HE       LYS  63 -12.105   5.396  -0.200
  444   1HZ   LYS  63          1HZ       LYS  63 -10.924   3.838  -1.556
  445   2HZ   LYS  63          2HZ       LYS  63 -11.732   2.570  -0.882
  446   3HZ   LYS  63          3HZ       LYS  63 -12.551   3.688  -1.773
  447    H    CYS  64           H        CYS  64  -8.704   8.640   0.102
  448    HA   CYS  64           HA       CYS  64  -8.287  10.820   1.623
  449   1HB   CYS  64          1HB       CYS  64  -8.535  10.768  -1.409
  450   2HB   CYS  64          2HB       CYS  64  -7.869  12.101  -0.478
  451    H    VAL  65           H        VAL  65  -9.768  11.873   2.791
  452    HA   VAL  65           HA       VAL  65 -11.210  13.982   1.484
  453    HB   VAL  65           HB       VAL  65 -13.290  13.661   2.832
  454   1HG1  VAL  65          1HG1      VAL  65 -13.205  13.165   0.379
  455   2HG1  VAL  65          2HG1      VAL  65 -12.971  11.447   0.782
  456   3HG1  VAL  65          3HG1      VAL  65 -14.451  12.279   1.278
  457   1HG2  VAL  65          1HG2      VAL  65 -12.358  11.890   4.392
  458   2HG2  VAL  65          2HG2      VAL  65 -13.960  11.556   3.692
  459   3HG2  VAL  65          3HG2      VAL  65 -12.537  10.740   3.051
  460    H    SER  66           H        SER  66 -12.019  15.482   3.449
  461    HA   SER  66           HA       SER  66  -9.807  15.970   5.096
  462   1HB   SER  66          1HB       SER  66 -12.700  16.764   5.523
  463   2HB   SER  66          2HB       SER  66 -11.278  17.553   6.233
  464    HG   SER  66           HG       SER  66 -10.539  17.963   4.076
  465    H    ALA  67           H        ALA  67  -9.231  15.438   7.136
  466    HA   ALA  67           HA       ALA  67  -9.731  12.989   8.199
  467   1HB   ALA  67          1HB       ALA  67  -7.848  14.397   8.873
  468   2HB   ALA  67          2HB       ALA  67  -8.946  15.502   9.730
  469   3HB   ALA  67          3HB       ALA  67  -8.733  13.827  10.289
  470    H    GLU  68           H        GLU  68 -11.588  15.919   8.903
  471    HA   GLU  68           HA       GLU  68 -13.217  15.326  11.019
  472   1HB   GLU  68          1HB       GLU  68 -14.001  16.442   8.295
  473   2HB   GLU  68          2HB       GLU  68 -15.008  16.537   9.745
  474   1HG   GLU  68          1HG       GLU  68 -13.394  17.913  10.900
  475   2HG   GLU  68          2HG       GLU  68 -12.184  17.708   9.631
  476    H    ASP  69           H        ASP  69 -13.630  14.038   7.685
  477    HA   ASP  69           HA       ASP  69 -16.042  12.573   8.067
  478   1HB   ASP  69          1HB       ASP  69 -15.131  12.881   5.839
  479   2HB   ASP  69          2HB       ASP  69 -13.605  12.109   6.302
  480    H    CYS  70           H        CYS  70 -12.640  11.620   8.382
  481    HA   CYS  70           HA       CYS  70 -13.110   8.867   9.016
  482   1HB   CYS  70          1HB       CYS  70 -11.082   9.625   7.987
  483   2HB   CYS  70          2HB       CYS  70 -10.727  10.723   9.304
  484    H    GLU  71           H        GLU  71 -12.255  11.712  10.986
  485    HA   GLU  71           HA       GLU  71 -12.153  10.664  13.587
  486   1HB   GLU  71          1HB       GLU  71 -13.263  13.299  12.569
  487   2HB   GLU  71          2HB       GLU  71 -12.958  12.941  14.269
  488   1HG   GLU  71          1HG       GLU  71 -10.612  12.849  13.968
  489   2HG   GLU  71          2HG       GLU  71 -10.729  12.674  12.218
  490    H    LEU  72           H        LEU  72 -15.032  12.083  11.928
  491    HA   LEU  72           HA       LEU  72 -16.907  11.305  13.918
  492   1HB   LEU  72          1HB       LEU  72 -17.218  11.815  10.934
  493   2HB   LEU  72          2HB       LEU  72 -18.584  11.602  12.031
  494    HG   LEU  72           HG       LEU  72 -16.487  13.781  12.439
  495   1HD1  LEU  72          1HD1      LEU  72 -17.562  14.076  10.241
  496   2HD1  LEU  72          2HD1      LEU  72 -19.165  13.947  10.997
  497   3HD1  LEU  72          3HD1      LEU  72 -18.099  15.317  11.384
  498   1HD2  LEU  72          1HD2      LEU  72 -19.320  13.410  13.511
  499   2HD2  LEU  72          2HD2      LEU  72 -17.820  13.275  14.454
  500   3HD2  LEU  72          3HD2      LEU  72 -18.294  14.834  13.775
  501    H    ASP  73           H        ASP  73 -15.948   9.682  10.885
  502    HA   ASP  73           HA       ASP  73 -17.779   7.651  10.821
  503   1HB   ASP  73          1HB       ASP  73 -16.164   8.161   9.021
  504   2HB   ASP  73          2HB       ASP  73 -14.860   7.456   9.991
  505    H    ASN  74           H        ASN  74 -14.904   7.731  12.945
  506    HA   ASN  74           HA       ASN  74 -14.902   4.963  13.648
  507   1HB   ASN  74          1HB       ASN  74 -13.138   6.530  14.415
  508   2HB   ASN  74          2HB       ASN  74 -14.316   7.346  15.446
  509   1HD2  ASN  74          2HD2      ASN  74 -12.391   4.392  15.008
  510   2HD2  ASN  74          1HD2      ASN  74 -12.735   3.720  16.590
  511    H    MET  75           H        MET  75 -16.779   7.708  14.862
  512    HA   MET  75           HA       MET  75 -18.528   8.025  16.176
  513   1HB   MET  75          1HB       MET  75 -19.263   5.165  15.437
  514   2HB   MET  75          2HB       MET  75 -20.331   6.337  16.209
  515   1HG   MET  75          1HG       MET  75 -20.127   7.859  14.309
  516   2HG   MET  75          2HG       MET  75 -19.026   6.754  13.489
  517   1HE   MET  75          1HE       MET  75 -19.665   4.526  12.368
  518   2HE   MET  75          2HE       MET  75 -20.329   3.871  13.886
  519   3HE   MET  75          3HE       MET  75 -21.298   3.821  12.399
  520    H    ASP  76           H        ASP  76 -17.522   4.722  16.885
  521    HA   ASP  76           HA       ASP  76 -18.450   4.307  19.350
  522   1HB   ASP  76          1HB       ASP  76 -17.277   2.745  17.812
  523   2HB   ASP  76          2HB       ASP  76 -15.732   3.419  18.312
  524    H    PHE  77           H        PHE  77 -15.013   5.434  18.977
  525    HA   PHE  77           HA       PHE  77 -15.363   7.473  20.935
  526   1HB   PHE  77          1HB       PHE  77 -14.036   6.659  22.817
  527   2HB   PHE  77          2HB       PHE  77 -15.492   5.739  22.624
  528    HD1  PHE  77           HD1      PHE  77 -11.798   5.655  22.386
  529    HD2  PHE  77           HD2      PHE  77 -15.444   3.374  22.113
  530    HE1  PHE  77           HE1      PHE  77 -10.507   3.552  22.609
  531    HE2  PHE  77           HE2      PHE  77 -14.138   1.269  22.220
  532    HZ   PHE  77           HZ       PHE  77 -11.664   1.354  22.477
  533    H    ILE  78           H        ILE  78 -13.789   6.638  18.348
  534    HA   ILE  78           HA       ILE  78 -11.854   7.055  17.329
  535    HB   ILE  78           HB       ILE  78 -11.593   9.412  19.211
  536   1HG1  ILE  78          1HG1      ILE  78 -13.024   9.087  16.529
  537   2HG1  ILE  78          2HG1      ILE  78 -13.812   9.328  18.095
  538   1HG2  ILE  78          1HG2      ILE  78  -9.536   8.824  17.892
  539   2HG2  ILE  78          2HG2      ILE  78 -10.512   8.856  16.413
  540   3HG2  ILE  78          3HG2      ILE  78 -10.236  10.336  17.343
  541   1HD1  ILE  78          1HD1      ILE  78 -12.686  11.548  18.293
  542   2HD1  ILE  78          2HD1      ILE  78 -12.091  11.346  16.622
  543   3HD1  ILE  78          3HD1      ILE  78 -13.827  11.409  16.942
  544    H    TYR  79           H        TYR  79 -10.870   5.169  17.788
  545    HA   TYR  79           HA       TYR  79  -9.737   4.460  20.244
  546   1HB   TYR  79          1HB       TYR  79  -8.940   3.471  17.478
  547   2HB   TYR  79          2HB       TYR  79  -8.718   2.595  18.988
  548    HD1  TYR  79           HD1      TYR  79 -11.835   3.676  19.727
  549    HD2  TYR  79           HD2      TYR  79  -9.869   1.250  16.739
  550    HE1  TYR  79           HE1      TYR  79 -13.886   2.426  19.411
  551    HE2  TYR  79           HE2      TYR  79 -11.998   0.008  16.388
  552    HH   TYR  79           HH       TYR  79 -14.905   0.615  18.381
  553    HA   PRO  80           HA       PRO  80  -5.559   6.200  19.887
  554   1HB   PRO  80          1HB       PRO  80  -4.164   4.589  21.590
  555   2HB   PRO  80          2HB       PRO  80  -5.336   5.795  22.178
  556   1HG   PRO  80          1HG       PRO  80  -5.794   2.830  21.763
  557   2HG   PRO  80          2HG       PRO  80  -6.231   3.818  23.185
  558   1HD   PRO  80          1HD       PRO  80  -8.018   3.196  21.207
  559   2HD   PRO  80          2HD       PRO  80  -8.080   4.766  22.060
  560    H    GLY  81           H        GLY  81  -5.480   5.630  17.691
  561   1HA   GLY  81          1HA       GLY  81  -5.325   3.110  16.549
  562   2HA   GLY  81          2HA       GLY  81  -4.750   4.612  15.816
  563    H    THR  82           H        THR  82  -3.828   1.993  17.970
  564    HA   THR  82           HA       THR  82  -1.938   0.780  18.258
  565    HB   THR  82           HB       THR  82  -0.337   0.539  16.388
  566    HG1  THR  82           HG1      THR  82  -1.079   2.865  15.646
  567   1HG2  THR  82          1HG2      THR  82  -2.438  -0.806  16.498
  568   2HG2  THR  82          2HG2      THR  82  -3.291   0.446  15.571
  569   3HG2  THR  82          3HG2      THR  82  -1.965  -0.462  14.823
  570    H    ARG  83           H        ARG  83  -1.517   2.038  20.045
  571    HA   ARG  83           HA       ARG  83  -0.214   3.204  21.477
  572   1HB   ARG  83          1HB       ARG  83   1.558   4.180  19.205
  573   2HB   ARG  83          2HB       ARG  83   1.837   4.294  20.936
  574   1HG   ARG  83          1HG       ARG  83   1.989   1.818  21.086
  575   2HG   ARG  83          2HG       ARG  83   1.751   1.701  19.333
  576   1HD   ARG  83          1HD       ARG  83   4.087   3.090  20.731
  577   2HD   ARG  83          2HD       ARG  83   4.123   1.544  19.903
  578    HE   ARG  83           HE       ARG  83   3.951   2.538  17.811
  579   1HH1  ARG  83          1HH1      ARG  83   3.913   5.054  20.318
  580   2HH1  ARG  83          2HH1      ARG  83   4.184   6.355  19.189
  581   1HH2  ARG  83          1HH2      ARG  83   4.296   4.242  16.357
  582   2HH2  ARG  83          2HH2      ARG  83   4.412   5.889  16.925
  583    H    ASN  84           H        ASN  84  -0.247   4.946  18.404
  584    HA   ASN  84           HA       ASN  84  -2.413   6.501  18.393
  585   1HB   ASN  84          1HB       ASN  84  -0.261   7.859  20.071
  586   2HB   ASN  84          2HB       ASN  84  -1.340   8.807  19.045
  587   1HD2  ASN  84          2HD2      ASN  84  -1.217   9.201  21.818
  588   2HD2  ASN  84          1HD2      ASN  84  -2.701   8.598  22.575
  589    HA   PRO  85           HA       PRO  85   0.260   7.156  14.800
  590   1HB   PRO  85          1HB       PRO  85  -1.469   8.256  13.044
  591   2HB   PRO  85          2HB       PRO  85  -1.770   6.633  13.714
  592   1HG   PRO  85          1HG       PRO  85  -2.923   9.252  14.733
  593   2HG   PRO  85          2HG       PRO  85  -3.823   7.781  14.258
  594   1HD   PRO  85          1HD       PRO  85  -3.088   8.280  16.860
  595   2HD   PRO  85          2HD       PRO  85  -3.123   6.622  16.185
  Start of MODEL   13
    1   1H    LYS   1          1H        LYS   1   4.946   4.520  -4.017
    2   2H    LYS   1          2H        LYS   1   3.722   4.361  -2.926
    3   3H    LYS   1          3H        LYS   1   5.174   3.644  -2.643
    4    HA   LYS   1           HA       LYS   1   4.880   2.213  -4.555
    5   1HB   LYS   1          1HB       LYS   1   2.627   2.068  -2.509
    6   2HB   LYS   1          2HB       LYS   1   3.105   0.780  -3.635
    7   1HG   LYS   1          1HG       LYS   1   5.440   0.909  -2.672
    8   2HG   LYS   1          2HG       LYS   1   4.803   1.990  -1.407
    9   1HD   LYS   1          1HD       LYS   1   3.182   0.145  -0.801
   10   2HD   LYS   1          2HD       LYS   1   4.013  -0.905  -1.961
   11   1HE   LYS   1          1HE       LYS   1   5.249   0.431   0.502
   12   2HE   LYS   1          2HE       LYS   1   4.889  -1.292   0.304
   13   1HZ   LYS   1          1HZ       LYS   1   6.495  -1.312  -1.502
   14   2HZ   LYS   1          2HZ       LYS   1   6.867   0.269  -1.213
   15   3HZ   LYS   1          3HZ       LYS   1   7.175  -0.869  -0.069
   16    H    ALA   2           H        ALA   2   1.994   4.226  -3.914
   17    HA   ALA   2           HA       ALA   2   0.860   3.697  -6.578
   18   1HB   ALA   2          1HB       ALA   2  -0.589   4.147  -4.631
   19   2HB   ALA   2          2HB       ALA   2   0.173   5.735  -4.407
   20   3HB   ALA   2          3HB       ALA   2  -0.790   5.413  -5.853
   21    H    THR   3           H        THR   3   3.345   4.292  -7.090
   22    HA   THR   3           HA       THR   3   4.841   6.386  -6.906
   23    HB   THR   3           HB       THR   3   5.524   6.195  -9.310
   24    HG1  THR   3           HG1      THR   3   3.341   4.364  -9.361
   25   1HG2  THR   3          1HG2      THR   3   6.397   4.650  -7.560
   26   2HG2  THR   3          2HG2      THR   3   5.083   3.512  -7.919
   27   3HG2  THR   3          3HG2      THR   3   6.282   3.896  -9.160
   28    H    MET   4           H        MET   4   2.776   6.621  -9.743
   29    HA   MET   4           HA       MET   4   2.085   9.471  -9.092
   30   1HB   MET   4          1HB       MET   4   2.708   8.273 -11.828
   31   2HB   MET   4          2HB       MET   4   2.120   9.915 -11.517
   32   1HG   MET   4          1HG       MET   4   4.151  10.428 -10.231
   33   2HG   MET   4          2HG       MET   4   4.750   8.785 -10.488
   34   1HE   MET   4          1HE       MET   4   3.983  12.247 -12.126
   35   2HE   MET   4          2HE       MET   4   4.491  11.976 -13.810
   36   3HE   MET   4          3HE       MET   4   3.023  11.191 -13.195
   37    H    GLN   5           H        GLN   5   0.708   6.876  -8.467
   38    HA   GLN   5           HA       GLN   5  -1.503   6.759 -10.463
   39   1HB   GLN   5          1HB       GLN   5  -0.831   5.032  -8.060
   40   2HB   GLN   5          2HB       GLN   5  -2.334   4.916  -8.982
   41   1HG   GLN   5          1HG       GLN   5  -0.883   3.248  -9.821
   42   2HG   GLN   5          2HG       GLN   5  -1.019   4.490 -11.067
   43   1HE2  GLN   5          2HE2      GLN   5   0.952   5.454 -11.807
   44   2HE2  GLN   5          1HE2      GLN   5   2.507   5.059 -11.071
   45    H    CYS   6           H        CYS   6  -1.715   9.098  -9.835
   46    HA   CYS   6           HA       CYS   6  -3.022   9.755  -7.328
   47   1HB   CYS   6          1HB       CYS   6  -2.877  11.323  -9.927
   48   2HB   CYS   6          2HB       CYS   6  -3.320  11.952  -8.335
   49    H    GLY   7           H        GLY   7  -4.522   7.785  -7.793
   50   1HA   GLY   7          1HA       GLY   7  -6.626   7.990  -9.737
   51   2HA   GLY   7          2HA       GLY   7  -6.608   6.949  -8.306
   52    H    GLU   8           H        GLU   8  -6.247   9.207  -6.435
   53    HA   GLU   8           HA       GLU   8  -9.001  10.384  -6.503
   54   1HB   GLU   8          1HB       GLU   8  -7.461   9.672  -3.980
   55   2HB   GLU   8          2HB       GLU   8  -9.163  10.098  -4.165
   56   1HG   GLU   8          1HG       GLU   8  -9.297   7.836  -3.843
   57   2HG   GLU   8          2HG       GLU   8  -9.368   7.948  -5.607
   58    H    ASN   9           H        ASN   9  -8.762  12.043  -4.419
   59    HA   ASN   9           HA       ASN   9  -7.291  14.351  -5.284
   60   1HB   ASN   9          1HB       ASN   9  -8.035  15.220  -3.019
   61   2HB   ASN   9          2HB       ASN   9  -9.296  14.796  -4.182
   62   1HD2  ASN   9          2HD2      ASN   9  -9.570  15.083  -1.250
   63   2HD2  ASN   9          1HD2      ASN   9 -10.184  13.523  -0.729
   64    H    GLU  10           H        GLU  10  -5.286  13.174  -5.516
   65    HA   GLU  10           HA       GLU  10  -3.637  13.113  -3.045
   66   1HB   GLU  10          1HB       GLU  10  -3.622  11.374  -5.549
   67   2HB   GLU  10          2HB       GLU  10  -2.422  11.241  -4.259
   68   1HG   GLU  10          1HG       GLU  10  -4.033  10.473  -2.669
   69   2HG   GLU  10          2HG       GLU  10  -5.390  10.832  -3.740
   70    H    LYS  11           H        LYS  11  -1.251  13.369  -3.541
   71    HA   LYS  11           HA       LYS  11  -0.572  14.992  -5.916
   72   1HB   LYS  11          1HB       LYS  11   0.642  16.599  -4.511
   73   2HB   LYS  11          2HB       LYS  11  -1.093  16.647  -4.186
   74   1HG   LYS  11          1HG       LYS  11  -0.772  15.332  -2.116
   75   2HG   LYS  11          2HG       LYS  11   0.950  15.148  -2.474
   76   1HD   LYS  11          1HD       LYS  11   1.321  17.559  -2.315
   77   2HD   LYS  11          2HD       LYS  11  -0.402  17.835  -2.039
   78   1HE   LYS  11          1HE       LYS  11   0.823  17.910   0.080
   79   2HE   LYS  11          2HE       LYS  11  -0.292  16.529   0.075
   80   1HZ   LYS  11          1HZ       LYS  11   2.596  16.424  -0.462
   81   2HZ   LYS  11          2HZ       LYS  11   1.849  15.960   0.933
   82   3HZ   LYS  11          3HZ       LYS  11   1.571  15.133  -0.461
   83    H    TYR  12           H        TYR  12   1.676  14.805  -6.469
   84    HA   TYR  12           HA       TYR  12   2.901  12.317  -5.771
   85   1HB   TYR  12          1HB       TYR  12   3.198  13.523  -7.913
   86   2HB   TYR  12          2HB       TYR  12   4.133  14.760  -7.072
   87    HD1  TYR  12           HD1      TYR  12   3.997  11.117  -7.893
   88    HD2  TYR  12           HD2      TYR  12   6.479  14.371  -6.548
   89    HE1  TYR  12           HE1      TYR  12   6.017   9.754  -8.332
   90    HE2  TYR  12           HE2      TYR  12   8.501  12.993  -6.953
   91    HH   TYR  12           HH       TYR  12   8.321   9.828  -8.575
   92    H    ASP  13           H        ASP  13   4.347  11.780  -4.127
   93    HA   ASP  13           HA       ASP  13   6.102  13.836  -3.059
   94   1HB   ASP  13          1HB       ASP  13   4.117  14.093  -1.590
   95   2HB   ASP  13          2HB       ASP  13   4.167  12.355  -1.245
   96    H    SER  14           H        SER  14   7.815  12.905  -1.791
   97    HA   SER  14           HA       SER  14   8.532  10.176  -2.759
   98   1HB   SER  14          1HB       SER  14  10.269  12.303  -1.475
   99   2HB   SER  14          2HB       SER  14  10.798  10.806  -2.252
  100    HG   SER  14           HG       SER  14   9.388  12.948  -3.508
  101    H    CYS  15           H        CYS  15   6.637   9.669  -0.924
  102    HA   CYS  15           HA       CYS  15   8.240   8.725   1.303
  103   1HB   CYS  15          1HB       CYS  15   7.068  11.228   1.674
  104   2HB   CYS  15          2HB       CYS  15   6.068  10.136   2.612
  105    H    GLY  16           H        GLY  16   7.296   7.050  -0.319
  106   1HA   GLY  16          1HA       GLY  16   6.441   4.944  -0.278
  107   2HA   GLY  16          2HA       GLY  16   6.379   5.112   1.469
  108    H    SER  17           H        SER  17   4.448   3.769   1.399
  109    HA   SER  17           HA       SER  17   2.155   4.339  -0.041
  110   1HB   SER  17          1HB       SER  17   2.305   2.938   2.662
  111   2HB   SER  17          2HB       SER  17   1.212   2.594   1.307
  112    HG   SER  17           HG       SER  17   3.025   1.150   1.440
  113    H    LYS  18           H        LYS  18   2.358   6.852   0.607
  114    HA   LYS  18           HA       LYS  18   1.694   8.702   1.712
  115   1HB   LYS  18          1HB       LYS  18  -0.609   7.113   2.853
  116   2HB   LYS  18          2HB       LYS  18  -0.549   8.835   2.467
  117   1HG   LYS  18          1HG       LYS  18  -0.190   8.000   0.004
  118   2HG   LYS  18          2HG       LYS  18  -0.778   6.451   0.591
  119   1HD   LYS  18          1HD       LYS  18  -2.910   7.381   1.251
  120   2HD   LYS  18          2HD       LYS  18  -2.335   9.037   1.046
  121   1HE   LYS  18          1HE       LYS  18  -3.858   8.215  -0.779
  122   2HE   LYS  18          2HE       LYS  18  -2.317   8.857  -1.345
  123   1HZ   LYS  18          1HZ       LYS  18  -2.934   6.013  -1.018
  124   2HZ   LYS  18          2HZ       LYS  18  -2.904   6.867  -2.439
  125   3HZ   LYS  18          3HZ       LYS  18  -1.512   6.646  -1.584
  126    H    GLU  19           H        GLU  19   3.773   7.471   2.982
  127    HA   GLU  19           HA       GLU  19   3.123   6.338   5.479
  128   1HB   GLU  19          1HB       GLU  19   5.759   7.499   4.575
  129   2HB   GLU  19          2HB       GLU  19   5.495   6.509   6.023
  130   1HG   GLU  19          1HG       GLU  19   4.417   4.748   4.491
  131   2HG   GLU  19          2HG       GLU  19   5.013   5.695   3.139
  132    H    CYS  20           H        CYS  20   2.257   7.194   7.090
  133    HA   CYS  20           HA       CYS  20   1.255   8.585   8.454
  134   1HB   CYS  20          1HB       CYS  20   3.826  10.045   9.012
  135   2HB   CYS  20          2HB       CYS  20   2.598   9.404  10.113
  136    H    ASP  21           H        ASP  21   1.289   9.432   5.672
  137    HA   ASP  21           HA       ASP  21   1.366  12.385   5.727
  138   1HB   ASP  21          1HB       ASP  21   2.260  11.345   3.744
  139   2HB   ASP  21          2HB       ASP  21   0.806  10.349   3.555
  140    H    LYS  22           H        LYS  22  -0.318  13.232   6.733
  141    HA   LYS  22           HA       LYS  22  -2.400  13.609   7.556
  142   1HB   LYS  22          1HB       LYS  22  -3.362  12.891   4.774
  143   2HB   LYS  22          2HB       LYS  22  -4.013  14.092   5.887
  144   1HG   LYS  22          1HG       LYS  22  -1.396  14.241   4.322
  145   2HG   LYS  22          2HG       LYS  22  -2.882  15.089   3.960
  146   1HD   LYS  22          1HD       LYS  22  -1.079  15.529   6.384
  147   2HD   LYS  22          2HD       LYS  22  -1.299  16.607   5.005
  148   1HE   LYS  22          1HE       LYS  22  -3.355  15.908   7.134
  149   2HE   LYS  22          2HE       LYS  22  -2.561  17.467   6.898
  150   1HZ   LYS  22          1HZ       LYS  22  -3.664  17.619   4.770
  151   2HZ   LYS  22          2HZ       LYS  22  -4.447  16.186   5.034
  152   3HZ   LYS  22          3HZ       LYS  22  -4.748  17.481   6.004
  153    H    LYS  23           H        LYS  23  -1.690  10.967   8.276
  154    HA   LYS  23           HA       LYS  23  -3.859   9.196   7.573
  155   1HB   LYS  23          1HB       LYS  23  -2.983   7.632   8.986
  156   2HB   LYS  23          2HB       LYS  23  -1.577   8.462   8.332
  157   1HG   LYS  23          1HG       LYS  23  -2.781   8.768  11.123
  158   2HG   LYS  23          2HG       LYS  23  -1.315   7.894  10.666
  159   1HD   LYS  23          1HD       LYS  23  -0.199   9.999  10.021
  160   2HD   LYS  23          2HD       LYS  23  -1.665  10.914  10.429
  161   1HE   LYS  23          1HE       LYS  23  -0.055  11.037  12.256
  162   2HE   LYS  23          2HE       LYS  23  -1.539  10.212  12.764
  163   1HZ   LYS  23          1HZ       LYS  23   0.947   8.873  11.959
  164   2HZ   LYS  23          2HZ       LYS  23   0.469   9.124  13.515
  165   3HZ   LYS  23          3HZ       LYS  23  -0.403   8.125  12.540
  166    H    CYS  24           H        CYS  24  -5.924   8.975   8.532
  167    HA   CYS  24           HA       CYS  24  -6.850  11.038  10.298
  168   1HB   CYS  24          1HB       CYS  24  -8.337   9.785   8.833
  169   2HB   CYS  24          2HB       CYS  24  -7.958   8.268   9.691
  170    H    LYS  25           H        LYS  25  -7.369  10.879  12.567
  171    HA   LYS  25           HA       LYS  25  -6.239   8.540  13.996
  172   1HB   LYS  25          1HB       LYS  25  -4.809  10.692  14.266
  173   2HB   LYS  25          2HB       LYS  25  -6.214  11.327  15.150
  174   1HG   LYS  25          1HG       LYS  25  -4.524  10.448  16.666
  175   2HG   LYS  25          2HG       LYS  25  -6.065   9.617  16.834
  176   1HD   LYS  25          1HD       LYS  25  -4.093   8.125  16.982
  177   2HD   LYS  25          2HD       LYS  25  -5.210   7.627  15.717
  178   1HE   LYS  25          1HE       LYS  25  -3.759   8.560  13.979
  179   2HE   LYS  25          2HE       LYS  25  -2.716   9.326  15.195
  180   1HZ   LYS  25          1HZ       LYS  25  -3.122   6.437  14.949
  181   2HZ   LYS  25          2HZ       LYS  25  -1.849   7.245  14.294
  182   3HZ   LYS  25          3HZ       LYS  25  -2.047   7.201  15.933
  183    H    TYR  26           H        TYR  26  -7.675   7.556  15.130
  184    HA   TYR  26           HA       TYR  26  -9.512   8.911  16.815
  185   1HB   TYR  26          1HB       TYR  26 -11.453   7.418  15.988
  186   2HB   TYR  26          2HB       TYR  26 -11.117   8.939  15.181
  187    HD1  TYR  26           HD1      TYR  26  -9.633   5.463  14.722
  188    HD2  TYR  26           HD2      TYR  26 -11.964   8.679  13.037
  189    HE1  TYR  26           HE1      TYR  26  -9.761   4.253  12.596
  190    HE2  TYR  26           HE2      TYR  26 -12.152   7.429  10.930
  191    HH   TYR  26           HH       TYR  26 -10.952   5.681   9.681
  192    H    ASP  27           H        ASP  27 -10.347   7.346  18.257
  193    HA   ASP  27           HA       ASP  27  -8.654   5.440  19.372
  194   1HB   ASP  27          1HB       ASP  27 -10.742   4.282  20.259
  195   2HB   ASP  27          2HB       ASP  27 -10.507   5.989  20.623
  196    H    GLY  28           H        GLY  28 -11.128   4.749  16.932
  197   1HA   GLY  28          1HA       GLY  28 -11.009   3.362  15.076
  198   2HA   GLY  28          2HA       GLY  28  -9.319   3.008  15.473
  199    H    VAL  29           H        VAL  29 -11.899   2.470  17.819
  200    HA   VAL  29           HA       VAL  29 -11.535  -0.450  17.667
  201    HB   VAL  29           HB       VAL  29 -11.653   0.661  19.820
  202   1HG1  VAL  29          1HG1      VAL  29 -13.240   2.510  19.342
  203   2HG1  VAL  29          2HG1      VAL  29 -14.568   1.334  19.263
  204   3HG1  VAL  29          3HG1      VAL  29 -13.680   1.569  20.771
  205   1HG2  VAL  29          1HG2      VAL  29 -12.334  -1.696  19.591
  206   2HG2  VAL  29          2HG2      VAL  29 -13.150  -0.869  20.928
  207   3HG2  VAL  29          3HG2      VAL  29 -14.029  -1.196  19.427
  208    H    GLU  30           H        GLU  30 -12.122   0.080  15.276
  209    HA   GLU  30           HA       GLU  30 -14.714  -1.020  14.733
  210   1HB   GLU  30          1HB       GLU  30 -15.458   0.943  13.328
  211   2HB   GLU  30          2HB       GLU  30 -15.555   1.210  15.072
  212   1HG   GLU  30          1HG       GLU  30 -13.587   2.605  15.069
  213   2HG   GLU  30          2HG       GLU  30 -13.205   2.185  13.391
  214    H    GLU  31           H        GLU  31 -14.697  -1.880  12.694
  215    HA   GLU  31           HA       GLU  31 -13.744  -2.896  10.898
  216   1HB   GLU  31          1HB       GLU  31 -12.825  -0.087  10.189
  217   2HB   GLU  31          2HB       GLU  31 -13.264  -1.401   9.089
  218   1HG   GLU  31          1HG       GLU  31 -15.122   0.223  10.884
  219   2HG   GLU  31          2HG       GLU  31 -15.092   0.169   9.123
  220    H    GLU  32           H        GLU  32 -12.068  -3.085  13.122
  221    HA   GLU  32           HA       GLU  32  -9.406  -2.359  12.763
  222   1HB   GLU  32          1HB       GLU  32 -10.513  -4.861  14.137
  223   2HB   GLU  32          2HB       GLU  32  -8.880  -4.207  14.289
  224   1HG   GLU  32          1HG       GLU  32  -9.774  -3.256  16.143
  225   2HG   GLU  32          2HG       GLU  32 -10.129  -1.964  14.999
  226    H    ASP  33           H        ASP  33 -11.189  -4.954  11.250
  227    HA   ASP  33           HA       ASP  33  -9.290  -6.601  10.109
  228   1HB   ASP  33          1HB       ASP  33 -11.728  -5.403   8.720
  229   2HB   ASP  33          2HB       ASP  33 -10.894  -6.898   8.279
  230    H    ASP  34           H        ASP  34  -9.957  -3.201   9.269
  231    HA   ASP  34           HA       ASP  34  -8.614  -3.196   6.741
  232   1HB   ASP  34          1HB       ASP  34 -10.250  -1.483   7.541
  233   2HB   ASP  34          2HB       ASP  34  -9.051  -0.913   8.711
  234    H    GLU  35           H        GLU  35  -7.463  -3.092  10.047
  235    HA   GLU  35           HA       GLU  35  -5.504  -3.009  11.052
  236   1HB   GLU  35          1HB       GLU  35  -4.364  -3.857   8.357
  237   2HB   GLU  35          2HB       GLU  35  -3.504  -3.868   9.905
  238   1HG   GLU  35          1HG       GLU  35  -5.210  -5.425  10.841
  239   2HG   GLU  35          2HG       GLU  35  -6.029  -5.455   9.274
  240    H    GLU  36           H        GLU  36  -4.693  -1.641   7.867
  241    HA   GLU  36           HA       GLU  36  -3.361   0.126   7.283
  242   1HB   GLU  36          1HB       GLU  36  -5.729   0.875   7.693
  243   2HB   GLU  36          2HB       GLU  36  -5.161   1.598   9.203
  244   1HG   GLU  36          1HG       GLU  36  -3.461   2.896   7.793
  245   2HG   GLU  36          2HG       GLU  36  -4.238   2.228   6.348
  246    HA   PRO  37           HA       PRO  37  -0.606   0.142  11.110
  247   1HB   PRO  37          1HB       PRO  37   1.726  -0.563   9.800
  248   2HB   PRO  37          2HB       PRO  37   0.545  -1.719  10.467
  249   1HG   PRO  37          1HG       PRO  37   0.745  -0.711   7.618
  250   2HG   PRO  37          2HG       PRO  37   0.630  -2.408   8.174
  251   1HD   PRO  37          1HD       PRO  37  -1.551  -1.098   7.335
  252   2HD   PRO  37          2HD       PRO  37  -1.665  -2.127   8.789
  253    H    ASN  38           H        ASN  38  -0.906   1.886   8.181
  254    HA   ASN  38           HA       ASN  38   1.124   3.845   8.578
  255   1HB   ASN  38          1HB       ASN  38  -0.316   3.378   6.480
  256   2HB   ASN  38          2HB       ASN  38  -1.618   4.263   7.298
  257   1HD2  ASN  38          2HD2      ASN  38  -1.563   5.935   5.618
  258   2HD2  ASN  38          1HD2      ASN  38  -0.169   7.001   5.482
  259    H    VAL  39           H        VAL  39  -2.115   3.356   9.988
  260    HA   VAL  39           HA       VAL  39  -2.531   5.959  11.002
  261    HB   VAL  39           HB       VAL  39  -3.554   3.263  11.924
  262   1HG1  VAL  39          1HG1      VAL  39  -4.293   6.042  12.948
  263   2HG1  VAL  39          2HG1      VAL  39  -5.233   4.565  13.235
  264   3HG1  VAL  39          3HG1      VAL  39  -3.608   4.707  13.911
  265   1HG2  VAL  39          1HG2      VAL  39  -4.265   4.135   9.727
  266   2HG2  VAL  39          2HG2      VAL  39  -5.605   4.046  10.881
  267   3HG2  VAL  39          3HG2      VAL  39  -4.861   5.615  10.502
  268    HA   PRO  40           HA       PRO  40   0.069   5.010  14.851
  269   1HB   PRO  40          1HB       PRO  40   1.207   2.599  15.367
  270   2HB   PRO  40          2HB       PRO  40  -0.523   2.905  15.664
  271   1HG   PRO  40          1HG       PRO  40   0.702   1.664  13.175
  272   2HG   PRO  40          2HG       PRO  40  -0.573   0.963  14.217
  273   1HD   PRO  40          1HD       PRO  40  -1.247   2.352  12.006
  274   2HD   PRO  40          2HD       PRO  40  -2.155   2.575  13.524
  275    H    CYS  41           H        CYS  41   0.885   5.424  11.891
  276    HA   CYS  41           HA       CYS  41   2.700   5.707  10.643
  277   1HB   CYS  41          1HB       CYS  41   2.554   7.587  12.221
  278   2HB   CYS  41          2HB       CYS  41   3.674   6.782  13.323
  279    H    LEU  42           H        LEU  42   2.797   3.062  11.058
  280    HA   LEU  42           HA       LEU  42   5.397   2.285  12.144
  281   1HB   LEU  42          1HB       LEU  42   3.305   0.981  12.298
  282   2HB   LEU  42          2HB       LEU  42   3.368   0.680  10.561
  283    HG   LEU  42           HG       LEU  42   5.685  -0.098  12.373
  284   1HD1  LEU  42          1HD1      LEU  42   3.174  -1.732  11.813
  285   2HD1  LEU  42          2HD1      LEU  42   4.634  -2.321  12.638
  286   3HD1  LEU  42          3HD1      LEU  42   3.653  -1.050  13.382
  287   1HD2  LEU  42          1HD2      LEU  42   4.612  -1.217   9.731
  288   2HD2  LEU  42          2HD2      LEU  42   6.141  -0.341   9.951
  289   3HD2  LEU  42          3HD2      LEU  42   5.935  -1.932  10.671
  290    H    VAL  43           H        VAL  43   3.919   2.342   8.883
  291    HA   VAL  43           HA       VAL  43   6.081   1.135   7.567
  292    HB   VAL  43           HB       VAL  43   5.000   2.088   5.468
  293   1HG1  VAL  43          1HG1      VAL  43   4.502  -0.148   6.346
  294   2HG1  VAL  43          2HG1      VAL  43   3.275   0.528   7.437
  295   3HG1  VAL  43          3HG1      VAL  43   3.044   0.606   5.678
  296   1HG2  VAL  43          1HG2      VAL  43   3.910   4.101   6.650
  297   2HG2  VAL  43          2HG2      VAL  43   2.849   3.138   5.604
  298   3HG2  VAL  43          3HG2      VAL  43   2.771   2.944   7.356
  299    H    ARG  44           H        ARG  44   8.008   1.764   6.873
  300    HA   ARG  44           HA       ARG  44   8.727   4.655   6.997
  301   1HB   ARG  44          1HB       ARG  44   9.446   2.789   8.813
  302   2HB   ARG  44          2HB       ARG  44  10.655   2.420   7.588
  303   1HG   ARG  44          1HG       ARG  44  11.848   3.954   8.787
  304   2HG   ARG  44          2HG       ARG  44  11.032   5.109   7.730
  305   1HD   ARG  44          1HD       ARG  44  10.247   4.260  10.550
  306   2HD   ARG  44          2HD       ARG  44  10.867   5.849  10.064
  307    HE   ARG  44           HE       ARG  44   8.717   5.812   8.542
  308   1HH1  ARG  44          1HH1      ARG  44   8.880   5.014  12.026
  309   2HH1  ARG  44          2HH1      ARG  44   7.122   4.995  12.149
  310   1HH2  ARG  44          1HH2      ARG  44   6.452   5.463   8.808
  311   2HH2  ARG  44          2HH2      ARG  44   5.845   5.541  10.469
  312    H    VAL  45           H        VAL  45   8.254   2.493   4.632
  313    HA   VAL  45           HA       VAL  45  10.852   2.755   3.240
  314    HB   VAL  45           HB       VAL  45   9.726   1.474   1.442
  315   1HG1  VAL  45          1HG1      VAL  45  11.139   0.410   3.152
  316   2HG1  VAL  45          2HG1      VAL  45   9.723   0.184   4.201
  317   3HG1  VAL  45          3HG1      VAL  45   9.823  -0.660   2.644
  318   1HG2  VAL  45          1HG2      VAL  45   7.317   1.980   1.947
  319   2HG2  VAL  45          2HG2      VAL  45   7.672   0.253   1.873
  320   3HG2  VAL  45          3HG2      VAL  45   7.460   1.031   3.443
  321    H    CYS  46           H        CYS  46  10.471   5.155   3.645
  322    HA   CYS  46           HA       CYS  46   8.461   6.476   2.150
  323   1HB   CYS  46          1HB       CYS  46  10.668   7.326   3.884
  324   2HB   CYS  46          2HB       CYS  46  10.292   8.482   2.618
  325    H    HIS  47           H        HIS  47   8.693   5.497   0.033
  326    HA   HIS  47           HA       HIS  47  10.499   7.161  -1.690
  327   1HB   HIS  47          1HB       HIS  47  10.769   5.315  -3.188
  328   2HB   HIS  47          2HB       HIS  47  11.221   4.777  -1.570
  329    HD1  HIS  47           HD1      HIS  47   8.045   4.625  -3.847
  330    HD2  HIS  47           HD2      HIS  47  10.041   2.559  -0.761
  331    HE1  HIS  47           HE1      HIS  47   6.795   2.474  -3.494
  332    H    GLN  48           H        GLN  48   9.718   7.741  -3.612
  333    HA   GLN  48           HA       GLN  48   7.713   9.011  -4.411
  334   1HB   GLN  48          1HB       GLN  48   8.253   6.719  -6.288
  335   2HB   GLN  48          2HB       GLN  48   7.873   8.402  -6.642
  336   1HG   GLN  48          1HG       GLN  48  10.454   7.150  -5.715
  337   2HG   GLN  48          2HG       GLN  48  10.189   8.186  -7.119
  338   1HE2  GLN  48          2HE2      GLN  48   9.567  10.591  -6.531
  339   2HE2  GLN  48          1HE2      GLN  48  10.248  11.224  -5.024
  340    H    ASP  49           H        ASP  49   5.579   9.156  -4.105
  341    HA   ASP  49           HA       ASP  49   3.746   7.021  -4.921
  342   1HB   ASP  49          1HB       ASP  49   4.483   6.472  -2.574
  343   2HB   ASP  49          2HB       ASP  49   3.928   8.068  -2.069
  344    H    CYS  50           H        CYS  50   1.589   7.961  -5.274
  345    HA   CYS  50           HA       CYS  50   1.464  10.899  -5.020
  346   1HB   CYS  50          1HB       CYS  50   0.744   9.760  -7.071
  347   2HB   CYS  50          2HB       CYS  50  -0.672   9.131  -6.206
  348    H    VAL  51           H        VAL  51   1.228  11.487  -2.942
  349    HA   VAL  51           HA       VAL  51  -0.276   9.786  -1.088
  350    HB   VAL  51           HB       VAL  51   0.815  10.905   0.675
  351   1HG1  VAL  51          1HG1      VAL  51   2.158   9.238  -0.512
  352   2HG1  VAL  51          2HG1      VAL  51   2.856  10.501  -1.536
  353   3HG1  VAL  51          3HG1      VAL  51   3.159  10.503   0.211
  354   1HG2  VAL  51          1HG2      VAL  51   1.833  12.931  -1.358
  355   2HG2  VAL  51          2HG2      VAL  51   0.664  13.240  -0.059
  356   3HG2  VAL  51          3HG2      VAL  51   2.335  12.836   0.345
  357    H    CYS  52           H        CYS  52  -1.361  11.395   0.827
  358    HA   CYS  52           HA       CYS  52  -3.791  12.101  -0.593
  359   1HB   CYS  52          1HB       CYS  52  -3.545  10.963   1.703
  360   2HB   CYS  52          2HB       CYS  52  -3.158  12.567   2.338
  361    H    GLU  53           H        GLU  53  -4.629  14.170  -1.077
  362    HA   GLU  53           HA       GLU  53  -2.717  16.257  -1.178
  363   1HB   GLU  53          1HB       GLU  53  -5.520  15.943  -1.990
  364   2HB   GLU  53          2HB       GLU  53  -5.174  17.581  -1.437
  365   1HG   GLU  53          1HG       GLU  53  -3.458  16.133  -3.481
  366   2HG   GLU  53          2HG       GLU  53  -4.855  17.124  -3.907
  367    H    GLU  54           H        GLU  54  -2.604  18.266  -0.229
  368    HA   GLU  54           HA       GLU  54  -2.569  18.068   2.643
  369   1HB   GLU  54          1HB       GLU  54  -0.807  19.118   1.222
  370   2HB   GLU  54          2HB       GLU  54  -1.909  20.459   0.873
  371   1HG   GLU  54          1HG       GLU  54  -1.996  20.999   3.299
  372   2HG   GLU  54          2HG       GLU  54  -0.951  19.611   3.653
  373    H    GLY  55           H        GLY  55  -4.820  17.787   2.970
  374   1HA   GLY  55          1HA       GLY  55  -6.287  19.910   4.074
  375   2HA   GLY  55          2HA       GLY  55  -6.778  19.811   2.369
  376    H    PHE  56           H        PHE  56  -6.194  16.835   2.301
  377    HA   PHE  56           HA       PHE  56  -8.683  15.902   3.631
  378   1HB   PHE  56          1HB       PHE  56  -7.056  14.667   1.428
  379   2HB   PHE  56          2HB       PHE  56  -8.644  14.169   2.013
  380    HD1  PHE  56           HD1      PHE  56 -10.600  15.935   1.787
  381    HD2  PHE  56           HD2      PHE  56  -6.832  16.309  -0.230
  382    HE1  PHE  56           HE1      PHE  56 -11.680  17.329   0.053
  383    HE2  PHE  56           HE2      PHE  56  -7.898  17.744  -1.967
  384    HZ   PHE  56           HZ       PHE  56 -10.333  18.241  -1.830
  385    H    TYR  57           H        TYR  57  -8.529  13.669   4.564
  386    HA   TYR  57           HA       TYR  57  -5.827  12.851   5.407
  387   1HB   TYR  57          1HB       TYR  57  -8.353  13.169   7.096
  388   2HB   TYR  57          2HB       TYR  57  -7.015  12.138   7.572
  389    HD1  TYR  57           HD1      TYR  57  -7.806  15.699   6.678
  390    HD2  TYR  57           HD2      TYR  57  -5.146  12.985   8.693
  391    HE1  TYR  57           HE1      TYR  57  -6.693  17.616   7.761
  392    HE2  TYR  57           HE2      TYR  57  -4.117  14.895   9.902
  393    HH   TYR  57           HH       TYR  57  -4.107  17.191  10.202
  394    H    ARG  58           H        ARG  58  -5.622  10.632   5.732
  395    HA   ARG  58           HA       ARG  58  -7.293   8.909   4.086
  396   1HB   ARG  58          1HB       ARG  58  -5.322   8.089   6.267
  397   2HB   ARG  58          2HB       ARG  58  -5.974   7.129   4.936
  398   1HG   ARG  58          1HG       ARG  58  -4.643   8.466   3.350
  399   2HG   ARG  58          2HG       ARG  58  -4.125   9.562   4.657
  400   1HD   ARG  58          1HD       ARG  58  -2.454   7.726   4.033
  401   2HD   ARG  58          2HD       ARG  58  -2.838   7.925   5.733
  402    HE   ARG  58           HE       ARG  58  -4.232   5.993   5.744
  403   1HH1  ARG  58          1HH1      ARG  58  -2.136   6.026   2.911
  404   2HH1  ARG  58          2HH1      ARG  58  -2.932   4.687   2.142
  405   1HH2  ARG  58          1HH2      ARG  58  -5.342   4.314   4.730
  406   2HH2  ARG  58          2HH2      ARG  58  -4.700   3.626   3.244
  407    H    ASN  59           H        ASN  59  -9.471   9.234   5.014
  408    HA   ASN  59           HA       ASN  59 -10.162   8.946   7.726
  409   1HB   ASN  59          1HB       ASN  59 -11.840   9.582   6.198
  410   2HB   ASN  59          2HB       ASN  59 -11.655   8.104   5.240
  411   1HD2  ASN  59          2HD2      ASN  59 -13.622   7.018   5.489
  412   2HD2  ASN  59          1HD2      ASN  59 -14.277   6.630   7.080
  413    H    LYS  60           H        LYS  60  -9.585   6.393   5.317
  414    HA   LYS  60           HA       LYS  60  -8.395   4.776   7.274
  415   1HB   LYS  60          1HB       LYS  60  -9.995   2.716   6.854
  416   2HB   LYS  60          2HB       LYS  60 -10.233   3.864   8.155
  417   1HG   LYS  60          1HG       LYS  60 -12.018   4.999   7.029
  418   2HG   LYS  60          2HG       LYS  60 -11.674   4.190   5.503
  419   1HD   LYS  60          1HD       LYS  60 -13.532   3.062   6.242
  420   2HD   LYS  60          2HD       LYS  60 -12.253   1.976   6.780
  421   1HE   LYS  60          1HE       LYS  60 -13.696   4.062   8.519
  422   2HE   LYS  60          2HE       LYS  60 -14.093   2.343   8.434
  423   1HZ   LYS  60          1HZ       LYS  60 -11.809   1.912   9.201
  424   2HZ   LYS  60          2HZ       LYS  60 -11.648   3.531   9.503
  425   3HZ   LYS  60          3HZ       LYS  60 -12.789   2.665  10.293
  426    H    ASP  61           H        ASP  61 -10.126   3.206   4.656
  427    HA   ASP  61           HA       ASP  61  -7.680   2.286   3.478
  428   1HB   ASP  61          1HB       ASP  61  -9.687   0.912   3.529
  429   2HB   ASP  61          2HB       ASP  61 -10.573   2.102   2.559
  430    H    ASP  62           H        ASP  62  -6.838   4.511   3.207
  431    HA   ASP  62           HA       ASP  62  -6.225   6.372   2.056
  432   1HB   ASP  62          1HB       ASP  62  -6.777   4.549  -0.327
  433   2HB   ASP  62          2HB       ASP  62  -5.843   6.044  -0.381
  434    H    LYS  63           H        LYS  63  -9.098   6.136   2.720
  435    HA   LYS  63           HA       LYS  63 -10.502   7.587   0.584
  436   1HB   LYS  63          1HB       LYS  63 -11.316   6.964   3.439
  437   2HB   LYS  63          2HB       LYS  63 -12.360   7.610   2.163
  438   1HG   LYS  63          1HG       LYS  63 -11.087   4.846   2.347
  439   2HG   LYS  63          2HG       LYS  63 -12.793   5.268   2.474
  440   1HD   LYS  63          1HD       LYS  63 -12.756   6.009   0.065
  441   2HD   LYS  63          2HD       LYS  63 -11.052   5.520  -0.027
  442   1HE   LYS  63          1HE       LYS  63 -12.418   3.781  -0.982
  443   2HE   LYS  63          2HE       LYS  63 -11.623   3.194   0.482
  444   1HZ   LYS  63          1HZ       LYS  63 -14.410   4.122   0.301
  445   2HZ   LYS  63          2HZ       LYS  63 -13.920   2.549   0.352
  446   3HZ   LYS  63          3HZ       LYS  63 -13.680   3.526   1.654
  447    H    CYS  64           H        CYS  64  -9.008   9.265   0.342
  448    HA   CYS  64           HA       CYS  64  -8.240  11.143   2.307
  449   1HB   CYS  64          1HB       CYS  64  -8.446  11.254  -0.685
  450   2HB   CYS  64          2HB       CYS  64  -8.004  12.680   0.236
  451    H    VAL  65           H        VAL  65  -9.976  11.796   3.655
  452    HA   VAL  65           HA       VAL  65 -11.595  13.971   2.468
  453    HB   VAL  65           HB       VAL  65 -13.538  13.378   3.865
  454   1HG1  VAL  65          1HG1      VAL  65 -13.483  12.848   1.444
  455   2HG1  VAL  65          2HG1      VAL  65 -12.860  11.226   1.821
  456   3HG1  VAL  65          3HG1      VAL  65 -14.474  11.709   2.372
  457   1HG2  VAL  65          1HG2      VAL  65 -12.373  11.816   5.468
  458   2HG2  VAL  65          2HG2      VAL  65 -13.832  11.118   4.741
  459   3HG2  VAL  65          3HG2      VAL  65 -12.235  10.636   4.147
  460    H    SER  66           H        SER  66 -11.964  15.716   4.004
  461    HA   SER  66           HA       SER  66  -9.678  16.183   5.509
  462   1HB   SER  66          1HB       SER  66 -12.365  17.584   5.635
  463   2HB   SER  66          2HB       SER  66 -10.804  18.263   6.148
  464    HG   SER  66           HG       SER  66 -10.051  18.080   4.046
  465    H    ALA  67           H        ALA  67  -9.427  16.834   7.724
  466    HA   ALA  67           HA       ALA  67  -9.543  14.856   9.546
  467   1HB   ALA  67          1HB       ALA  67  -9.771  17.833  10.142
  468   2HB   ALA  67          2HB       ALA  67  -9.298  16.575  11.302
  469   3HB   ALA  67          3HB       ALA  67  -8.276  16.907   9.897
  470    H    GLU  68           H        GLU  68 -11.952  17.427   9.275
  471    HA   GLU  68           HA       GLU  68 -13.804  16.808  11.206
  472   1HB   GLU  68          1HB       GLU  68 -14.636  17.553   8.364
  473   2HB   GLU  68          2HB       GLU  68 -15.394  17.996   9.897
  474   1HG   GLU  68          1HG       GLU  68 -12.778  19.058   8.717
  475   2HG   GLU  68          2HG       GLU  68 -14.270  19.932   9.030
  476    H    ASP  69           H        ASP  69 -13.673  15.419   7.908
  477    HA   ASP  69           HA       ASP  69 -16.016  13.745   8.229
  478   1HB   ASP  69          1HB       ASP  69 -13.764  13.596   6.185
  479   2HB   ASP  69          2HB       ASP  69 -15.364  12.854   6.051
  480    H    CYS  70           H        CYS  70 -12.498  13.266   8.145
  481    HA   CYS  70           HA       CYS  70 -12.207  10.528   8.619
  482   1HB   CYS  70          1HB       CYS  70 -10.138  11.408   8.408
  483   2HB   CYS  70          2HB       CYS  70 -10.639  12.971   9.007
  484    H    GLU  71           H        GLU  71 -12.608  13.091  11.092
  485    HA   GLU  71           HA       GLU  71 -12.767  11.286  13.304
  486   1HB   GLU  71          1HB       GLU  71 -13.638  14.179  12.891
  487   2HB   GLU  71          2HB       GLU  71 -13.760  13.344  14.447
  488   1HG   GLU  71          1HG       GLU  71 -11.378  12.963  14.533
  489   2HG   GLU  71          2HG       GLU  71 -11.143  13.560  12.889
  490    H    LEU  72           H        LEU  72 -15.367  13.195  11.688
  491    HA   LEU  72           HA       LEU  72 -17.479  12.176  13.192
  492   1HB   LEU  72          1HB       LEU  72 -17.382  13.210  10.340
  493   2HB   LEU  72          2HB       LEU  72 -18.901  12.846  11.161
  494    HG   LEU  72           HG       LEU  72 -16.884  14.811  12.326
  495   1HD1  LEU  72          1HD1      LEU  72 -17.577  15.583  10.078
  496   2HD1  LEU  72          2HD1      LEU  72 -19.283  15.381  10.532
  497   3HD1  LEU  72          3HD1      LEU  72 -18.277  16.594  11.352
  498   1HD2  LEU  72          1HD2      LEU  72 -19.862  14.359  12.813
  499   2HD2  LEU  72          2HD2      LEU  72 -18.549  13.973  13.944
  500   3HD2  LEU  72          3HD2      LEU  72 -18.883  15.654  13.528
  501    H    ASP  73           H        ASP  73 -16.023  10.716  10.286
  502    HA   ASP  73           HA       ASP  73 -18.000   8.802   9.752
  503   1HB   ASP  73          1HB       ASP  73 -16.054   9.282   8.291
  504   2HB   ASP  73          2HB       ASP  73 -14.990   8.485   9.465
  505    H    ASN  74           H        ASN  74 -15.606   8.852  12.374
  506    HA   ASN  74           HA       ASN  74 -16.303   6.086  13.198
  507   1HB   ASN  74          1HB       ASN  74 -14.024   6.913  13.463
  508   2HB   ASN  74          2HB       ASN  74 -14.583   8.199  14.531
  509   1HD2  ASN  74          2HD2      ASN  74 -12.689   5.870  14.952
  510   2HD2  ASN  74          1HD2      ASN  74 -13.281   5.186  16.470
  511    H    MET  75           H        MET  75 -18.616   7.007  12.914
  512    HA   MET  75           HA       MET  75 -19.838   8.719  14.761
  513   1HB   MET  75          1HB       MET  75 -20.864   6.110  13.541
  514   2HB   MET  75          2HB       MET  75 -21.837   7.143  14.582
  515   1HG   MET  75          1HG       MET  75 -22.477   7.758  12.441
  516   2HG   MET  75          2HG       MET  75 -21.457   9.066  13.035
  517   1HE   MET  75          1HE       MET  75 -21.798   6.035  10.560
  518   2HE   MET  75          2HE       MET  75 -20.239   6.098   9.700
  519   3HE   MET  75          3HE       MET  75 -20.286   5.580  11.395
  520    H    ASP  76           H        ASP  76 -18.695   5.432  15.232
  521    HA   ASP  76           HA       ASP  76 -20.084   4.649  17.476
  522   1HB   ASP  76          1HB       ASP  76 -18.588   3.243  16.061
  523   2HB   ASP  76          2HB       ASP  76 -17.176   4.012  16.797
  524    H    PHE  77           H        PHE  77 -16.911   6.376  17.468
  525    HA   PHE  77           HA       PHE  77 -17.501   7.445  20.184
  526   1HB   PHE  77          1HB       PHE  77 -15.166   5.610  19.572
  527   2HB   PHE  77          2HB       PHE  77 -15.305   6.614  21.018
  528    HD1  PHE  77           HD1      PHE  77 -17.487   6.263  22.476
  529    HD2  PHE  77           HD2      PHE  77 -15.809   3.369  19.758
  530    HE1  PHE  77           HE1      PHE  77 -18.479   4.426  23.813
  531    HE2  PHE  77           HE2      PHE  77 -16.834   1.540  21.070
  532    HZ   PHE  77           HZ       PHE  77 -18.155   2.061  23.116
  533    H    ILE  78           H        ILE  78 -15.235   7.290  17.464
  534    HA   ILE  78           HA       ILE  78 -13.685   8.668  16.650
  535    HB   ILE  78           HB       ILE  78 -14.646  10.957  18.393
  536   1HG1  ILE  78          1HG1      ILE  78 -15.648  10.079  15.652
  537   2HG1  ILE  78          2HG1      ILE  78 -16.591  10.018  17.151
  538   1HG2  ILE  78          1HG2      ILE  78 -12.423  11.066  17.116
  539   2HG2  ILE  78          2HG2      ILE  78 -13.364  10.926  15.632
  540   3HG2  ILE  78          3HG2      ILE  78 -13.592  12.321  16.713
  541   1HD1  ILE  78          1HD1      ILE  78 -16.379  12.501  17.355
  542   2HD1  ILE  78          2HD1      ILE  78 -15.644  12.526  15.733
  543   3HD1  ILE  78          3HD1      ILE  78 -17.297  11.939  15.942
  544    H    TYR  79           H        TYR  79 -13.903   9.561  20.122
  545    HA   TYR  79           HA       TYR  79 -10.998   8.848  20.357
  546   1HB   TYR  79          1HB       TYR  79 -12.291  11.370  21.393
  547   2HB   TYR  79          2HB       TYR  79 -10.694  10.793  21.866
  548    HD1  TYR  79           HD1      TYR  79  -9.154  10.031  19.726
  549    HD2  TYR  79           HD2      TYR  79 -12.245  13.047  19.708
  550    HE1  TYR  79           HE1      TYR  79  -8.295  10.902  17.587
  551    HE2  TYR  79           HE2      TYR  79 -11.335  13.944  17.585
  552    HH   TYR  79           HH       TYR  79  -9.012  12.097  15.672
  553    HA   PRO  80           HA       PRO  80 -12.375   7.993  24.707
  554   1HB   PRO  80          1HB       PRO  80 -15.042   7.931  25.462
  555   2HB   PRO  80          2HB       PRO  80 -13.964   9.344  25.585
  556   1HG   PRO  80          1HG       PRO  80 -15.875   8.679  23.324
  557   2HG   PRO  80          2HG       PRO  80 -15.740  10.222  24.221
  558   1HD   PRO  80          1HD       PRO  80 -14.516   9.975  21.877
  559   2HD   PRO  80          2HD       PRO  80 -13.609  10.687  23.230
  560    H    GLY  81           H        GLY  81 -13.194   6.384  21.909
  561   1HA   GLY  81          1HA       GLY  81 -14.622   4.095  22.897
  562   2HA   GLY  81          2HA       GLY  81 -13.563   4.162  21.474
  563    H    THR  82           H        THR  82 -11.116   4.960  22.640
  564    HA   THR  82           HA       THR  82 -10.198   2.579  24.016
  565    HB   THR  82           HB       THR  82  -8.100   4.261  24.087
  566    HG1  THR  82           HG1      THR  82  -9.158   6.128  23.458
  567   1HG2  THR  82          1HG2      THR  82  -9.269   3.066  21.538
  568   2HG2  THR  82          2HG2      THR  82  -7.604   3.643  21.735
  569   3HG2  THR  82          3HG2      THR  82  -8.183   2.264  22.688
  570    H    ARG  83           H        ARG  83 -12.222   4.769  25.299
  571    HA   ARG  83           HA       ARG  83 -12.701   5.570  27.288
  572   1HB   ARG  83          1HB       ARG  83 -10.368   4.067  28.532
  573   2HB   ARG  83          2HB       ARG  83 -11.810   4.713  29.310
  574   1HG   ARG  83          1HG       ARG  83 -11.661   2.369  27.356
  575   2HG   ARG  83          2HG       ARG  83 -12.036   2.330  29.078
  576   1HD   ARG  83          1HD       ARG  83 -14.082   3.764  28.564
  577   2HD   ARG  83          2HD       ARG  83 -13.784   3.484  26.848
  578    HE   ARG  83           HE       ARG  83 -14.761   1.611  28.879
  579   1HH1  ARG  83          1HH1      ARG  83 -13.484   1.857  25.512
  580   2HH1  ARG  83          2HH1      ARG  83 -14.039   0.270  25.115
  581   1HH2  ARG  83          1HH2      ARG  83 -15.478  -0.425  28.260
  582   2HH2  ARG  83          2HH2      ARG  83 -15.194  -1.028  26.650
  583    H    ASN  84           H        ASN  84  -9.121   5.468  27.244
  584    HA   ASN  84           HA       ASN  84  -8.861   8.278  27.971
  585   1HB   ASN  84          1HB       ASN  84  -7.087   6.516  28.330
  586   2HB   ASN  84          2HB       ASN  84  -6.858   6.424  26.580
  587   1HD2  ASN  84          2HD2      ASN  84  -6.208   8.667  25.459
  588   2HD2  ASN  84          1HD2      ASN  84  -5.184   9.658  26.468
  589    HA   PRO  85           HA       PRO  85 -10.015   9.474  23.788
  590   1HB   PRO  85          1HB       PRO  85  -8.998  12.031  23.610
  591   2HB   PRO  85          2HB       PRO  85 -10.446  11.600  24.562
  592   1HG   PRO  85          1HG       PRO  85  -7.598  11.865  25.564
  593   2HG   PRO  85          2HG       PRO  85  -9.072  12.609  26.254
  594   1HD   PRO  85          1HD       PRO  85  -8.064  10.327  27.274
  595   2HD   PRO  85          2HD       PRO  85  -9.833  10.495  27.084
  Start of MODEL   14
    1   1H    LYS   1          1H        LYS   1   2.646   2.129  -3.441
    2   2H    LYS   1          2H        LYS   1   3.418   2.562  -2.050
    3   3H    LYS   1          3H        LYS   1   2.591   3.695  -2.921
    4    HA   LYS   1           HA       LYS   1   4.863   4.007  -3.286
    5   1HB   LYS   1          1HB       LYS   1   5.370   1.602  -2.676
    6   2HB   LYS   1          2HB       LYS   1   4.947   1.161  -4.337
    7   1HG   LYS   1          1HG       LYS   1   6.827   2.522  -5.185
    8   2HG   LYS   1          2HG       LYS   1   7.110   3.187  -3.578
    9   1HD   LYS   1          1HD       LYS   1   8.763   1.466  -4.114
   10   2HD   LYS   1          2HD       LYS   1   7.780   0.974  -2.735
   11   1HE   LYS   1          1HE       LYS   1   8.200  -0.887  -4.315
   12   2HE   LYS   1          2HE       LYS   1   6.477  -0.559  -4.123
   13   1HZ   LYS   1          1HZ       LYS   1   8.152   0.378  -6.351
   14   2HZ   LYS   1          2HZ       LYS   1   7.093  -0.884  -6.407
   15   3HZ   LYS   1          3HZ       LYS   1   6.535   0.650  -6.182
   16    H    ALA   2           H        ALA   2   2.394   4.574  -4.562
   17    HA   ALA   2           HA       ALA   2   2.315   3.617  -7.273
   18   1HB   ALA   2          1HB       ALA   2   0.324   4.100  -5.881
   19   2HB   ALA   2          2HB       ALA   2   0.733   5.830  -5.915
   20   3HB   ALA   2          3HB       ALA   2   0.297   4.986  -7.415
   21    H    THR   3           H        THR   3   4.662   5.541  -6.391
   22    HA   THR   3           HA       THR   3   5.680   7.440  -7.053
   23    HB   THR   3           HB       THR   3   6.466   5.924  -8.692
   24    HG1  THR   3           HG1      THR   3   7.165   7.367 -10.121
   25   1HG2  THR   3          1HG2      THR   3   4.094   6.607 -10.456
   26   2HG2  THR   3          2HG2      THR   3   5.539   5.716 -10.961
   27   3HG2  THR   3          3HG2      THR   3   4.477   5.027  -9.733
   28    H    MET   4           H        MET   4   4.750   8.632  -9.800
   29    HA   MET   4           HA       MET   4   3.021  10.728  -8.624
   30   1HB   MET   4          1HB       MET   4   4.393  10.478 -11.326
   31   2HB   MET   4          2HB       MET   4   3.605  11.941 -10.701
   32   1HG   MET   4          1HG       MET   4   5.138  12.138  -8.891
   33   2HG   MET   4          2HG       MET   4   5.980  10.646  -9.319
   34   1HE   MET   4          1HE       MET   4   7.609  10.356 -11.276
   35   2HE   MET   4          2HE       MET   4   6.360  10.803 -12.467
   36   3HE   MET   4          3HE       MET   4   7.946  11.603 -12.501
   37    H    GLN   5           H        GLN   5   1.979  11.266 -11.423
   38    HA   GLN   5           HA       GLN   5   0.245  10.807 -12.790
   39   1HB   GLN   5          1HB       GLN   5  -0.280   8.126 -11.473
   40   2HB   GLN   5          2HB       GLN   5  -0.791   8.686 -13.040
   41   1HG   GLN   5          1HG       GLN   5   1.185   8.192 -14.064
   42   2HG   GLN   5          2HG       GLN   5   2.194   8.591 -12.682
   43   1HE2  GLN   5          2HE2      GLN   5   1.561   7.055 -10.607
   44   2HE2  GLN   5          1HE2      GLN   5   1.672   5.366 -11.041
   45    H    CYS   6           H        CYS   6  -0.522   9.261  -9.680
   46    HA   CYS   6           HA       CYS   6  -2.293   9.509  -8.232
   47   1HB   CYS   6          1HB       CYS   6  -1.435  12.418  -8.425
   48   2HB   CYS   6          2HB       CYS   6  -2.089  11.542  -7.040
   49    H    GLY   7           H        GLY   7  -3.633   9.049 -10.292
   50   1HA   GLY   7          1HA       GLY   7  -5.526  11.143 -11.098
   51   2HA   GLY   7          2HA       GLY   7  -5.528   9.439 -11.581
   52    H    GLU   8           H        GLU   8  -5.850  11.385  -8.595
   53    HA   GLU   8           HA       GLU   8  -8.415  10.363  -7.815
   54   1HB   GLU   8          1HB       GLU   8  -6.979   8.397  -7.282
   55   2HB   GLU   8          2HB       GLU   8  -5.888   9.416  -6.344
   56   1HG   GLU   8          1HG       GLU   8  -7.457   7.937  -5.051
   57   2HG   GLU   8          2HG       GLU   8  -7.516   9.622  -4.571
   58    H    ASN   9           H        ASN   9  -8.547  11.318  -5.279
   59    HA   ASN   9           HA       ASN   9  -7.785  14.102  -5.442
   60   1HB   ASN   9          1HB       ASN   9  -9.830  13.274  -4.309
   61   2HB   ASN   9          2HB       ASN   9  -8.822  12.478  -3.091
   62   1HD2  ASN   9          2HD2      ASN   9  -9.855  13.825  -1.341
   63   2HD2  ASN   9          1HD2      ASN   9  -9.438  15.518  -1.275
   64    H    GLU  10           H        GLU  10  -5.362  12.905  -5.843
   65    HA   GLU  10           HA       GLU  10  -3.904  13.168  -3.276
   66   1HB   GLU  10          1HB       GLU  10  -3.591  10.924  -5.322
   67   2HB   GLU  10          2HB       GLU  10  -2.549  11.210  -3.919
   68   1HG   GLU  10          1HG       GLU  10  -4.684  11.029  -2.490
   69   2HG   GLU  10          2HG       GLU  10  -5.477  10.391  -3.928
   70    H    LYS  11           H        LYS  11  -1.708  13.606  -3.513
   71    HA   LYS  11           HA       LYS  11  -0.768  14.747  -6.088
   72   1HB   LYS  11          1HB       LYS  11   0.504  16.392  -4.728
   73   2HB   LYS  11          2HB       LYS  11  -1.245  16.615  -4.580
   74   1HG   LYS  11          1HG       LYS  11  -1.245  15.479  -2.391
   75   2HG   LYS  11          2HG       LYS  11   0.482  15.119  -2.548
   76   1HD   LYS  11          1HD       LYS  11   1.067  17.464  -2.475
   77   2HD   LYS  11          2HD       LYS  11  -0.631  17.951  -2.583
   78   1HE   LYS  11          1HE       LYS  11   0.246  18.137  -0.266
   79   2HE   LYS  11          2HE       LYS  11  -1.112  17.004  -0.377
   80   1HZ   LYS  11          1HZ       LYS  11   1.721  16.234  -0.332
   81   2HZ   LYS  11          2HZ       LYS  11   0.682  16.154   0.948
   82   3HZ   LYS  11          3HZ       LYS  11   0.427  15.211  -0.376
   83    H    TYR  12           H        TYR  12   1.648  14.632  -6.149
   84    HA   TYR  12           HA       TYR  12   2.635  12.062  -5.295
   85   1HB   TYR  12          1HB       TYR  12   3.482  13.128  -7.307
   86   2HB   TYR  12          2HB       TYR  12   3.991  14.554  -6.397
   87    HD1  TYR  12           HD1      TYR  12   4.516  10.855  -6.575
   88    HD2  TYR  12           HD2      TYR  12   6.159  14.656  -5.408
   89    HE1  TYR  12           HE1      TYR  12   6.572   9.728  -5.819
   90    HE2  TYR  12           HE2      TYR  12   8.191  13.525  -4.579
   91    HH   TYR  12           HH       TYR  12   9.084  11.476  -3.998
   92    H    ASP  13           H        ASP  13   4.029  11.558  -3.584
   93    HA   ASP  13           HA       ASP  13   5.310  13.675  -2.042
   94   1HB   ASP  13          1HB       ASP  13   3.231  13.514  -0.797
   95   2HB   ASP  13          2HB       ASP  13   3.337  11.734  -0.796
   96    H    SER  14           H        SER  14   7.273  13.001  -1.373
   97    HA   SER  14           HA       SER  14   8.194  10.276  -1.933
   98   1HB   SER  14          1HB       SER  14   9.597  12.610  -0.577
   99   2HB   SER  14          2HB       SER  14  10.349  11.140  -1.217
  100    HG   SER  14           HG       SER  14  10.429  13.018  -2.628
  101    H    CYS  15           H        CYS  15   6.202   9.705  -0.172
  102    HA   CYS  15           HA       CYS  15   7.883   8.644   1.837
  103   1HB   CYS  15          1HB       CYS  15   7.528  10.786   3.049
  104   2HB   CYS  15          2HB       CYS  15   5.807  10.369   3.118
  105    H    GLY  16           H        GLY  16   7.012   6.845   0.495
  106   1HA   GLY  16          1HA       GLY  16   6.299   4.727   1.046
  107   2HA   GLY  16          2HA       GLY  16   5.661   5.332   2.553
  108    H    SER  17           H        SER  17   4.316   3.400   1.281
  109    HA   SER  17           HA       SER  17   2.286   4.128  -0.571
  110   1HB   SER  17          1HB       SER  17   2.468   1.882   1.475
  111   2HB   SER  17          2HB       SER  17   1.382   1.928   0.070
  112    HG   SER  17           HG       SER  17   3.428   0.785  -0.260
  113    H    LYS  18           H        LYS  18   1.718   6.214   0.602
  114    HA   LYS  18           HA       LYS  18   0.355   7.515   1.867
  115   1HB   LYS  18          1HB       LYS  18  -1.527   5.130   2.037
  116   2HB   LYS  18          2HB       LYS  18  -1.931   6.849   2.161
  117   1HG   LYS  18          1HG       LYS  18  -1.139   7.166  -0.206
  118   2HG   LYS  18          2HG       LYS  18  -0.833   5.426  -0.311
  119   1HD   LYS  18          1HD       LYS  18  -3.285   5.042   0.233
  120   2HD   LYS  18          2HD       LYS  18  -3.521   6.791   0.031
  121   1HE   LYS  18          1HE       LYS  18  -2.484   6.613  -2.268
  122   2HE   LYS  18          2HE       LYS  18  -2.363   4.860  -2.052
  123   1HZ   LYS  18          1HZ       LYS  18  -4.740   4.785  -1.847
  124   2HZ   LYS  18          2HZ       LYS  18  -4.851   6.417  -2.083
  125   3HZ   LYS  18          3HZ       LYS  18  -4.284   5.451  -3.286
  126    H    GLU  19           H        GLU  19   2.463   6.188   3.120
  127    HA   GLU  19           HA       GLU  19   1.549   4.856   5.537
  128   1HB   GLU  19          1HB       GLU  19   4.255   5.652   4.407
  129   2HB   GLU  19          2HB       GLU  19   4.062   4.938   6.013
  130   1HG   GLU  19          1HG       GLU  19   3.205   2.901   5.167
  131   2HG   GLU  19          2HG       GLU  19   2.840   3.596   3.588
  132    H    CYS  20           H        CYS  20   4.010   7.388   5.515
  133    HA   CYS  20           HA       CYS  20   2.876   8.464   8.026
  134   1HB   CYS  20          1HB       CYS  20   5.539   9.177   6.835
  135   2HB   CYS  20          2HB       CYS  20   5.016   9.197   8.524
  136    H    ASP  21           H        ASP  21   1.330   9.070   5.843
  137    HA   ASP  21           HA       ASP  21   2.104  11.749   4.818
  138   1HB   ASP  21          1HB       ASP  21   0.444  11.408   3.178
  139   2HB   ASP  21          2HB       ASP  21   1.283   9.864   3.318
  140    H    LYS  22           H        LYS  22  -0.777  12.486   4.501
  141    HA   LYS  22           HA       LYS  22  -1.384  13.410   7.235
  142   1HB   LYS  22          1HB       LYS  22  -2.770  13.753   4.559
  143   2HB   LYS  22          2HB       LYS  22  -3.376  14.396   6.086
  144   1HG   LYS  22          1HG       LYS  22  -1.246  15.592   6.474
  145   2HG   LYS  22          2HG       LYS  22  -0.671  15.131   4.871
  146   1HD   LYS  22          1HD       LYS  22  -3.336  16.572   5.197
  147   2HD   LYS  22          2HD       LYS  22  -1.825  17.476   5.337
  148   1HE   LYS  22          1HE       LYS  22  -2.705  17.603   3.063
  149   2HE   LYS  22          2HE       LYS  22  -1.127  16.797   3.082
  150   1HZ   LYS  22          1HZ       LYS  22  -3.741  15.461   2.983
  151   2HZ   LYS  22          2HZ       LYS  22  -2.749  15.696   1.686
  152   3HZ   LYS  22          3HZ       LYS  22  -2.266  14.720   2.914
  153    H    LYS  23           H        LYS  23  -1.199  11.032   7.751
  154    HA   LYS  23           HA       LYS  23  -3.526   9.319   7.392
  155   1HB   LYS  23          1HB       LYS  23  -2.441   8.418   9.688
  156   2HB   LYS  23          2HB       LYS  23  -1.904   7.975   8.083
  157   1HG   LYS  23          1HG       LYS  23  -0.001   8.399   9.470
  158   2HG   LYS  23          2HG       LYS  23  -0.038   9.470   8.122
  159   1HD   LYS  23          1HD       LYS  23   0.721  10.640  10.117
  160   2HD   LYS  23          2HD       LYS  23  -0.837  11.326   9.681
  161   1HE   LYS  23          1HE       LYS  23  -0.702  11.018  12.079
  162   2HE   LYS  23          2HE       LYS  23  -1.963   9.982  11.416
  163   1HZ   LYS  23          1HZ       LYS  23   0.757   9.118  12.121
  164   2HZ   LYS  23          2HZ       LYS  23  -0.607   8.861  13.013
  165   3HZ   LYS  23          3HZ       LYS  23  -0.440   8.138  11.550
  166    H    CYS  24           H        CYS  24  -5.501   9.454   8.402
  167    HA   CYS  24           HA       CYS  24  -6.078  11.631  10.203
  168   1HB   CYS  24          1HB       CYS  24  -7.923  10.693   9.082
  169   2HB   CYS  24          2HB       CYS  24  -7.523   9.035   9.612
  170    H    LYS  25           H        LYS  25  -5.624   8.122  10.814
  171    HA   LYS  25           HA       LYS  25  -5.338   6.952  12.718
  172   1HB   LYS  25          1HB       LYS  25  -3.109   8.001  11.971
  173   2HB   LYS  25          2HB       LYS  25  -3.309   9.109  13.331
  174   1HG   LYS  25          1HG       LYS  25  -1.912   7.372  14.127
  175   2HG   LYS  25          2HG       LYS  25  -3.473   6.961  14.822
  176   1HD   LYS  25          1HD       LYS  25  -3.832   5.299  12.978
  177   2HD   LYS  25          2HD       LYS  25  -2.269   5.772  12.282
  178   1HE   LYS  25          1HE       LYS  25  -1.134   5.009  14.365
  179   2HE   LYS  25          2HE       LYS  25  -2.706   4.486  15.006
  180   1HZ   LYS  25          1HZ       LYS  25  -2.867   3.020  13.079
  181   2HZ   LYS  25          2HZ       LYS  25  -1.347   3.461  12.603
  182   3HZ   LYS  25          3HZ       LYS  25  -1.566   2.671  14.024
  183    H    TYR  26           H        TYR  26  -7.530   8.575  13.097
  184    HA   TYR  26           HA       TYR  26  -7.606  10.022  15.470
  185   1HB   TYR  26          1HB       TYR  26  -9.957   9.525  15.598
  186   2HB   TYR  26          2HB       TYR  26  -9.455  10.077  14.019
  187    HD1  TYR  26           HD1      TYR  26  -8.543   6.819  13.353
  188    HD2  TYR  26           HD2      TYR  26 -12.065   9.016  14.573
  189    HE1  TYR  26           HE1      TYR  26  -9.896   5.514  11.808
  190    HE2  TYR  26           HE2      TYR  26 -13.408   7.615  13.084
  191    HH   TYR  26           HH       TYR  26 -13.437   6.040  11.486
  192    H    ASP  27           H        ASP  27  -7.542   6.481  15.143
  193    HA   ASP  27           HA       ASP  27  -7.372   4.844  16.686
  194   1HB   ASP  27          1HB       ASP  27  -5.333   6.064  17.294
  195   2HB   ASP  27          2HB       ASP  27  -6.215   7.049  18.456
  196    H    GLY  28           H        GLY  28  -7.850   6.286  19.698
  197   1HA   GLY  28          1HA       GLY  28  -9.614   6.388  21.095
  198   2HA   GLY  28          2HA       GLY  28 -10.751   6.444  19.741
  199    H    VAL  29           H        VAL  29 -10.915   4.492  18.504
  200    HA   VAL  29           HA       VAL  29 -10.305   1.882  19.730
  201    HB   VAL  29           HB       VAL  29 -13.114   2.709  18.890
  202   1HG1  VAL  29          1HG1      VAL  29 -12.036  -0.064  19.560
  203   2HG1  VAL  29          2HG1      VAL  29 -13.753   0.355  19.405
  204   3HG1  VAL  29          3HG1      VAL  29 -12.698   0.461  17.996
  205   1HG2  VAL  29          1HG2      VAL  29 -11.925   1.673  21.511
  206   2HG2  VAL  29          2HG2      VAL  29 -12.594   3.293  21.223
  207   3HG2  VAL  29          3HG2      VAL  29 -13.657   1.882  21.213
  208    H    GLU  30           H        GLU  30 -11.290   3.895  16.958
  209    HA   GLU  30           HA       GLU  30 -10.893   1.863  14.965
  210   1HB   GLU  30          1HB       GLU  30 -11.131   4.899  14.779
  211   2HB   GLU  30          2HB       GLU  30 -11.194   3.740  13.444
  212   1HG   GLU  30          1HG       GLU  30 -13.431   4.227  13.828
  213   2HG   GLU  30          2HG       GLU  30 -13.203   2.658  14.601
  214    H    GLU  31           H        GLU  31  -8.741   1.327  16.022
  215    HA   GLU  31           HA       GLU  31  -6.464   2.927  14.918
  216   1HB   GLU  31          1HB       GLU  31  -5.139   0.902  15.895
  217   2HB   GLU  31          2HB       GLU  31  -5.699   2.222  16.907
  218   1HG   GLU  31          1HG       GLU  31  -5.997   0.146  18.064
  219   2HG   GLU  31          2HG       GLU  31  -7.566   0.869  17.763
  220    H    GLU  32           H        GLU  32  -8.249  -0.082  14.547
  221    HA   GLU  32           HA       GLU  32  -6.971  -1.206  12.336
  222   1HB   GLU  32          1HB       GLU  32  -9.179  -2.249  11.875
  223   2HB   GLU  32          2HB       GLU  32  -8.643  -2.386  13.547
  224   1HG   GLU  32          1HG       GLU  32 -10.996  -1.943  13.541
  225   2HG   GLU  32          2HG       GLU  32 -10.196  -0.525  14.205
  226    H    ASP  33           H        ASP  33  -7.875  -1.240  10.056
  227    HA   ASP  33           HA       ASP  33  -8.201  -0.251   8.110
  228   1HB   ASP  33          1HB       ASP  33 -10.059   1.325   9.775
  229   2HB   ASP  33          2HB       ASP  33  -9.334   2.300   8.506
  230    H    ASP  34           H        ASP  34  -7.315   2.422  10.382
  231    HA   ASP  34           HA       ASP  34  -5.492   3.581   8.474
  232   1HB   ASP  34          1HB       ASP  34  -6.564   4.757  10.445
  233   2HB   ASP  34          2HB       ASP  34  -5.359   3.980  11.480
  234    H    GLU  35           H        GLU  35  -5.006   1.642  11.414
  235    HA   GLU  35           HA       GLU  35  -3.616   0.091  12.097
  236   1HB   GLU  35          1HB       GLU  35  -3.527  -0.435   9.111
  237   2HB   GLU  35          2HB       GLU  35  -2.796  -1.527  10.302
  238   1HG   GLU  35          1HG       GLU  35  -4.886  -1.891  11.426
  239   2HG   GLU  35          2HG       GLU  35  -5.651  -0.578  10.517
  240    H    GLU  36           H        GLU  36  -1.801   1.441   9.313
  241    HA   GLU  36           HA       GLU  36   0.597   0.264  10.005
  242   1HB   GLU  36          1HB       GLU  36   0.146   2.909   8.574
  243   2HB   GLU  36          2HB       GLU  36   1.685   2.032   8.598
  244   1HG   GLU  36          1HG       GLU  36   0.533   0.025   7.611
  245   2HG   GLU  36          2HG       GLU  36  -0.947   0.984   7.445
  246    HA   PRO  37           HA       PRO  37   2.096   2.647  13.528
  247   1HB   PRO  37          1HB       PRO  37   4.660   1.819  13.677
  248   2HB   PRO  37          2HB       PRO  37   3.307   0.691  13.934
  249   1HG   PRO  37          1HG       PRO  37   4.813   1.123  11.330
  250   2HG   PRO  37          2HG       PRO  37   4.528  -0.428  12.175
  251   1HD   PRO  37          1HD       PRO  37   2.919   0.440  10.164
  252   2HD   PRO  37          2HD       PRO  37   2.233  -0.407  11.584
  253    H    ASN  38           H        ASN  38   1.543   4.349  11.815
  254    HA   ASN  38           HA       ASN  38   3.760   5.524  10.323
  255   1HB   ASN  38          1HB       ASN  38   1.939   6.982   9.419
  256   2HB   ASN  38          2HB       ASN  38   1.821   5.249   9.088
  257   1HD2  ASN  38          2HD2      ASN  38  -0.463   5.794   8.571
  258   2HD2  ASN  38          1HD2      ASN  38  -1.614   5.721   9.885
  259    H    VAL  39           H        VAL  39   1.841   6.304  13.194
  260    HA   VAL  39           HA       VAL  39   2.589   8.936  13.656
  261    HB   VAL  39           HB       VAL  39   2.253   6.676  15.659
  262   1HG1  VAL  39          1HG1      VAL  39   2.491   9.681  16.150
  263   2HG1  VAL  39          2HG1      VAL  39   1.943   8.487  17.344
  264   3HG1  VAL  39          3HG1      VAL  39   3.608   8.437  16.755
  265   1HG2  VAL  39          1HG2      VAL  39   0.293   7.243  14.316
  266   2HG2  VAL  39          2HG2      VAL  39   0.081   7.669  16.019
  267   3HG2  VAL  39          3HG2      VAL  39   0.427   8.943  14.834
  268    HA   PRO  40           HA       PRO  40   6.993   7.947  15.152
  269   1HB   PRO  40          1HB       PRO  40   7.953   5.441  15.489
  270   2HB   PRO  40          2HB       PRO  40   6.836   6.155  16.686
  271   1HG   PRO  40          1HG       PRO  40   6.073   4.390  14.321
  272   2HG   PRO  40          2HG       PRO  40   5.722   4.073  16.050
  273   1HD   PRO  40          1HD       PRO  40   3.906   5.288  14.481
  274   2HD   PRO  40          2HD       PRO  40   4.220   5.892  16.139
  275    H    CYS  41           H        CYS  41   5.518   7.051  12.356
  276    HA   CYS  41           HA       CYS  41   5.962   6.056  10.418
  277   1HB   CYS  41          1HB       CYS  41   6.785   8.416  10.325
  278   2HB   CYS  41          2HB       CYS  41   8.429   7.816  10.598
  279    H    LEU  42           H        LEU  42   6.503   4.144  12.143
  280    HA   LEU  42           HA       LEU  42   9.197   3.357  12.460
  281   1HB   LEU  42          1HB       LEU  42   7.370   2.572  13.897
  282   2HB   LEU  42          2HB       LEU  42   6.676   1.680  12.537
  283    HG   LEU  42           HG       LEU  42   8.650   0.187  12.489
  284   1HD1  LEU  42          1HD1      LEU  42   9.560   1.817  14.907
  285   2HD1  LEU  42          2HD1      LEU  42  10.254   0.259  14.410
  286   3HD1  LEU  42          3HD1      LEU  42  10.413   1.664  13.354
  287   1HD2  LEU  42          1HD2      LEU  42   6.671  -0.382  13.849
  288   2HD2  LEU  42          2HD2      LEU  42   8.162  -0.986  14.591
  289   3HD2  LEU  42          3HD2      LEU  42   7.375   0.467  15.241
  290    H    VAL  43           H        VAL  43   6.858   2.596   9.965
  291    HA   VAL  43           HA       VAL  43   8.086   0.662   8.399
  292    HB   VAL  43           HB       VAL  43   7.072   1.920   6.446
  293   1HG1  VAL  43          1HG1      VAL  43   5.812   0.231   7.756
  294   2HG1  VAL  43          2HG1      VAL  43   5.220   1.517   8.831
  295   3HG1  VAL  43          3HG1      VAL  43   4.773   1.511   7.112
  296   1HG2  VAL  43          1HG2      VAL  43   6.256   3.934   8.606
  297   2HG2  VAL  43          2HG2      VAL  43   7.228   4.237   7.146
  298   3HG2  VAL  43          3HG2      VAL  43   5.533   3.780   7.017
  299    H    ARG  44           H        ARG  44   8.986   4.106   8.664
  300    HA   ARG  44           HA       ARG  44  10.737   5.248   8.185
  301   1HB   ARG  44          1HB       ARG  44  11.750   3.209   9.385
  302   2HB   ARG  44          2HB       ARG  44  12.339   2.699   7.805
  303   1HG   ARG  44          1HG       ARG  44  14.077   3.871   9.028
  304   2HG   ARG  44          2HG       ARG  44  13.641   4.795   7.589
  305   1HD   ARG  44          1HD       ARG  44  14.002   6.180   9.663
  306   2HD   ARG  44          2HD       ARG  44  12.437   6.416   8.891
  307    HE   ARG  44           HE       ARG  44  12.625   4.415  11.076
  308   1HH1  ARG  44          1HH1      ARG  44  11.648   7.728  10.228
  309   2HH1  ARG  44          2HH1      ARG  44  10.481   7.822  11.525
  310   1HH2  ARG  44          1HH2      ARG  44  11.130   4.603  12.768
  311   2HH2  ARG  44          2HH2      ARG  44  10.097   6.010  12.891
  312    H    VAL  45           H        VAL  45  10.385   2.657   5.781
  313    HA   VAL  45           HA       VAL  45  11.899   3.888   3.722
  314    HB   VAL  45           HB       VAL  45  10.784   2.249   2.246
  315   1HG1  VAL  45          1HG1      VAL  45  12.834   1.715   3.502
  316   2HG1  VAL  45          2HG1      VAL  45  11.858   1.110   4.858
  317   3HG1  VAL  45          3HG1      VAL  45  11.807   0.288   3.287
  318   1HG2  VAL  45          1HG2      VAL  45   8.534   2.040   3.376
  319   2HG2  VAL  45          2HG2      VAL  45   9.352   0.500   3.133
  320   3HG2  VAL  45          3HG2      VAL  45   9.329   1.238   4.737
  321    H    CYS  46           H        CYS  46  11.022   6.094   4.134
  322    HA   CYS  46           HA       CYS  46   8.531   6.871   2.982
  323   1HB   CYS  46          1HB       CYS  46  11.097   8.320   3.667
  324   2HB   CYS  46          2HB       CYS  46   9.883   9.145   2.723
  325    H    HIS  47           H        HIS  47   8.785   5.326   1.061
  326    HA   HIS  47           HA       HIS  47  10.362   6.501  -1.169
  327   1HB   HIS  47          1HB       HIS  47   9.912   4.397  -2.328
  328   2HB   HIS  47          2HB       HIS  47  10.803   4.236  -0.816
  329    HD1  HIS  47           HD1      HIS  47   6.941   4.298  -1.130
  330    HD2  HIS  47           HD2      HIS  47  10.174   1.805  -0.114
  331    HE1  HIS  47           HE1      HIS  47   5.942   2.123  -0.208
  332    H    GLN  48           H        GLN  48   9.533   7.514  -2.740
  333    HA   GLN  48           HA       GLN  48   7.595   8.843  -3.574
  334   1HB   GLN  48          1HB       GLN  48   7.769   7.872  -5.909
  335   2HB   GLN  48          2HB       GLN  48   9.274   8.267  -5.097
  336   1HG   GLN  48          1HG       GLN  48  10.030   6.251  -5.605
  337   2HG   GLN  48          2HG       GLN  48   8.891   5.527  -4.477
  338   1HE2  GLN  48          2HE2      GLN  48   6.707   4.990  -5.353
  339   2HE2  GLN  48          1HE2      GLN  48   6.635   4.333  -6.976
  340    H    ASP  49           H        ASP  49   5.401   9.011  -3.375
  341    HA   ASP  49           HA       ASP  49   3.736   6.860  -4.455
  342   1HB   ASP  49          1HB       ASP  49   4.282   6.152  -2.082
  343   2HB   ASP  49          2HB       ASP  49   3.640   7.707  -1.532
  344    H    CYS  50           H        CYS  50   1.378   7.475  -4.239
  345    HA   CYS  50           HA       CYS  50   0.902  10.390  -4.494
  346   1HB   CYS  50          1HB       CYS  50  -0.773   7.912  -5.060
  347   2HB   CYS  50          2HB       CYS  50  -1.373   9.567  -5.213
  348    H    VAL  51           H        VAL  51  -0.013  11.461  -2.734
  349    HA   VAL  51           HA       VAL  51  -1.533   9.877  -0.720
  350    HB   VAL  51           HB       VAL  51  -0.449  10.902   1.102
  351   1HG1  VAL  51          1HG1      VAL  51   0.726   8.944   0.120
  352   2HG1  VAL  51          2HG1      VAL  51   1.779  10.032  -0.796
  353   3HG1  VAL  51          3HG1      VAL  51   1.830  10.040   0.971
  354   1HG2  VAL  51          1HG2      VAL  51   1.067  12.604  -0.907
  355   2HG2  VAL  51          2HG2      VAL  51  -0.065  13.156   0.344
  356   3HG2  VAL  51          3HG2      VAL  51   1.493  12.482   0.820
  357    H    CYS  52           H        CYS  52  -2.935  11.292   0.590
  358    HA   CYS  52           HA       CYS  52  -4.690  12.643  -1.000
  359   1HB   CYS  52          1HB       CYS  52  -4.257  13.151   1.952
  360   2HB   CYS  52          2HB       CYS  52  -5.709  13.515   1.015
  361    H    GLU  53           H        GLU  53  -5.221  14.666  -1.663
  362    HA   GLU  53           HA       GLU  53  -3.178  16.665  -1.837
  363   1HB   GLU  53          1HB       GLU  53  -6.166  16.675  -2.358
  364   2HB   GLU  53          2HB       GLU  53  -5.179  18.132  -2.556
  365   1HG   GLU  53          1HG       GLU  53  -3.756  17.012  -4.194
  366   2HG   GLU  53          2HG       GLU  53  -4.604  15.485  -3.922
  367    H    GLU  54           H        GLU  54  -3.434  18.899  -1.142
  368    HA   GLU  54           HA       GLU  54  -3.032  19.288   1.532
  369   1HB   GLU  54          1HB       GLU  54  -4.265  21.339  -0.357
  370   2HB   GLU  54          2HB       GLU  54  -3.400  21.651   1.148
  371   1HG   GLU  54          1HG       GLU  54  -1.678  22.023  -0.287
  372   2HG   GLU  54          2HG       GLU  54  -1.432  20.289  -0.078
  373    H    GLY  55           H        GLY  55  -4.265  19.464   3.364
  374   1HA   GLY  55          1HA       GLY  55  -6.072  20.020   4.690
  375   2HA   GLY  55          2HA       GLY  55  -7.047  20.374   3.262
  376    H    PHE  56           H        PHE  56  -6.269  17.551   2.145
  377    HA   PHE  56           HA       PHE  56  -8.481  16.145   3.493
  378   1HB   PHE  56          1HB       PHE  56  -6.841  15.458   1.046
  379   2HB   PHE  56          2HB       PHE  56  -8.275  14.614   1.611
  380    HD1  PHE  56           HD1      PHE  56 -10.472  16.079   1.818
  381    HD2  PHE  56           HD2      PHE  56  -7.045  17.390  -0.388
  382    HE1  PHE  56           HE1      PHE  56 -11.969  17.054   0.097
  383    HE2  PHE  56           HE2      PHE  56  -8.515  18.446  -2.069
  384    HZ   PHE  56           HZ       PHE  56 -10.988  18.293  -1.834
  385    H    TYR  57           H        TYR  57  -8.167  13.977   4.367
  386    HA   TYR  57           HA       TYR  57  -5.355  13.234   5.018
  387   1HB   TYR  57          1HB       TYR  57  -7.816  13.437   6.813
  388   2HB   TYR  57          2HB       TYR  57  -6.454  12.401   7.199
  389    HD1  TYR  57           HD1      TYR  57  -7.231  16.008   6.418
  390    HD2  TYR  57           HD2      TYR  57  -4.661  13.205   8.444
  391    HE1  TYR  57           HE1      TYR  57  -5.952  17.886   7.392
  392    HE2  TYR  57           HE2      TYR  57  -3.415  15.080   9.462
  393    HH   TYR  57           HH       TYR  57  -3.197  17.375   9.611
  394    H    ARG  58           H        ARG  58  -5.018  10.963   5.065
  395    HA   ARG  58           HA       ARG  58  -7.182   9.451   3.730
  396   1HB   ARG  58          1HB       ARG  58  -5.928   7.516   3.846
  397   2HB   ARG  58          2HB       ARG  58  -5.105   8.803   2.981
  398   1HG   ARG  58          1HG       ARG  58  -3.347   7.964   3.999
  399   2HG   ARG  58          2HG       ARG  58  -3.793   9.074   5.293
  400   1HD   ARG  58          1HD       ARG  58  -4.755   7.135   6.561
  401   2HD   ARG  58          2HD       ARG  58  -4.693   6.144   5.086
  402    HE   ARG  58           HE       ARG  58  -2.080   7.001   5.646
  403   1HH1  ARG  58          1HH1      ARG  58  -4.511   4.595   6.701
  404   2HH1  ARG  58          2HH1      ARG  58  -3.310   3.561   7.439
  405   1HH2  ARG  58          1HH2      ARG  58  -0.648   5.485   6.054
  406   2HH2  ARG  58          2HH2      ARG  58  -1.025   3.942   6.772
  407    H    ASN  59           H        ASN  59  -8.893   9.367   4.922
  408    HA   ASN  59           HA       ASN  59  -9.012   9.324   7.767
  409   1HB   ASN  59          1HB       ASN  59 -11.040   8.499   5.663
  410   2HB   ASN  59          2HB       ASN  59 -11.358   8.472   7.396
  411   1HD2  ASN  59          2HD2      ASN  59  -9.473  11.007   5.511
  412   2HD2  ASN  59          1HD2      ASN  59 -10.544  12.274   5.963
  413    H    LYS  60           H        LYS  60  -8.682   6.806   5.388
  414    HA   LYS  60           HA       LYS  60  -8.124   4.781   7.470
  415   1HB   LYS  60          1HB       LYS  60 -10.034   4.353   5.139
  416   2HB   LYS  60          2HB       LYS  60  -9.430   3.112   6.238
  417   1HG   LYS  60          1HG       LYS  60 -10.470   4.312   8.150
  418   2HG   LYS  60          2HG       LYS  60 -11.119   5.536   7.052
  419   1HD   LYS  60          1HD       LYS  60 -12.698   4.133   6.110
  420   2HD   LYS  60          2HD       LYS  60 -11.801   2.662   6.484
  421   1HE   LYS  60          1HE       LYS  60 -13.816   2.896   7.915
  422   2HE   LYS  60          2HE       LYS  60 -12.327   2.859   8.868
  423   1HZ   LYS  60          1HZ       LYS  60 -12.430   5.240   9.028
  424   2HZ   LYS  60          2HZ       LYS  60 -13.842   5.282   8.172
  425   3HZ   LYS  60          3HZ       LYS  60 -13.780   4.542   9.638
  426    H    ASP  61           H        ASP  61  -8.353   5.062   3.958
  427    HA   ASP  61           HA       ASP  61  -5.535   4.059   3.697
  428   1HB   ASP  61          1HB       ASP  61  -6.616   2.645   1.772
  429   2HB   ASP  61          2HB       ASP  61  -6.659   2.073   3.450
  430    H    ASP  62           H        ASP  62  -7.970   4.471   1.277
  431    HA   ASP  62           HA       ASP  62  -6.422   6.637  -0.088
  432   1HB   ASP  62          1HB       ASP  62  -6.901   4.580  -1.446
  433   2HB   ASP  62          2HB       ASP  62  -8.630   4.850  -1.190
  434    H    LYS  63           H        LYS  63  -8.565   6.448   2.292
  435    HA   LYS  63           HA       LYS  63 -10.852   7.702   1.142
  436   1HB   LYS  63          1HB       LYS  63 -10.137   7.221   4.036
  437   2HB   LYS  63          2HB       LYS  63 -11.718   7.759   3.453
  438   1HG   LYS  63          1HG       LYS  63 -10.385   5.083   2.854
  439   2HG   LYS  63          2HG       LYS  63 -11.726   5.395   3.964
  440   1HD   LYS  63          1HD       LYS  63 -13.106   6.173   2.011
  441   2HD   LYS  63          2HD       LYS  63 -11.780   5.687   0.927
  442   1HE   LYS  63          1HE       LYS  63 -11.913   3.363   1.793
  443   2HE   LYS  63          2HE       LYS  63 -13.263   3.834   2.844
  444   1HZ   LYS  63          1HZ       LYS  63 -14.504   4.406   0.887
  445   2HZ   LYS  63          2HZ       LYS  63 -13.249   3.967  -0.088
  446   3HZ   LYS  63          3HZ       LYS  63 -14.015   2.834   0.829
  447    H    CYS  64           H        CYS  64  -9.456   9.470   0.225
  448    HA   CYS  64           HA       CYS  64  -8.313  11.455   1.978
  449   1HB   CYS  64          1HB       CYS  64  -8.717  11.438  -1.022
  450   2HB   CYS  64          2HB       CYS  64  -7.816  12.655  -0.127
  451    H    VAL  65           H        VAL  65 -10.227  11.906   3.195
  452    HA   VAL  65           HA       VAL  65 -11.597  14.301   2.095
  453    HB   VAL  65           HB       VAL  65 -13.567  13.814   3.478
  454   1HG1  VAL  65          1HG1      VAL  65 -13.543  13.358   1.038
  455   2HG1  VAL  65          2HG1      VAL  65 -13.004  11.696   1.357
  456   3HG1  VAL  65          3HG1      VAL  65 -14.597  12.237   1.919
  457   1HG2  VAL  65          1HG2      VAL  65 -12.593  12.203   5.031
  458   2HG2  VAL  65          2HG2      VAL  65 -14.023  11.525   4.241
  459   3HG2  VAL  65          3HG2      VAL  65 -12.405  11.000   3.736
  460    H    SER  66           H        SER  66 -12.048  15.843   4.169
  461    HA   SER  66           HA       SER  66  -9.481  15.868   5.507
  462   1HB   SER  66          1HB       SER  66 -10.892  17.919   4.974
  463   2HB   SER  66          2HB       SER  66 -11.854  17.504   6.411
  464    HG   SER  66           HG       SER  66  -9.084  18.115   6.184
  465    H    ALA  67           H        ALA  67  -9.098  15.728   7.853
  466    HA   ALA  67           HA       ALA  67 -10.164  13.316   8.937
  467   1HB   ALA  67          1HB       ALA  67  -7.920  14.064   9.527
  468   2HB   ALA  67          2HB       ALA  67  -8.588  15.488  10.361
  469   3HB   ALA  67          3HB       ALA  67  -8.901  13.849  10.973
  470    H    GLU  68           H        GLU  68 -11.368  16.529   8.952
  471    HA   GLU  68           HA       GLU  68 -13.135  16.650  11.115
  472   1HB   GLU  68          1HB       GLU  68 -13.647  17.442   8.212
  473   2HB   GLU  68          2HB       GLU  68 -14.531  18.023   9.626
  474   1HG   GLU  68          1HG       GLU  68 -12.488  19.094  10.507
  475   2HG   GLU  68          2HG       GLU  68 -11.552  18.530   9.113
  476    H    ASP  69           H        ASP  69 -13.366  14.775   8.056
  477    HA   ASP  69           HA       ASP  69 -16.045  13.749   8.620
  478   1HB   ASP  69          1HB       ASP  69 -15.160  13.847   6.311
  479   2HB   ASP  69          2HB       ASP  69 -13.863  12.731   6.759
  480    H    CYS  70           H        CYS  70 -12.744  12.373   8.649
  481    HA   CYS  70           HA       CYS  70 -13.014   9.925   9.591
  482   1HB   CYS  70          1HB       CYS  70 -10.818  11.159   9.198
  483   2HB   CYS  70          2HB       CYS  70 -10.971  11.791  10.835
  484    H    GLU  71           H        GLU  71 -12.801  12.699  11.884
  485    HA   GLU  71           HA       GLU  71 -13.208  11.152  14.215
  486   1HB   GLU  71          1HB       GLU  71 -13.763  13.260  15.344
  487   2HB   GLU  71          2HB       GLU  71 -12.307  13.365  14.345
  488   1HG   GLU  71          1HG       GLU  71 -13.627  14.503  12.568
  489   2HG   GLU  71          2HG       GLU  71 -15.067  14.437  13.594
  490    H    LEU  72           H        LEU  72 -15.645  12.443  11.968
  491    HA   LEU  72           HA       LEU  72 -17.900  11.786  13.737
  492   1HB   LEU  72          1HB       LEU  72 -17.844  12.406  10.758
  493   2HB   LEU  72          2HB       LEU  72 -19.277  12.295  11.777
  494    HG   LEU  72           HG       LEU  72 -17.053  14.359  12.128
  495   1HD1  LEU  72          1HD1      LEU  72 -18.295  14.672  10.027
  496   2HD1  LEU  72          2HD1      LEU  72 -19.833  14.636  10.918
  497   3HD1  LEU  72          3HD1      LEU  72 -18.671  15.953  11.191
  498   1HD2  LEU  72          1HD2      LEU  72 -19.782  14.082  13.464
  499   2HD2  LEU  72          2HD2      LEU  72 -18.194  13.959  14.259
  500   3HD2  LEU  72          3HD2      LEU  72 -18.724  15.503  13.588
  501    H    ASP  73           H        ASP  73 -16.138  10.360  10.998
  502    HA   ASP  73           HA       ASP  73 -17.796   7.948  10.930
  503   1HB   ASP  73          1HB       ASP  73 -16.700   8.933   8.907
  504   2HB   ASP  73          2HB       ASP  73 -15.117   8.595   9.624
  505    H    ASN  74           H        ASN  74 -17.257   8.109  13.470
  506    HA   ASN  74           HA       ASN  74 -15.516   5.883  14.071
  507   1HB   ASN  74          1HB       ASN  74 -14.015   7.009  15.314
  508   2HB   ASN  74          2HB       ASN  74 -14.654   8.539  14.714
  509   1HD2  ASN  74          2HD2      ASN  74 -16.165   9.726  16.037
  510   2HD2  ASN  74          1HD2      ASN  74 -16.297   9.360  17.765
  511    H    MET  75           H        MET  75 -16.430   4.862  15.941
  512    HA   MET  75           HA       MET  75 -19.349   5.186  16.028
  513   1HB   MET  75          1HB       MET  75 -18.335   2.967  15.658
  514   2HB   MET  75          2HB       MET  75 -17.471   3.077  17.188
  515   1HG   MET  75          1HG       MET  75 -19.513   1.653  17.275
  516   2HG   MET  75          2HG       MET  75 -19.531   2.956  18.451
  517   1HE   MET  75          1HE       MET  75 -20.971   1.643  15.049
  518   2HE   MET  75          2HE       MET  75 -22.150   2.911  14.641
  519   3HE   MET  75          3HE       MET  75 -20.412   3.266  14.568
  520    H    ASP  76           H        ASP  76 -18.740   7.355  16.957
  521    HA   ASP  76           HA       ASP  76 -18.998   8.809  18.650
  522   1HB   ASP  76          1HB       ASP  76 -20.638   7.231  19.571
  523   2HB   ASP  76          2HB       ASP  76 -19.367   6.411  20.480
  524    H    PHE  77           H        PHE  77 -17.189   6.082  20.050
  525    HA   PHE  77           HA       PHE  77 -15.825   6.745  22.000
  526   1HB   PHE  77          1HB       PHE  77 -14.325   5.731  19.566
  527   2HB   PHE  77          2HB       PHE  77 -13.753   5.640  21.228
  528    HD1  PHE  77           HD1      PHE  77 -15.409   4.485  22.957
  529    HD2  PHE  77           HD2      PHE  77 -15.494   3.882  18.686
  530    HE1  PHE  77           HE1      PHE  77 -16.569   2.317  23.281
  531    HE2  PHE  77           HE2      PHE  77 -16.595   1.688  19.022
  532    HZ   PHE  77           HZ       PHE  77 -17.154   0.909  21.315
  533    H    ILE  78           H        ILE  78 -13.824   7.760  19.214
  534    HA   ILE  78           HA       ILE  78 -12.074   9.169  19.106
  535    HB   ILE  78           HB       ILE  78 -13.782  10.969  20.873
  536   1HG1  ILE  78          1HG1      ILE  78 -14.856  10.466  18.753
  537   2HG1  ILE  78          2HG1      ILE  78 -14.338  12.140  18.822
  538   1HG2  ILE  78          1HG2      ILE  78 -11.215  11.565  19.364
  539   2HG2  ILE  78          2HG2      ILE  78 -12.346  12.808  19.940
  540   3HG2  ILE  78          3HG2      ILE  78 -11.533  11.755  21.098
  541   1HD1  ILE  78          1HD1      ILE  78 -12.368  11.567  17.372
  542   2HD1  ILE  78          2HD1      ILE  78 -12.984   9.899  17.247
  543   3HD1  ILE  78          3HD1      ILE  78 -13.935  11.242  16.623
  544    H    TYR  79           H        TYR  79 -13.030   9.320  22.573
  545    HA   TYR  79           HA       TYR  79 -10.410   9.563  23.588
  546   1HB   TYR  79          1HB       TYR  79 -12.838   8.179  24.808
  547   2HB   TYR  79          2HB       TYR  79 -11.417   8.698  25.704
  548    HD1  TYR  79           HD1      TYR  79 -10.810  11.214  25.679
  549    HD2  TYR  79           HD2      TYR  79 -14.669   9.674  24.535
  550    HE1  TYR  79           HE1      TYR  79 -11.789  13.490  25.896
  551    HE2  TYR  79           HE2      TYR  79 -15.638  11.938  24.735
  552    HH   TYR  79           HH       TYR  79 -15.233  14.155  25.219
  553    HA   PRO  80           HA       PRO  80  -8.685   5.478  22.844
  554   1HB   PRO  80          1HB       PRO  80  -7.076   5.132  25.025
  555   2HB   PRO  80          2HB       PRO  80  -6.690   6.215  23.659
  556   1HG   PRO  80          1HG       PRO  80  -7.962   6.963  26.303
  557   2HG   PRO  80          2HG       PRO  80  -6.577   7.756  25.493
  558   1HD   PRO  80          1HD       PRO  80  -9.072   8.747  25.272
  559   2HD   PRO  80          2HD       PRO  80  -8.010   8.718  23.834
  560    H    GLY  81           H        GLY  81  -9.593   3.503  23.192
  561   1HA   GLY  81          1HA       GLY  81 -11.652   3.061  25.091
  562   2HA   GLY  81          2HA       GLY  81 -10.883   1.848  24.061
  563    H    THR  82           H        THR  82  -9.900   3.831  26.843
  564    HA   THR  82           HA       THR  82  -8.508   3.417  28.597
  565    HB   THR  82           HB       THR  82  -9.802   2.200  30.330
  566    HG1  THR  82           HG1      THR  82 -11.578   1.647  28.177
  567   1HG2  THR  82          1HG2      THR  82 -10.344   4.562  29.754
  568   2HG2  THR  82          2HG2      THR  82 -11.516   4.008  28.544
  569   3HG2  THR  82          3HG2      THR  82 -11.779   3.651  30.260
  570    H    ARG  83           H        ARG  83  -9.723   0.157  28.654
  571    HA   ARG  83           HA       ARG  83  -7.412  -1.181  29.423
  572   1HB   ARG  83          1HB       ARG  83  -9.693  -2.049  29.444
  573   2HB   ARG  83          2HB       ARG  83  -9.720  -2.184  27.692
  574   1HG   ARG  83          1HG       ARG  83  -7.561  -3.614  29.288
  575   2HG   ARG  83          2HG       ARG  83  -9.211  -4.235  29.336
  576   1HD   ARG  83          1HD       ARG  83  -7.535  -3.946  26.816
  577   2HD   ARG  83          2HD       ARG  83  -7.905  -5.415  27.679
  578    HE   ARG  83           HE       ARG  83 -10.176  -5.342  27.097
  579   1HH1  ARG  83          1HH1      ARG  83  -8.317  -2.864  25.419
  580   2HH1  ARG  83          2HH1      ARG  83  -9.545  -2.439  24.291
  581   1HH2  ARG  83          1HH2      ARG  83 -11.791  -4.939  25.548
  582   2HH2  ARG  83          2HH2      ARG  83 -11.536  -3.751  24.298
  583    H    ASN  84           H        ASN  84  -8.514  -0.509  26.072
  584    HA   ASN  84           HA       ASN  84  -6.034   0.084  25.119
  585   1HB   ASN  84          1HB       ASN  84  -6.241  -2.813  25.203
  586   2HB   ASN  84          2HB       ASN  84  -6.382  -2.336  23.522
  587   1HD2  ASN  84          2HD2      ASN  84  -4.422  -1.608  26.442
  588   2HD2  ASN  84          1HD2      ASN  84  -2.886  -1.491  25.573
  589    HA   PRO  85           HA       PRO  85  -8.982   1.451  22.048
  590   1HB   PRO  85          1HB       PRO  85  -7.368   2.212  19.962
  591   2HB   PRO  85          2HB       PRO  85  -7.462   3.123  21.497
  592   1HG   PRO  85          1HG       PRO  85  -5.380   1.075  20.731
  593   2HG   PRO  85          2HG       PRO  85  -5.122   2.713  21.392
  594   1HD   PRO  85          1HD       PRO  85  -5.105   0.524  22.985
  595   2HD   PRO  85          2HD       PRO  85  -5.855   2.042  23.558
  Start of MODEL   15
    1   1H    LYS   1          1H        LYS   1  -1.505  15.120 -15.682
    2   2H    LYS   1          2H        LYS   1  -3.059  14.548 -15.712
    3   3H    LYS   1          3H        LYS   1  -2.646  15.807 -14.723
    4    HA   LYS   1           HA       LYS   1  -2.859  13.891 -13.415
    5   1HB   LYS   1          1HB       LYS   1  -1.355  11.957 -13.792
    6   2HB   LYS   1          2HB       LYS   1  -2.557  12.185 -15.066
    7   1HG   LYS   1          1HG       LYS   1  -0.851  13.196 -16.541
    8   2HG   LYS   1          2HG       LYS   1   0.357  13.070 -15.243
    9   1HD   LYS   1          1HD       LYS   1   0.087  10.605 -15.237
   10   2HD   LYS   1          2HD       LYS   1  -1.127  10.725 -16.519
   11   1HE   LYS   1          1HE       LYS   1   1.048  10.079 -17.440
   12   2HE   LYS   1          2HE       LYS   1   0.588  11.676 -18.052
   13   1HZ   LYS   1          1HZ       LYS   1   2.388  11.219 -15.771
   14   2HZ   LYS   1          2HZ       LYS   1   2.894  11.504 -17.319
   15   3HZ   LYS   1          3HZ       LYS   1   2.060  12.660 -16.494
   16    H    ALA   2           H        ALA   2  -1.557  13.638 -11.557
   17    HA   ALA   2           HA       ALA   2   0.558  15.667 -11.226
   18   1HB   ALA   2          1HB       ALA   2  -0.665  13.679  -9.277
   19   2HB   ALA   2          2HB       ALA   2   0.502  14.957  -8.871
   20   3HB   ALA   2          3HB       ALA   2  -1.110  15.390  -9.468
   21    H    THR   3           H        THR   3   1.630  14.388 -13.034
   22    HA   THR   3           HA       THR   3   3.357  13.239 -13.817
   23    HB   THR   3           HB       THR   3   5.275  12.722 -12.476
   24    HG1  THR   3           HG1      THR   3   3.597  13.176 -10.239
   25   1HG2  THR   3          1HG2      THR   3   4.836  15.098 -13.056
   26   2HG2  THR   3          2HG2      THR   3   4.013  15.322 -11.497
   27   3HG2  THR   3          3HG2      THR   3   5.737  14.919 -11.539
   28    H    MET   4           H        MET   4   3.241  11.252 -10.895
   29    HA   MET   4           HA       MET   4   3.385   8.868 -12.536
   30   1HB   MET   4          1HB       MET   4   3.178   9.165  -9.514
   31   2HB   MET   4          2HB       MET   4   3.602   7.690 -10.402
   32   1HG   MET   4          1HG       MET   4   5.558   8.924 -11.396
   33   2HG   MET   4          2HG       MET   4   5.185  10.282 -10.323
   34   1HE   MET   4          1HE       MET   4   7.561  10.372  -9.383
   35   2HE   MET   4          2HE       MET   4   8.448   8.968  -8.756
   36   3HE   MET   4          3HE       MET   4   8.034   9.052 -10.483
   37    H    GLN   5           H        GLN   5   1.179   9.611 -13.494
   38    HA   GLN   5           HA       GLN   5  -0.781   8.669 -14.175
   39   1HB   GLN   5          1HB       GLN   5  -0.819   6.825 -11.780
   40   2HB   GLN   5          2HB       GLN   5  -1.658   6.642 -13.295
   41   1HG   GLN   5          1HG       GLN   5   0.111   5.736 -14.386
   42   2HG   GLN   5          2HG       GLN   5   1.316   6.759 -13.622
   43   1HE2  GLN   5          2HE2      GLN   5   1.170   6.325 -10.950
   44   2HE2  GLN   5          1HE2      GLN   5   1.491   4.625 -10.626
   45    H    CYS   6           H        CYS   6  -0.653   9.010 -10.656
   46    HA   CYS   6           HA       CYS   6  -3.362   9.435 -10.087
   47   1HB   CYS   6          1HB       CYS   6  -2.454   9.922  -7.885
   48   2HB   CYS   6          2HB       CYS   6  -1.405   8.735  -8.644
   49    H    GLY   7           H        GLY   7  -3.435  11.677  -8.411
   50   1HA   GLY   7          1HA       GLY   7  -3.115  14.156  -8.807
   51   2HA   GLY   7          2HA       GLY   7  -3.844  13.861 -10.401
   52    H    GLU   8           H        GLU   8  -5.617  11.776  -9.560
   53    HA   GLU   8           HA       GLU   8  -7.877  13.310  -8.621
   54   1HB   GLU   8          1HB       GLU   8  -7.498  10.310  -9.014
   55   2HB   GLU   8          2HB       GLU   8  -9.034  11.129  -8.706
   56   1HG   GLU   8          1HG       GLU   8  -8.753  12.449 -10.801
   57   2HG   GLU   8          2HG       GLU   8  -7.241  11.592 -11.141
   58    H    ASN   9           H        ASN   9  -6.960  14.106  -6.635
   59    HA   ASN   9           HA       ASN   9  -7.210  14.264  -4.374
   60   1HB   ASN   9          1HB       ASN   9  -9.157  12.760  -4.485
   61   2HB   ASN   9          2HB       ASN   9  -8.105  11.347  -4.291
   62   1HD2  ASN   9          2HD2      ASN   9 -10.278  12.189  -2.534
   63   2HD2  ASN   9          1HD2      ASN   9  -9.536  12.379  -0.960
   64    H    GLU  10           H        GLU  10  -5.873  11.031  -5.189
   65    HA   GLU  10           HA       GLU  10  -3.591  11.420  -3.392
   66   1HB   GLU  10          1HB       GLU  10  -2.701   9.389  -4.629
   67   2HB   GLU  10          2HB       GLU  10  -4.127   9.164  -3.619
   68   1HG   GLU  10          1HG       GLU  10  -5.600   8.996  -5.479
   69   2HG   GLU  10          2HG       GLU  10  -4.406   9.641  -6.611
   70    H    LYS  11           H        LYS  11  -1.680  12.421  -3.987
   71    HA   LYS  11           HA       LYS  11  -1.158  13.146  -6.810
   72   1HB   LYS  11          1HB       LYS  11  -0.835  15.472  -6.230
   73   2HB   LYS  11          2HB       LYS  11  -2.450  14.961  -5.743
   74   1HG   LYS  11          1HG       LYS  11  -1.928  16.009  -3.801
   75   2HG   LYS  11          2HG       LYS  11  -1.156  14.480  -3.400
   76   1HD   LYS  11          1HD       LYS  11   0.953  15.630  -4.632
   77   2HD   LYS  11          2HD       LYS  11   0.071  17.109  -4.260
   78   1HE   LYS  11          1HE       LYS  11   1.109  14.980  -2.343
   79   2HE   LYS  11          2HE       LYS  11   1.659  16.652  -2.485
   80   1HZ   LYS  11          1HZ       LYS  11  -0.576  17.305  -1.747
   81   2HZ   LYS  11          2HZ       LYS  11  -0.932  15.714  -1.481
   82   3HZ   LYS  11          3HZ       LYS  11   0.250  16.445  -0.608
   83    H    TYR  12           H        TYR  12   1.094  13.427  -7.228
   84    HA   TYR  12           HA       TYR  12   2.751  11.624  -5.972
   85   1HB   TYR  12          1HB       TYR  12   3.192  12.405  -8.171
   86   2HB   TYR  12          2HB       TYR  12   3.480  14.058  -7.605
   87    HD1  TYR  12           HD1      TYR  12   4.733  10.546  -7.409
   88    HD2  TYR  12           HD2      TYR  12   5.637  14.695  -6.682
   89    HE1  TYR  12           HE1      TYR  12   6.906   9.909  -6.451
   90    HE2  TYR  12           HE2      TYR  12   7.781  14.045  -5.635
   91    HH   TYR  12           HH       TYR  12   8.975  12.232  -4.709
   92    H    ASP  13           H        ASP  13   4.141  11.538  -4.241
   93    HA   ASP  13           HA       ASP  13   5.465  13.963  -3.360
   94   1HB   ASP  13          1HB       ASP  13   3.476  14.061  -1.917
   95   2HB   ASP  13          2HB       ASP  13   3.726  12.359  -1.462
   96    H    SER  14           H        SER  14   7.354  13.467  -2.132
   97    HA   SER  14           HA       SER  14   8.504  10.856  -2.770
   98   1HB   SER  14          1HB       SER  14   9.667  13.192  -1.251
   99   2HB   SER  14          2HB       SER  14  10.543  11.811  -1.937
  100    HG   SER  14           HG       SER  14  10.512  13.701  -3.321
  101    H    CYS  15           H        CYS  15   6.336  10.266  -1.145
  102    HA   CYS  15           HA       CYS  15   7.690   8.900   0.937
  103   1HB   CYS  15          1HB       CYS  15   7.564  11.193   2.032
  104   2HB   CYS  15          2HB       CYS  15   5.819  10.975   2.098
  105    H    GLY  16           H        GLY  16   6.421   7.359  -0.559
  106   1HA   GLY  16          1HA       GLY  16   5.018   5.557  -0.309
  107   2HA   GLY  16          2HA       GLY  16   4.533   6.183   1.279
  108    H    SER  17           H        SER  17   2.390   5.403   0.724
  109    HA   SER  17           HA       SER  17   0.860   7.067  -1.218
  110   1HB   SER  17          1HB       SER  17  -0.714   5.101  -1.127
  111   2HB   SER  17          2HB       SER  17   0.881   4.738  -1.810
  112    HG   SER  17           HG       SER  17   0.432   3.136  -0.342
  113    H    LYS  18           H        LYS  18  -0.385   5.054   1.313
  114    HA   LYS  18           HA       LYS  18  -1.676   7.370   2.714
  115   1HB   LYS  18          1HB       LYS  18  -2.788   5.600   4.037
  116   2HB   LYS  18          2HB       LYS  18  -3.079   5.428   2.311
  117   1HG   LYS  18          1HG       LYS  18  -1.423   3.580   2.180
  118   2HG   LYS  18          2HG       LYS  18  -1.095   3.764   3.913
  119   1HD   LYS  18          1HD       LYS  18  -3.520   3.257   4.372
  120   2HD   LYS  18          2HD       LYS  18  -3.761   3.037   2.626
  121   1HE   LYS  18          1HE       LYS  18  -3.513   0.867   3.663
  122   2HE   LYS  18          2HE       LYS  18  -2.122   1.177   2.613
  123   1HZ   LYS  18          1HZ       LYS  18  -2.172   1.520   5.535
  124   2HZ   LYS  18          2HZ       LYS  18  -1.494   0.254   4.726
  125   3HZ   LYS  18          3HZ       LYS  18  -0.866   1.766   4.559
  126    H    GLU  19           H        GLU  19   0.534   8.101   2.837
  127    HA   GLU  19           HA       GLU  19   2.313   7.199   4.877
  128   1HB   GLU  19          1HB       GLU  19   2.755   9.772   5.035
  129   2HB   GLU  19          2HB       GLU  19   3.269   8.841   3.655
  130   1HG   GLU  19          1HG       GLU  19   2.341  11.044   3.043
  131   2HG   GLU  19          2HG       GLU  19   1.597   9.680   2.241
  132    H    CYS  20           H        CYS  20   1.890   6.912   6.989
  133    HA   CYS  20           HA       CYS  20  -0.560   7.697   8.184
  134   1HB   CYS  20          1HB       CYS  20   0.805   5.820   8.917
  135   2HB   CYS  20          2HB       CYS  20   2.027   6.934   9.563
  136    H    ASP  21           H        ASP  21   2.193   9.553   7.496
  137    HA   ASP  21           HA       ASP  21   2.475  11.686   9.090
  138   1HB   ASP  21          1HB       ASP  21   1.889  11.485   6.113
  139   2HB   ASP  21          2HB       ASP  21   2.363  13.014   6.878
  140    H    LYS  22           H        LYS  22  -0.082  11.852   6.541
  141    HA   LYS  22           HA       LYS  22  -1.714  13.605   8.270
  142   1HB   LYS  22          1HB       LYS  22  -2.102  12.641   5.420
  143   2HB   LYS  22          2HB       LYS  22  -3.098  13.839   6.270
  144   1HG   LYS  22          1HG       LYS  22  -0.966  15.194   6.651
  145   2HG   LYS  22          2HG       LYS  22  -0.172  14.132   5.484
  146   1HD   LYS  22          1HD       LYS  22  -2.642  15.880   5.008
  147   2HD   LYS  22          2HD       LYS  22  -1.008  16.207   4.417
  148   1HE   LYS  22          1HE       LYS  22  -2.763  13.836   3.621
  149   2HE   LYS  22          2HE       LYS  22  -2.482  15.271   2.658
  150   1HZ   LYS  22          1HZ       LYS  22  -0.133  14.723   2.647
  151   2HZ   LYS  22          2HZ       LYS  22  -0.461  13.288   3.402
  152   3HZ   LYS  22          3HZ       LYS  22  -1.084  13.611   1.899
  153    H    LYS  23           H        LYS  23  -1.614  11.443   9.689
  154    HA   LYS  23           HA       LYS  23  -3.666   9.511   9.083
  155   1HB   LYS  23          1HB       LYS  23  -3.557   8.906  11.493
  156   2HB   LYS  23          2HB       LYS  23  -2.082   8.775  10.564
  157   1HG   LYS  23          1HG       LYS  23  -1.538   9.544  12.705
  158   2HG   LYS  23          2HG       LYS  23  -1.234  10.889  11.606
  159   1HD   LYS  23          1HD       LYS  23  -3.323  11.972  12.338
  160   2HD   LYS  23          2HD       LYS  23  -3.725  10.574  13.362
  161   1HE   LYS  23          1HE       LYS  23  -1.228  12.312  13.672
  162   2HE   LYS  23          2HE       LYS  23  -2.737  12.570  14.557
  163   1HZ   LYS  23          1HZ       LYS  23  -1.121  10.136  14.710
  164   2HZ   LYS  23          2HZ       LYS  23  -1.184  11.350  15.825
  165   3HZ   LYS  23          3HZ       LYS  23  -2.526  10.434  15.531
  166    H    CYS  24           H        CYS  24  -5.639   9.168  10.239
  167    HA   CYS  24           HA       CYS  24  -7.294  11.529  10.491
  168   1HB   CYS  24          1HB       CYS  24  -8.329   9.557   9.777
  169   2HB   CYS  24          2HB       CYS  24  -7.740   8.594  11.140
  170    H    LYS  25           H        LYS  25  -6.235  12.834  11.992
  171    HA   LYS  25           HA       LYS  25  -5.729  12.003  14.705
  172   1HB   LYS  25          1HB       LYS  25  -5.663  14.439  15.221
  173   2HB   LYS  25          2HB       LYS  25  -4.575  13.896  13.959
  174   1HG   LYS  25          1HG       LYS  25  -5.441  16.016  13.376
  175   2HG   LYS  25          2HG       LYS  25  -5.989  14.835  12.201
  176   1HD   LYS  25          1HD       LYS  25  -7.706  16.449  12.672
  177   2HD   LYS  25          2HD       LYS  25  -8.268  14.889  13.258
  178   1HE   LYS  25          1HE       LYS  25  -7.639  15.577  15.597
  179   2HE   LYS  25          2HE       LYS  25  -6.984  17.096  14.957
  180   1HZ   LYS  25          1HZ       LYS  25  -9.202  17.605  14.169
  181   2HZ   LYS  25          2HZ       LYS  25  -9.785  16.231  14.880
  182   3HZ   LYS  25          3HZ       LYS  25  -9.140  17.427  15.805
  183    H    TYR  26           H        TYR  26  -6.881  12.893  16.622
  184    HA   TYR  26           HA       TYR  26  -9.796  13.091  16.243
  185   1HB   TYR  26          1HB       TYR  26  -8.368  11.015  17.929
  186   2HB   TYR  26          2HB       TYR  26 -10.028  11.520  18.216
  187    HD1  TYR  26           HD1      TYR  26 -11.582  11.540  16.001
  188    HD2  TYR  26           HD2      TYR  26  -8.085   9.080  16.564
  189    HE1  TYR  26           HE1      TYR  26 -12.368  10.007  14.227
  190    HE2  TYR  26           HE2      TYR  26  -8.985   7.449  14.927
  191    HH   TYR  26           HH       TYR  26 -12.150   7.883  13.296
  192    H    ASP  27           H        ASP  27 -10.530  14.661  17.304
  193    HA   ASP  27           HA       ASP  27  -9.284  15.678  19.812
  194   1HB   ASP  27          1HB       ASP  27  -9.153  17.317  17.956
  195   2HB   ASP  27          2HB       ASP  27 -10.897  17.151  17.673
  196    H    GLY  28           H        GLY  28 -11.015  16.622  21.235
  197   1HA   GLY  28          1HA       GLY  28 -13.186  16.538  22.190
  198   2HA   GLY  28          2HA       GLY  28 -13.618  15.112  21.228
  199    H    VAL  29           H        VAL  29 -11.598  13.494  21.389
  200    HA   VAL  29           HA       VAL  29 -10.580  13.161  24.122
  201    HB   VAL  29           HB       VAL  29 -11.689  10.875  22.422
  202   1HG1  VAL  29          1HG1      VAL  29 -10.592  10.946  25.265
  203   2HG1  VAL  29          2HG1      VAL  29 -11.406   9.552  24.523
  204   3HG1  VAL  29          3HG1      VAL  29  -9.877  10.113  23.865
  205   1HG2  VAL  29          1HG2      VAL  29 -12.891  12.225  24.880
  206   2HG2  VAL  29          2HG2      VAL  29 -13.600  12.129  23.252
  207   3HG2  VAL  29          3HG2      VAL  29 -13.439  10.668  24.222
  208    H    GLU  30           H        GLU  30  -8.562  11.811  23.892
  209    HA   GLU  30           HA       GLU  30  -6.604  11.212  22.989
  210   1HB   GLU  30          1HB       GLU  30  -7.649  11.711  20.179
  211   2HB   GLU  30          2HB       GLU  30  -6.243  10.781  20.670
  212   1HG   GLU  30          1HG       GLU  30  -9.165  10.052  21.180
  213   2HG   GLU  30          2HG       GLU  30  -8.070   9.312  20.016
  214    H    GLU  31           H        GLU  31  -7.917  13.925  21.036
  215    HA   GLU  31           HA       GLU  31  -7.058  15.970  20.484
  216   1HB   GLU  31          1HB       GLU  31  -5.657  15.670  23.179
  217   2HB   GLU  31          2HB       GLU  31  -5.507  17.100  22.168
  218   1HG   GLU  31          1HG       GLU  31  -7.193  17.404  23.918
  219   2HG   GLU  31          2HG       GLU  31  -7.843  17.595  22.287
  220    H    GLU  32           H        GLU  32  -5.916  13.630  19.382
  221    HA   GLU  32           HA       GLU  32  -2.980  13.901  19.549
  222   1HB   GLU  32          1HB       GLU  32  -2.901  11.914  18.138
  223   2HB   GLU  32          2HB       GLU  32  -3.880  11.682  19.591
  224   1HG   GLU  32          1HG       GLU  32  -5.954  11.910  18.278
  225   2HG   GLU  32          2HG       GLU  32  -4.997  12.270  16.826
  226    H    ASP  33           H        ASP  33  -3.873  16.260  18.615
  227    HA   ASP  33           HA       ASP  33  -4.057  16.251  15.688
  228   1HB   ASP  33          1HB       ASP  33  -5.452  17.735  17.118
  229   2HB   ASP  33          2HB       ASP  33  -3.985  18.581  17.641
  230    H    ASP  34           H        ASP  34  -1.700  15.111  16.237
  231    HA   ASP  34           HA       ASP  34   0.458  17.137  15.987
  232   1HB   ASP  34          1HB       ASP  34   1.990  15.307  16.044
  233   2HB   ASP  34          2HB       ASP  34   0.836  15.123  17.370
  234    H    GLU  35           H        GLU  35  -1.329  14.768  14.069
  235    HA   GLU  35           HA       GLU  35  -1.345  14.194  11.882
  236   1HB   GLU  35          1HB       GLU  35  -0.906  17.178  11.485
  237   2HB   GLU  35          2HB       GLU  35  -1.611  16.039  10.330
  238   1HG   GLU  35          1HG       GLU  35  -3.429  15.546  12.005
  239   2HG   GLU  35          2HG       GLU  35  -2.799  16.860  13.020
  240    H    GLU  36           H        GLU  36   1.421  14.039  13.113
  241    HA   GLU  36           HA       GLU  36   2.709  13.387  10.661
  242   1HB   GLU  36          1HB       GLU  36   3.139  15.860  10.790
  243   2HB   GLU  36          2HB       GLU  36   3.824  15.638  12.403
  244   1HG   GLU  36          1HG       GLU  36   5.560  15.849  10.720
  245   2HG   GLU  36          2HG       GLU  36   5.594  14.237  11.440
  246    HA   PRO  37           HA       PRO  37   4.182  10.956  14.328
  247   1HB   PRO  37          1HB       PRO  37   3.193   8.488  13.701
  248   2HB   PRO  37          2HB       PRO  37   2.306   9.706  14.649
  249   1HG   PRO  37          1HG       PRO  37   1.905   9.025  11.736
  250   2HG   PRO  37          2HG       PRO  37   0.710   9.405  12.982
  251   1HD   PRO  37          1HD       PRO  37   1.695  11.226  11.116
  252   2HD   PRO  37          2HD       PRO  37   0.986  11.682  12.680
  253    H    ASN  38           H        ASN  38   3.736   9.140  11.276
  254    HA   ASN  38           HA       ASN  38   5.061   8.288   9.726
  255   1HB   ASN  38          1HB       ASN  38   5.664  10.623   9.335
  256   2HB   ASN  38          2HB       ASN  38   7.022  10.491  10.459
  257   1HD2  ASN  38          2HD2      ASN  38   5.867   9.733   7.231
  258   2HD2  ASN  38          1HD2      ASN  38   7.372   9.024   6.664
  259    H    VAL  39           H        VAL  39   7.288   9.059  12.441
  260    HA   VAL  39           HA       VAL  39   8.969   6.792  11.846
  261    HB   VAL  39           HB       VAL  39   8.964   8.721  14.184
  262   1HG1  VAL  39          1HG1      VAL  39  10.958   6.534  13.431
  263   2HG1  VAL  39          2HG1      VAL  39  11.229   7.803  14.641
  264   3HG1  VAL  39          3HG1      VAL  39   9.980   6.582  14.914
  265   1HG2  VAL  39          1HG2      VAL  39  10.715   8.448  11.714
  266   2HG2  VAL  39          2HG2      VAL  39   9.514   9.722  12.008
  267   3HG2  VAL  39          3HG2      VAL  39  10.945   9.605  13.039
  268    HA   PRO  40           HA       PRO  40   7.093   4.548  15.590
  269   1HB   PRO  40          1HB       PRO  40   4.870   5.499  16.899
  270   2HB   PRO  40          2HB       PRO  40   6.546   5.920  17.352
  271   1HG   PRO  40          1HG       PRO  40   4.658   7.524  15.610
  272   2HG   PRO  40          2HG       PRO  40   5.625   8.098  16.996
  273   1HD   PRO  40          1HD       PRO  40   6.527   8.446  14.487
  274   2HD   PRO  40          2HD       PRO  40   7.645   7.928  15.782
  275    H    CYS  41           H        CYS  41   4.566   6.424  13.830
  276    HA   CYS  41           HA       CYS  41   3.009   3.986  13.249
  277   1HB   CYS  41          1HB       CYS  41   1.965   6.292  13.595
  278   2HB   CYS  41          2HB       CYS  41   2.678   6.735  12.039
  279    H    LEU  42           H        LEU  42   5.091   3.119  12.541
  280    HA   LEU  42           HA       LEU  42   6.618   4.026  10.471
  281   1HB   LEU  42          1HB       LEU  42   7.614   1.686  10.478
  282   2HB   LEU  42          2HB       LEU  42   7.638   2.656  11.934
  283    HG   LEU  42           HG       LEU  42   5.850   1.380  12.961
  284   1HD1  LEU  42          1HD1      LEU  42   5.820  -0.342  10.452
  285   2HD1  LEU  42          2HD1      LEU  42   4.951  -0.661  11.965
  286   3HD1  LEU  42          3HD1      LEU  42   4.508   0.742  10.987
  287   1HD2  LEU  42          1HD2      LEU  42   8.169   0.660  13.217
  288   2HD2  LEU  42          2HD2      LEU  42   7.053  -0.716  13.247
  289   3HD2  LEU  42          3HD2      LEU  42   8.015  -0.388  11.789
  290    H    VAL  43           H        VAL  43   4.748   4.583   8.873
  291    HA   VAL  43           HA       VAL  43   4.421   2.410   6.870
  292    HB   VAL  43           HB       VAL  43   3.935   5.378   6.411
  293   1HG1  VAL  43          1HG1      VAL  43   3.007   2.896   4.925
  294   2HG1  VAL  43          2HG1      VAL  43   2.446   4.549   4.619
  295   3HG1  VAL  43          3HG1      VAL  43   4.135   4.139   4.342
  296   1HG2  VAL  43          1HG2      VAL  43   2.029   3.141   7.291
  297   2HG2  VAL  43          2HG2      VAL  43   2.515   4.524   8.288
  298   3HG2  VAL  43          3HG2      VAL  43   1.533   4.777   6.829
  299    H    ARG  44           H        ARG  44   6.751   1.993   7.264
  300    HA   ARG  44           HA       ARG  44   8.733   3.866   6.662
  301   1HB   ARG  44          1HB       ARG  44   8.755   1.567   7.995
  302   2HB   ARG  44          2HB       ARG  44   9.235   0.898   6.437
  303   1HG   ARG  44          1HG       ARG  44  11.214   1.277   7.632
  304   2HG   ARG  44          2HG       ARG  44  11.180   2.594   6.459
  305   1HD   ARG  44          1HD       ARG  44  10.183   2.866   9.345
  306   2HD   ARG  44          2HD       ARG  44  11.861   3.111   8.893
  307    HE   ARG  44           HE       ARG  44  11.237   4.896   7.382
  308   1HH1  ARG  44          1HH1      ARG  44   8.918   4.216  10.015
  309   2HH1  ARG  44          2HH1      ARG  44   8.163   5.780   9.898
  310   1HH2  ARG  44          1HH2      ARG  44  10.372   6.949   7.381
  311   2HH2  ARG  44          2HH2      ARG  44   9.127   7.416   8.505
  312    H    VAL  45           H        VAL  45   6.836   2.111   4.493
  313    HA   VAL  45           HA       VAL  45   8.548   2.201   2.158
  314    HB   VAL  45           HB       VAL  45   6.413   1.765   0.965
  315   1HG1  VAL  45          1HG1      VAL  45   7.779  -0.076   1.874
  316   2HG1  VAL  45          2HG1      VAL  45   6.846  -0.031   3.385
  317   3HG1  VAL  45          3HG1      VAL  45   6.052  -0.467   1.860
  318   1HG2  VAL  45          1HG2      VAL  45   4.814   2.992   2.448
  319   2HG2  VAL  45          2HG2      VAL  45   4.346   1.314   2.178
  320   3HG2  VAL  45          3HG2      VAL  45   5.070   1.788   3.719
  321    H    CYS  46           H        CYS  46   9.005   4.587   3.260
  322    HA   CYS  46           HA       CYS  46   7.218   6.704   2.330
  323   1HB   CYS  46          1HB       CYS  46   8.555   6.763   4.440
  324   2HB   CYS  46          2HB       CYS  46  10.025   6.780   3.444
  325    H    HIS  47           H        HIS  47   7.551   5.402   0.133
  326    HA   HIS  47           HA       HIS  47   9.956   6.397  -1.335
  327   1HB   HIS  47          1HB       HIS  47   9.555   4.519  -2.851
  328   2HB   HIS  47          2HB       HIS  47   9.906   4.032  -1.193
  329    HD1  HIS  47           HD1      HIS  47   6.355   4.918  -2.478
  330    HD2  HIS  47           HD2      HIS  47   8.737   1.673  -1.254
  331    HE1  HIS  47           HE1      HIS  47   4.833   2.878  -2.426
  332    H    GLN  48           H        GLN  48   9.709   7.650  -2.964
  333    HA   GLN  48           HA       GLN  48   7.921   9.268  -4.015
  334   1HB   GLN  48          1HB       GLN  48   8.829   8.782  -6.290
  335   2HB   GLN  48          2HB       GLN  48  10.046   8.982  -5.043
  336   1HG   GLN  48          1HG       GLN  48  10.915   6.955  -5.436
  337   2HG   GLN  48          2HG       GLN  48   9.366   6.141  -5.231
  338   1HE2  GLN  48          2HE2      GLN  48   7.818   6.325  -7.126
  339   2HE2  GLN  48          1HE2      GLN  48   8.528   6.171  -8.735
  340    H    ASP  49           H        ASP  49   5.685   9.023  -3.903
  341    HA   ASP  49           HA       ASP  49   4.367   7.482  -5.917
  342   1HB   ASP  49          1HB       ASP  49   5.006   5.598  -4.408
  343   2HB   ASP  49          2HB       ASP  49   4.250   6.425  -3.054
  344    H    CYS  50           H        CYS  50   1.805   7.597  -5.264
  345    HA   CYS  50           HA       CYS  50   1.527  10.450  -4.668
  346   1HB   CYS  50          1HB       CYS  50  -0.490   8.554  -5.856
  347   2HB   CYS  50          2HB       CYS  50  -0.596  10.311  -5.711
  348    H    VAL  51           H        VAL  51   0.727  11.339  -2.951
  349    HA   VAL  51           HA       VAL  51  -0.515   9.645  -0.838
  350    HB   VAL  51           HB       VAL  51   0.426  11.180   0.764
  351   1HG1  VAL  51          1HG1      VAL  51   1.933   9.402  -0.001
  352   2HG1  VAL  51          2HG1      VAL  51   2.578  10.432  -1.280
  353   3HG1  VAL  51          3HG1      VAL  51   2.852  10.851   0.420
  354   1HG2  VAL  51          1HG2      VAL  51   1.436  12.810  -1.588
  355   2HG2  VAL  51          2HG2      VAL  51   0.245  13.320  -0.378
  356   3HG2  VAL  51          3HG2      VAL  51   1.917  13.061   0.106
  357    H    CYS  52           H        CYS  52  -2.101  10.817   0.536
  358    HA   CYS  52           HA       CYS  52  -4.200  11.972  -0.922
  359   1HB   CYS  52          1HB       CYS  52  -3.473  12.442   2.002
  360   2HB   CYS  52          2HB       CYS  52  -5.052  12.706   1.268
  361    H    GLU  53           H        GLU  53  -4.680  14.071  -1.642
  362    HA   GLU  53           HA       GLU  53  -2.888  16.210  -1.546
  363   1HB   GLU  53          1HB       GLU  53  -5.243  15.895  -2.757
  364   2HB   GLU  53          2HB       GLU  53  -5.837  16.798  -1.357
  365   1HG   GLU  53          1HG       GLU  53  -3.702  17.710  -3.331
  366   2HG   GLU  53          2HG       GLU  53  -5.386  18.239  -3.294
  367    H    GLU  54           H        GLU  54  -2.628  18.013  -0.113
  368    HA   GLU  54           HA       GLU  54  -2.557  17.495   2.615
  369   1HB   GLU  54          1HB       GLU  54  -2.720  20.228   1.290
  370   2HB   GLU  54          2HB       GLU  54  -2.072  19.853   2.894
  371   1HG   GLU  54          1HG       GLU  54  -0.892  19.017   0.203
  372   2HG   GLU  54          2HG       GLU  54  -0.219  20.140   1.378
  373    H    GLY  55           H        GLY  55  -5.276  18.943   0.813
  374   1HA   GLY  55          1HA       GLY  55  -6.762  19.816   3.102
  375   2HA   GLY  55          2HA       GLY  55  -7.398  19.451   1.493
  376    H    PHE  56           H        PHE  56  -5.922  16.611   2.279
  377    HA   PHE  56           HA       PHE  56  -8.316  15.446   3.592
  378   1HB   PHE  56          1HB       PHE  56  -6.656  14.312   1.337
  379   2HB   PHE  56          2HB       PHE  56  -8.076  13.576   2.066
  380    HD1  PHE  56           HD1      PHE  56 -10.135  15.592   2.124
  381    HD2  PHE  56           HD2      PHE  56  -7.085  14.972  -0.846
  382    HE1  PHE  56           HE1      PHE  56 -11.536  16.750   0.456
  383    HE2  PHE  56           HE2      PHE  56  -8.493  16.126  -2.531
  384    HZ   PHE  56           HZ       PHE  56 -10.726  17.018  -1.884
  385    H    TYR  57           H        TYR  57  -7.918  13.437   4.666
  386    HA   TYR  57           HA       TYR  57  -5.134  12.912   5.558
  387   1HB   TYR  57          1HB       TYR  57  -7.714  13.015   7.188
  388   2HB   TYR  57          2HB       TYR  57  -6.172  12.404   7.777
  389    HD1  TYR  57           HD1      TYR  57  -7.988  15.479   6.698
  390    HD2  TYR  57           HD2      TYR  57  -4.367  13.898   8.410
  391    HE1  TYR  57           HE1      TYR  57  -7.176  17.786   7.127
  392    HE2  TYR  57           HE2      TYR  57  -3.521  16.186   8.737
  393    HH   TYR  57           HH       TYR  57  -4.140  18.438   8.873
  394    H    ARG  58           H        ARG  58  -4.736  10.702   5.968
  395    HA   ARG  58           HA       ARG  58  -6.377   8.927   4.304
  396   1HB   ARG  58          1HB       ARG  58  -4.782   7.236   4.684
  397   2HB   ARG  58          2HB       ARG  58  -3.950   8.738   4.310
  398   1HG   ARG  58          1HG       ARG  58  -2.619   8.276   6.056
  399   2HG   ARG  58          2HG       ARG  58  -3.957   8.801   7.067
  400   1HD   ARG  58          1HD       ARG  58  -4.761   6.287   6.925
  401   2HD   ARG  58          2HD       ARG  58  -3.187   5.978   6.228
  402    HE   ARG  58           HE       ARG  58  -2.118   6.341   8.222
  403   1HH1  ARG  58          1HH1      ARG  58  -5.542   7.167   8.634
  404   2HH1  ARG  58          2HH1      ARG  58  -5.584   6.706  10.320
  405   1HH2  ARG  58          1HH2      ARG  58  -2.089   6.062  10.464
  406   2HH2  ARG  58          2HH2      ARG  58  -3.559   6.168  11.398
  407    H    ASN  59           H        ASN  59  -8.406   9.034   5.274
  408    HA   ASN  59           HA       ASN  59  -9.028   8.748   7.969
  409   1HB   ASN  59          1HB       ASN  59 -10.697   9.276   6.339
  410   2HB   ASN  59          2HB       ASN  59 -10.543   7.675   5.590
  411   1HD2  ASN  59          2HD2      ASN  59 -12.507   6.691   5.979
  412   2HD2  ASN  59          1HD2      ASN  59 -13.165   6.510   7.603
  413    H    LYS  60           H        LYS  60  -8.268   6.223   5.629
  414    HA   LYS  60           HA       LYS  60  -7.001   4.631   7.545
  415   1HB   LYS  60          1HB       LYS  60  -8.534   2.529   7.294
  416   2HB   LYS  60          2HB       LYS  60  -8.814   3.768   8.497
  417   1HG   LYS  60          1HG       LYS  60 -10.589   4.798   6.965
  418   2HG   LYS  60          2HG       LYS  60 -10.396   3.404   5.917
  419   1HD   LYS  60          1HD       LYS  60 -12.306   3.183   7.425
  420   2HD   LYS  60          2HD       LYS  60 -11.117   1.913   7.730
  421   1HE   LYS  60          1HE       LYS  60 -12.171   2.948   9.785
  422   2HE   LYS  60          2HE       LYS  60 -10.410   2.950   9.794
  423   1HZ   LYS  60          1HZ       LYS  60 -12.121   5.241   9.093
  424   2HZ   LYS  60          2HZ       LYS  60 -11.316   5.028  10.510
  425   3HZ   LYS  60          3HZ       LYS  60 -10.467   5.255   9.123
  426    H    ASP  61           H        ASP  61  -8.679   2.862   5.040
  427    HA   ASP  61           HA       ASP  61  -6.127   2.131   3.909
  428   1HB   ASP  61          1HB       ASP  61  -7.933   0.509   4.117
  429   2HB   ASP  61          2HB       ASP  61  -8.976   1.479   3.063
  430    H    ASP  62           H        ASP  62  -5.557   4.388   3.399
  431    HA   ASP  62           HA       ASP  62  -5.319   6.238   2.161
  432   1HB   ASP  62          1HB       ASP  62  -4.331   4.451   0.595
  433   2HB   ASP  62          2HB       ASP  62  -5.853   4.521  -0.296
  434    H    LYS  63           H        LYS  63  -7.918   5.690   3.166
  435    HA   LYS  63           HA       LYS  63  -9.849   6.765   1.221
  436   1HB   LYS  63          1HB       LYS  63 -10.000   6.146   4.189
  437   2HB   LYS  63          2HB       LYS  63 -11.372   6.718   3.217
  438   1HG   LYS  63          1HG       LYS  63  -9.797   4.144   2.747
  439   2HG   LYS  63          2HG       LYS  63 -11.306   4.244   3.648
  440   1HD   LYS  63          1HD       LYS  63 -12.559   4.905   1.711
  441   2HD   LYS  63          2HD       LYS  63 -11.108   5.075   0.712
  442   1HE   LYS  63          1HE       LYS  63 -11.886   2.432   2.003
  443   2HE   LYS  63          2HE       LYS  63 -12.417   2.923   0.387
  444   1HZ   LYS  63          1HZ       LYS  63  -9.587   2.744   1.168
  445   2HZ   LYS  63          2HZ       LYS  63 -10.423   1.575   0.361
  446   3HZ   LYS  63          3HZ       LYS  63 -10.193   3.054  -0.322
  447    H    CYS  64           H        CYS  64  -8.388   8.446   0.694
  448    HA   CYS  64           HA       CYS  64  -7.522  10.477   2.464
  449   1HB   CYS  64          1HB       CYS  64  -7.984  10.484  -0.528
  450   2HB   CYS  64          2HB       CYS  64  -7.124  11.742   0.377
  451    H    VAL  65           H        VAL  65  -9.276  11.299   3.759
  452    HA   VAL  65           HA       VAL  65 -11.025  13.213   2.316
  453    HB   VAL  65           HB       VAL  65 -12.977  12.576   3.681
  454   1HG1  VAL  65          1HG1      VAL  65 -12.760  11.830   1.331
  455   2HG1  VAL  65          2HG1      VAL  65 -12.027  10.311   1.890
  456   3HG1  VAL  65          3HG1      VAL  65 -13.698  10.704   2.328
  457   1HG2  VAL  65          1HG2      VAL  65 -11.730  11.282   5.467
  458   2HG2  VAL  65          2HG2      VAL  65 -13.126  10.422   4.789
  459   3HG2  VAL  65          3HG2      VAL  65 -11.493   9.989   4.274
  460    H    SER  66           H        SER  66 -11.914  14.901   3.761
  461    HA   SER  66           HA       SER  66  -9.730  15.944   5.189
  462   1HB   SER  66          1HB       SER  66 -12.613  16.893   5.130
  463   2HB   SER  66          2HB       SER  66 -11.191  17.862   5.565
  464    HG   SER  66           HG       SER  66 -10.383  17.554   3.477
  465    H    ALA  67           H        ALA  67  -9.709  16.854   7.328
  466    HA   ALA  67           HA       ALA  67  -9.771  15.074   9.397
  467   1HB   ALA  67          1HB       ALA  67 -10.190  18.084   9.547
  468   2HB   ALA  67          2HB       ALA  67  -9.695  17.033  10.891
  469   3HB   ALA  67          3HB       ALA  67  -8.631  17.232   9.486
  470    H    GLU  68           H        GLU  68 -12.384  17.200   8.340
  471    HA   GLU  68           HA       GLU  68 -14.285  16.809  10.376
  472   1HB   GLU  68          1HB       GLU  68 -14.841  17.135   7.387
  473   2HB   GLU  68          2HB       GLU  68 -15.903  17.546   8.740
  474   1HG   GLU  68          1HG       GLU  68 -14.183  19.239   9.496
  475   2HG   GLU  68          2HG       GLU  68 -13.246  18.904   8.028
  476    H    ASP  69           H        ASP  69 -13.754  14.956   7.343
  477    HA   ASP  69           HA       ASP  69 -15.945  13.121   7.722
  478   1HB   ASP  69          1HB       ASP  69 -13.411  12.813   6.070
  479   2HB   ASP  69          2HB       ASP  69 -14.900  11.872   5.905
  480    H    CYS  70           H        CYS  70 -12.438  13.012   8.258
  481    HA   CYS  70           HA       CYS  70 -12.134  10.449   9.404
  482   1HB   CYS  70          1HB       CYS  70 -10.117  11.476   9.066
  483   2HB   CYS  70          2HB       CYS  70 -10.731  13.063   9.504
  484    H    GLU  71           H        GLU  71 -12.890  13.522  11.143
  485    HA   GLU  71           HA       GLU  71 -13.233  12.331  13.695
  486   1HB   GLU  71          1HB       GLU  71 -14.245  14.887  12.400
  487   2HB   GLU  71          2HB       GLU  71 -14.631  14.505  14.067
  488   1HG   GLU  71          1HG       GLU  71 -11.751  14.540  13.070
  489   2HG   GLU  71          2HG       GLU  71 -12.583  15.994  13.631
  490    H    LEU  72           H        LEU  72 -15.639  13.034  11.122
  491    HA   LEU  72           HA       LEU  72 -17.894  12.013  12.551
  492   1HB   LEU  72          1HB       LEU  72 -17.311  12.157   9.577
  493   2HB   LEU  72          2HB       LEU  72 -18.871  11.668  10.240
  494    HG   LEU  72           HG       LEU  72 -17.603  14.352  10.942
  495   1HD1  LEU  72          1HD1      LEU  72 -19.549  13.711   8.685
  496   2HD1  LEU  72          2HD1      LEU  72 -19.066  15.339   9.211
  497   3HD1  LEU  72          3HD1      LEU  72 -17.866  14.252   8.499
  498   1HD2  LEU  72          1HD2      LEU  72 -20.486  13.380  11.030
  499   2HD2  LEU  72          2HD2      LEU  72 -19.433  13.602  12.447
  500   3HD2  LEU  72          3HD2      LEU  72 -19.908  14.995  11.474
  501    H    ASP  73           H        ASP  73 -15.374  10.332  10.638
  502    HA   ASP  73           HA       ASP  73 -16.564   7.713  11.139
  503   1HB   ASP  73          1HB       ASP  73 -15.078   8.228   9.185
  504   2HB   ASP  73          2HB       ASP  73 -13.710   8.323  10.302
  505    H    ASN  74           H        ASN  74 -16.909   8.467  13.359
  506    HA   ASN  74           HA       ASN  74 -15.698   6.941  15.299
  507   1HB   ASN  74          1HB       ASN  74 -13.647   8.153  15.331
  508   2HB   ASN  74          2HB       ASN  74 -14.468   9.716  15.173
  509   1HD2  ASN  74          2HD2      ASN  74 -13.532   7.155  17.433
  510   2HD2  ASN  74          1HD2      ASN  74 -13.953   8.080  18.866
  511    H    MET  75           H        MET  75 -16.742  10.348  14.899
  512    HA   MET  75           HA       MET  75 -18.655  11.407  15.315
  513   1HB   MET  75          1HB       MET  75 -19.714   9.256  14.459
  514   2HB   MET  75          2HB       MET  75 -19.969   8.795  16.143
  515   1HG   MET  75          1HG       MET  75 -21.990   9.779  15.368
  516   2HG   MET  75          2HG       MET  75 -21.260  10.900  16.508
  517   1HE   MET  75          1HE       MET  75 -22.185  10.105  12.836
  518   2HE   MET  75          2HE       MET  75 -21.603  11.524  11.944
  519   3HE   MET  75          3HE       MET  75 -20.438  10.356  12.596
  520    H    ASP  76           H        ASP  76 -18.109   8.954  17.830
  521    HA   ASP  76           HA       ASP  76 -19.466  10.113  19.944
  522   1HB   ASP  76          1HB       ASP  76 -18.585   7.808  19.886
  523   2HB   ASP  76          2HB       ASP  76 -16.929   8.427  19.997
  524    H    PHE  77           H        PHE  77 -16.054  10.646  18.989
  525    HA   PHE  77           HA       PHE  77 -15.496  12.358  21.295
  526   1HB   PHE  77          1HB       PHE  77 -13.851  11.873  18.788
  527   2HB   PHE  77          2HB       PHE  77 -13.297  12.542  20.332
  528    HD1  PHE  77           HD1      PHE  77 -15.025  10.187  21.870
  529    HD2  PHE  77           HD2      PHE  77 -11.864  10.415  18.942
  530    HE1  PHE  77           HE1      PHE  77 -14.179   7.999  22.611
  531    HE2  PHE  77           HE2      PHE  77 -10.950   8.267  19.772
  532    HZ   PHE  77           HZ       PHE  77 -12.113   7.044  21.599
  533    H    ILE  78           H        ILE  78 -13.914  13.994  18.912
  534    HA   ILE  78           HA       ILE  78 -14.201  15.804  17.706
  535    HB   ILE  78           HB       ILE  78 -17.234  15.649  17.808
  536   1HG1  ILE  78          1HG1      ILE  78 -15.350  14.011  16.091
  537   2HG1  ILE  78          2HG1      ILE  78 -16.657  13.434  17.115
  538   1HG2  ILE  78          1HG2      ILE  78 -16.055  17.695  16.932
  539   2HG2  ILE  78          2HG2      ILE  78 -15.319  16.672  15.684
  540   3HG2  ILE  78          3HG2      ILE  78 -17.083  16.894  15.753
  541   1HD1  ILE  78          1HD1      ILE  78 -18.318  14.577  15.655
  542   2HD1  ILE  78          2HD1      ILE  78 -17.001  14.984  14.527
  543   3HD1  ILE  78          3HD1      ILE  78 -17.393  13.297  14.851
  544    H    TYR  79           H        TYR  79 -16.941  15.866  20.010
  545    HA   TYR  79           HA       TYR  79 -16.780  18.665  20.466
  546   1HB   TYR  79          1HB       TYR  79 -18.060  16.853  22.486
  547   2HB   TYR  79          2HB       TYR  79 -18.600  18.405  21.868
  548    HD1  TYR  79           HD1      TYR  79 -19.147  18.339  19.183
  549    HD2  TYR  79           HD2      TYR  79 -19.142  14.911  21.804
  550    HE1  TYR  79           HE1      TYR  79 -20.067  16.926  17.362
  551    HE2  TYR  79           HE2      TYR  79 -20.013  13.514  19.980
  552    HH   TYR  79           HH       TYR  79 -20.029  13.424  17.630
  553    HA   PRO  80           HA       PRO  80 -12.970  18.620  22.943
  554   1HB   PRO  80          1HB       PRO  80 -14.485  20.936  24.170
  555   2HB   PRO  80          2HB       PRO  80 -12.720  20.793  23.891
  556   1HG   PRO  80          1HG       PRO  80 -14.219  22.096  22.062
  557   2HG   PRO  80          2HG       PRO  80 -13.044  20.870  21.495
  558   1HD   PRO  80          1HD       PRO  80 -16.032  20.590  21.799
  559   2HD   PRO  80          2HD       PRO  80 -14.949  19.976  20.512
  560    H    GLY  81           H        GLY  81 -12.664  17.051  24.568
  561   1HA   GLY  81          1HA       GLY  81 -12.685  16.303  26.740
  562   2HA   GLY  81          2HA       GLY  81 -13.975  17.432  27.171
  563    H    THR  82           H        THR  82 -15.825  16.768  25.128
  564    HA   THR  82           HA       THR  82 -17.396  15.364  24.422
  565    HB   THR  82           HB       THR  82 -15.532  13.071  25.180
  566    HG1  THR  82           HG1      THR  82 -15.436  15.025  23.280
  567   1HG2  THR  82          1HG2      THR  82 -17.830  13.256  23.204
  568   2HG2  THR  82          2HG2      THR  82 -16.726  11.877  23.407
  569   3HG2  THR  82          3HG2      THR  82 -17.834  12.319  24.713
  570    H    ARG  83           H        ARG  83 -16.095  14.002  27.487
  571    HA   ARG  83           HA       ARG  83 -18.712  13.055  28.339
  572   1HB   ARG  83          1HB       ARG  83 -16.078  13.319  29.841
  573   2HB   ARG  83          2HB       ARG  83 -17.527  12.473  30.407
  574   1HG   ARG  83          1HG       ARG  83 -17.395  10.952  28.429
  575   2HG   ARG  83          2HG       ARG  83 -15.910  11.764  27.909
  576   1HD   ARG  83          1HD       ARG  83 -15.313   9.720  29.115
  577   2HD   ARG  83          2HD       ARG  83 -14.788  11.142  30.007
  578    HE   ARG  83           HE       ARG  83 -16.180  10.621  31.735
  579   1HH1  ARG  83          1HH1      ARG  83 -17.225   8.771  28.915
  580   2HH1  ARG  83          2HH1      ARG  83 -18.374   7.800  29.794
  581   1HH2  ARG  83          1HH2      ARG  83 -17.684   9.379  32.898
  582   2HH2  ARG  83          2HH2      ARG  83 -18.642   8.160  32.105
  583    H    ASN  84           H        ASN  84 -19.511  15.354  27.841
  584    HA   ASN  84           HA       ASN  84 -20.372  17.354  28.508
  585   1HB   ASN  84          1HB       ASN  84 -21.751  15.573  29.539
  586   2HB   ASN  84          2HB       ASN  84 -20.881  15.789  31.061
  587   1HD2  ASN  84          2HD2      ASN  84 -20.878  18.184  31.877
  588   2HD2  ASN  84          1HD2      ASN  84 -22.403  19.051  31.689
  589    HA   PRO  85           HA       PRO  85 -16.612  19.004  30.740
  590   1HB   PRO  85          1HB       PRO  85 -17.485  21.206  28.852
  591   2HB   PRO  85          2HB       PRO  85 -15.827  20.774  29.363
  592   1HG   PRO  85          1HG       PRO  85 -16.748  19.955  26.954
  593   2HG   PRO  85          2HG       PRO  85 -15.867  18.795  27.995
  594   1HD   PRO  85          1HD       PRO  85 -18.852  19.069  27.612
  595   2HD   PRO  85          2HD       PRO  85 -17.848  17.590  27.652
  Start of MODEL   16
    1   1H    LYS   1          1H        LYS   1  -6.836   5.901 -10.350
    2   2H    LYS   1          2H        LYS   1  -7.330   4.756 -11.430
    3   3H    LYS   1          3H        LYS   1  -7.682   4.583  -9.825
    4    HA   LYS   1           HA       LYS   1  -5.392   4.378  -9.286
    5   1HB   LYS   1          1HB       LYS   1  -6.598   2.331  -9.620
    6   2HB   LYS   1          2HB       LYS   1  -6.477   2.471 -11.377
    7   1HG   LYS   1          1HG       LYS   1  -4.958   0.771 -10.536
    8   2HG   LYS   1          2HG       LYS   1  -4.056   2.074 -11.306
    9   1HD   LYS   1          1HD       LYS   1  -3.518   3.023  -9.057
   10   2HD   LYS   1          2HD       LYS   1  -4.428   1.707  -8.289
   11   1HE   LYS   1          1HE       LYS   1  -2.885   0.045  -9.239
   12   2HE   LYS   1          2HE       LYS   1  -2.058   1.302 -10.183
   13   1HZ   LYS   1          1HZ       LYS   1  -2.124   1.208  -7.256
   14   2HZ   LYS   1          2HZ       LYS   1  -0.870   0.716  -8.208
   15   3HZ   LYS   1          3HZ       LYS   1  -1.317   2.297  -8.201
   16    H    ALA   2           H        ALA   2  -3.763   5.733  -9.829
   17    HA   ALA   2           HA       ALA   2  -2.805   5.931 -12.648
   18   1HB   ALA   2          1HB       ALA   2  -2.867   8.006 -11.298
   19   2HB   ALA   2          2HB       ALA   2  -1.792   7.249 -10.094
   20   3HB   ALA   2          3HB       ALA   2  -1.211   7.558 -11.740
   21    H    THR   3           H        THR   3  -0.312   5.562 -12.818
   22    HA   THR   3           HA       THR   3   0.441   2.939 -12.000
   23    HB   THR   3           HB       THR   3   2.746   3.963 -12.676
   24    HG1  THR   3           HG1      THR   3   2.503   6.003 -13.705
   25   1HG2  THR   3          1HG2      THR   3   0.371   4.116 -14.609
   26   2HG2  THR   3          2HG2      THR   3   2.084   4.012 -15.078
   27   3HG2  THR   3          3HG2      THR   3   1.309   2.661 -14.229
   28    H    MET   4           H        MET   4   1.601   6.140 -10.954
   29    HA   MET   4           HA       MET   4   2.584   5.172  -8.368
   30   1HB   MET   4          1HB       MET   4   2.245   7.941  -9.600
   31   2HB   MET   4          2HB       MET   4   2.817   7.686  -7.953
   32   1HG   MET   4          1HG       MET   4   4.721   7.990  -9.247
   33   2HG   MET   4          2HG       MET   4   4.684   6.290  -8.787
   34   1HE   MET   4          1HE       MET   4   6.655   5.915 -10.492
   35   2HE   MET   4          2HE       MET   4   6.587   6.382 -12.209
   36   3HE   MET   4          3HE       MET   4   6.605   7.637 -10.947
   37    H    GLN   5           H        GLN   5  -0.025   4.283  -8.547
   38    HA   GLN   5           HA       GLN   5  -1.885   4.092  -7.356
   39   1HB   GLN   5          1HB       GLN   5  -0.201   4.353  -5.507
   40   2HB   GLN   5          2HB       GLN   5  -0.668   6.053  -5.378
   41   1HG   GLN   5          1HG       GLN   5  -3.042   5.295  -4.951
   42   2HG   GLN   5          2HG       GLN   5  -2.431   3.631  -4.942
   43   1HE2  GLN   5          2HE2      GLN   5  -1.890   6.891  -3.376
   44   2HE2  GLN   5          1HE2      GLN   5  -1.471   6.193  -1.822
   45    H    CYS   6           H        CYS   6  -1.171   7.509  -6.820
   46    HA   CYS   6           HA       CYS   6  -2.666   9.046  -6.206
   47   1HB   CYS   6          1HB       CYS   6  -3.006   9.152  -9.210
   48   2HB   CYS   6          2HB       CYS   6  -3.354  10.453  -8.058
   49    H    GLY   7           H        GLY   7  -4.951   8.802  -8.791
   50   1HA   GLY   7          1HA       GLY   7  -7.122   8.145  -8.890
   51   2HA   GLY   7          2HA       GLY   7  -6.825   7.049  -7.536
   52    H    GLU   8           H        GLU   8  -6.544   8.308  -5.355
   53    HA   GLU   8           HA       GLU   8  -9.173   9.523  -4.947
   54   1HB   GLU   8          1HB       GLU   8  -6.982   8.838  -2.938
   55   2HB   GLU   8          2HB       GLU   8  -8.646   9.306  -2.579
   56   1HG   GLU   8          1HG       GLU   8  -8.668   6.971  -2.391
   57   2HG   GLU   8          2HG       GLU   8  -9.386   7.269  -3.974
   58    H    ASN   9           H        ASN   9  -8.253  11.361  -6.409
   59    HA   ASN   9           HA       ASN   9  -7.506  13.456  -6.723
   60   1HB   ASN   9          1HB       ASN   9  -8.461  15.156  -5.401
   61   2HB   ASN   9          2HB       ASN   9  -9.597  13.813  -5.454
   62   1HD2  ASN   9          2HD2      ASN   9  -7.174  15.475  -3.407
   63   2HD2  ASN   9          1HD2      ASN   9  -7.990  15.080  -1.885
   64    H    GLU  10           H        GLU  10  -5.496  11.695  -5.579
   65    HA   GLU  10           HA       GLU  10  -3.915  13.206  -3.693
   66   1HB   GLU  10          1HB       GLU  10  -3.260  10.874  -5.497
   67   2HB   GLU  10          2HB       GLU  10  -2.262  11.385  -4.136
   68   1HG   GLU  10          1HG       GLU  10  -4.458  11.023  -2.755
   69   2HG   GLU  10          2HG       GLU  10  -4.946   9.984  -4.099
   70    H    LYS  11           H        LYS  11  -1.553  13.651  -4.170
   71    HA   LYS  11           HA       LYS  11  -0.932  14.279  -7.001
   72   1HB   LYS  11          1HB       LYS  11  -0.548  16.226  -4.690
   73   2HB   LYS  11          2HB       LYS  11   0.102  16.403  -6.342
   74   1HG   LYS  11          1HG       LYS  11  -2.277  16.236  -7.190
   75   2HG   LYS  11          2HG       LYS  11  -2.823  16.327  -5.505
   76   1HD   LYS  11          1HD       LYS  11  -1.813  18.526  -5.222
   77   2HD   LYS  11          2HD       LYS  11  -1.062  18.458  -6.824
   78   1HE   LYS  11          1HE       LYS  11  -4.080  18.378  -6.364
   79   2HE   LYS  11          2HE       LYS  11  -3.167  19.857  -6.705
   80   1HZ   LYS  11          1HZ       LYS  11  -2.480  18.868  -8.775
   81   2HZ   LYS  11          2HZ       LYS  11  -3.363  17.511  -8.459
   82   3HZ   LYS  11          3HZ       LYS  11  -4.123  18.956  -8.670
   83    H    TYR  12           H        TYR  12   1.329  14.351  -7.430
   84    HA   TYR  12           HA       TYR  12   2.552  12.068  -6.560
   85   1HB   TYR  12          1HB       TYR  12   3.101  13.161  -8.643
   86   2HB   TYR  12          2HB       TYR  12   3.831  14.520  -7.787
   87    HD1  TYR  12           HD1      TYR  12   4.218  10.924  -8.666
   88    HD2  TYR  12           HD2      TYR  12   6.058  14.329  -6.764
   89    HE1  TYR  12           HE1      TYR  12   6.409   9.778  -8.728
   90    HE2  TYR  12           HE2      TYR  12   8.243  13.156  -6.790
   91    HH   TYR  12           HH       TYR  12   8.650  10.033  -8.478
   92    H    ASP  13           H        ASP  13   3.871  11.447  -4.879
   93    HA   ASP  13           HA       ASP  13   5.589  13.214  -3.429
   94   1HB   ASP  13          1HB       ASP  13   3.480  14.049  -2.403
   95   2HB   ASP  13          2HB       ASP  13   2.982  12.371  -2.098
   96    H    SER  14           H        SER  14   6.860  12.006  -1.867
   97    HA   SER  14           HA       SER  14   6.748   9.079  -2.167
   98   1HB   SER  14          1HB       SER  14   8.456  10.951  -0.479
   99   2HB   SER  14          2HB       SER  14   8.522   9.189  -0.337
  100    HG   SER  14           HG       SER  14  10.074   9.982  -1.819
  101    H    CYS  15           H        CYS  15   4.395   8.982  -1.548
  102    HA   CYS  15           HA       CYS  15   3.873   9.346   1.247
  103   1HB   CYS  15          1HB       CYS  15   1.937   8.277   1.256
  104   2HB   CYS  15          2HB       CYS  15   1.993   9.249  -0.203
  105    H    GLY  16           H        GLY  16   5.979   7.178  -0.145
  106   1HA   GLY  16          1HA       GLY  16   5.852   5.331   2.067
  107   2HA   GLY  16          2HA       GLY  16   7.213   5.504   0.911
  108    H    SER  17           H        SER  17   5.541   7.438   3.229
  109    HA   SER  17           HA       SER  17   7.200   7.751   5.387
  110   1HB   SER  17          1HB       SER  17   8.149   9.997   5.118
  111   2HB   SER  17          2HB       SER  17   8.876   8.873   3.972
  112    HG   SER  17           HG       SER  17   7.323   9.756   2.389
  113    H    LYS  18           H        LYS  18   5.221   9.690   3.110
  114    HA   LYS  18           HA       LYS  18   3.609  10.876   5.139
  115   1HB   LYS  18          1HB       LYS  18   4.032  11.338   2.465
  116   2HB   LYS  18          2HB       LYS  18   2.390  10.670   2.504
  117   1HG   LYS  18          1HG       LYS  18   2.294  13.071   2.641
  118   2HG   LYS  18          2HG       LYS  18   1.804  12.435   4.222
  119   1HD   LYS  18          1HD       LYS  18   4.135  12.974   5.065
  120   2HD   LYS  18          2HD       LYS  18   4.554  13.564   3.453
  121   1HE   LYS  18          1HE       LYS  18   2.350  14.699   5.251
  122   2HE   LYS  18          2HE       LYS  18   3.973  15.375   5.067
  123   1HZ   LYS  18          1HZ       LYS  18   3.508  15.716   2.745
  124   2HZ   LYS  18          2HZ       LYS  18   1.982  15.122   2.923
  125   3HZ   LYS  18          3HZ       LYS  18   2.415  16.506   3.690
  126    H    GLU  19           H        GLU  19   3.513   7.685   3.870
  127    HA   GLU  19           HA       GLU  19   0.789   7.095   4.115
  128   1HB   GLU  19          1HB       GLU  19   1.499   4.759   4.436
  129   2HB   GLU  19          2HB       GLU  19   2.273   5.525   3.063
  130   1HG   GLU  19          1HG       GLU  19   4.069   4.402   4.026
  131   2HG   GLU  19          2HG       GLU  19   4.289   5.996   4.722
  132    H    CYS  20           H        CYS  20  -0.493   6.481   5.797
  133    HA   CYS  20           HA       CYS  20  -1.358   6.844   7.843
  134   1HB   CYS  20          1HB       CYS  20  -0.138   4.683   8.013
  135   2HB   CYS  20          2HB       CYS  20   1.233   5.524   8.731
  136    H    ASP  21           H        ASP  21   0.857   8.993   6.866
  137    HA   ASP  21           HA       ASP  21   1.708  10.193   9.357
  138   1HB   ASP  21          1HB       ASP  21   2.971  10.279   7.216
  139   2HB   ASP  21          2HB       ASP  21   1.708  11.264   6.489
  140    H    LYS  22           H        LYS  22  -0.280  11.512   6.683
  141    HA   LYS  22           HA       LYS  22  -1.960  13.079   8.523
  142   1HB   LYS  22          1HB       LYS  22  -2.110  12.651   5.517
  143   2HB   LYS  22          2HB       LYS  22  -3.063  13.816   6.465
  144   1HG   LYS  22          1HG       LYS  22  -0.834  14.781   7.268
  145   2HG   LYS  22          2HG       LYS  22  -0.045  13.841   6.004
  146   1HD   LYS  22          1HD       LYS  22  -2.241  15.936   5.554
  147   2HD   LYS  22          2HD       LYS  22  -0.507  16.226   5.433
  148   1HE   LYS  22          1HE       LYS  22  -1.204  15.969   3.217
  149   2HE   LYS  22          2HE       LYS  22  -0.418  14.435   3.598
  150   1HZ   LYS  22          1HZ       LYS  22  -3.330  14.926   3.687
  151   2HZ   LYS  22          2HZ       LYS  22  -2.513  14.304   2.396
  152   3HZ   LYS  22          3HZ       LYS  22  -2.572  13.471   3.819
  153    H    LYS  23           H        LYS  23  -2.180  10.645   9.468
  154    HA   LYS  23           HA       LYS  23  -4.327   9.115   8.299
  155   1HB   LYS  23          1HB       LYS  23  -2.451   8.036   9.399
  156   2HB   LYS  23          2HB       LYS  23  -2.652   8.996  10.856
  157   1HG   LYS  23          1HG       LYS  23  -3.423   6.723  11.187
  158   2HG   LYS  23          2HG       LYS  23  -4.776   7.846  11.354
  159   1HD   LYS  23          1HD       LYS  23  -5.406   7.381   8.959
  160   2HD   LYS  23          2HD       LYS  23  -4.030   6.287   8.848
  161   1HE   LYS  23          1HE       LYS  23  -5.925   4.867   9.299
  162   2HE   LYS  23          2HE       LYS  23  -5.094   5.004  10.855
  163   1HZ   LYS  23          1HZ       LYS  23  -6.712   6.825  11.347
  164   2HZ   LYS  23          2HZ       LYS  23  -7.479   6.433   9.934
  165   3HZ   LYS  23          3HZ       LYS  23  -7.397   5.334  11.154
  166    H    CYS  24           H        CYS  24  -6.467   9.127   9.052
  167    HA   CYS  24           HA       CYS  24  -7.546  11.251  10.630
  168   1HB   CYS  24          1HB       CYS  24  -9.011  10.066   9.193
  169   2HB   CYS  24          2HB       CYS  24  -8.516   8.490   9.844
  170    H    LYS  25           H        LYS  25  -7.169  11.590  12.756
  171    HA   LYS  25           HA       LYS  25  -6.247   9.362  14.502
  172   1HB   LYS  25          1HB       LYS  25  -6.238  12.374  14.929
  173   2HB   LYS  25          2HB       LYS  25  -5.508  11.160  15.995
  174   1HG   LYS  25          1HG       LYS  25  -4.642  11.995  13.213
  175   2HG   LYS  25          2HG       LYS  25  -3.752  12.149  14.736
  176   1HD   LYS  25          1HD       LYS  25  -3.663   9.611  14.853
  177   2HD   LYS  25          2HD       LYS  25  -4.302   9.594  13.199
  178   1HE   LYS  25          1HE       LYS  25  -1.663  10.797  14.155
  179   2HE   LYS  25          2HE       LYS  25  -1.900   9.418  13.076
  180   1HZ   LYS  25          1HZ       LYS  25  -3.024  11.040  11.571
  181   2HZ   LYS  25          2HZ       LYS  25  -2.448  12.244  12.525
  182   3HZ   LYS  25          3HZ       LYS  25  -1.394  11.252  11.737
  183    H    TYR  26           H        TYR  26  -7.125   9.175  16.652
  184    HA   TYR  26           HA       TYR  26  -9.912  10.178  16.957
  185   1HB   TYR  26          1HB       TYR  26  -8.973   7.320  17.349
  186   2HB   TYR  26          2HB       TYR  26 -10.589   7.943  17.692
  187    HD1  TYR  26           HD1      TYR  26 -11.595   9.389  15.560
  188    HD2  TYR  26           HD2      TYR  26  -8.840   6.076  15.344
  189    HE1  TYR  26           HE1      TYR  26 -12.441   8.842  13.334
  190    HE2  TYR  26           HE2      TYR  26  -9.727   5.507  13.100
  191    HH   TYR  26           HH       TYR  26 -12.543   7.202  11.692
  192    H    ASP  27           H        ASP  27  -8.051  11.567  18.232
  193    HA   ASP  27           HA       ASP  27  -8.455  10.692  21.070
  194   1HB   ASP  27          1HB       ASP  27  -6.035  10.913  20.112
  195   2HB   ASP  27          2HB       ASP  27  -6.382  12.647  20.127
  196    H    GLY  28           H        GLY  28  -7.791  13.415  22.003
  197   1HA   GLY  28          1HA       GLY  28 -10.357  14.444  22.286
  198   2HA   GLY  28          2HA       GLY  28  -8.842  15.304  22.591
  199    H    VAL  29           H        VAL  29 -11.341  14.657  20.299
  200    HA   VAL  29           HA       VAL  29 -12.195  15.772  18.517
  201    HB   VAL  29           HB       VAL  29 -10.400  18.156  19.110
  202   1HG1  VAL  29          1HG1      VAL  29 -11.555  18.169  16.894
  203   2HG1  VAL  29          2HG1      VAL  29 -13.103  17.884  17.710
  204   3HG1  VAL  29          3HG1      VAL  29 -12.212  19.395  17.981
  205   1HG2  VAL  29          1HG2      VAL  29 -13.141  17.458  20.248
  206   2HG2  VAL  29          2HG2      VAL  29 -11.638  17.679  21.169
  207   3HG2  VAL  29          3HG2      VAL  29 -12.376  19.058  20.353
  208    H    GLU  30           H        GLU  30 -10.422  13.860  18.231
  209    HA   GLU  30           HA       GLU  30  -9.181  12.805  16.676
  210   1HB   GLU  30          1HB       GLU  30  -8.595  15.401  15.218
  211   2HB   GLU  30          2HB       GLU  30  -8.341  13.749  14.657
  212   1HG   GLU  30          1HG       GLU  30 -10.681  13.360  14.376
  213   2HG   GLU  30          2HG       GLU  30 -11.119  14.847  15.236
  214    H    GLU  31           H        GLU  31  -7.903  16.051  17.421
  215    HA   GLU  31           HA       GLU  31  -6.126  16.822  18.435
  216   1HB   GLU  31          1HB       GLU  31  -6.225  14.827  19.929
  217   2HB   GLU  31          2HB       GLU  31  -5.019  14.031  18.870
  218   1HG   GLU  31          1HG       GLU  31  -3.449  15.898  19.333
  219   2HG   GLU  31          2HG       GLU  31  -4.693  16.679  20.327
  220    H    GLU  32           H        GLU  32  -5.784  14.410  15.922
  221    HA   GLU  32           HA       GLU  32  -4.461  14.280  14.075
  222   1HB   GLU  32          1HB       GLU  32  -4.191  17.289  14.370
  223   2HB   GLU  32          2HB       GLU  32  -3.932  16.326  12.910
  224   1HG   GLU  32          1HG       GLU  32  -6.333  15.549  13.048
  225   2HG   GLU  32          2HG       GLU  32  -6.581  16.668  14.401
  226    H    ASP  33           H        ASP  33  -3.278  13.636  16.463
  227    HA   ASP  33           HA       ASP  33  -0.745  14.866  16.911
  228   1HB   ASP  33          1HB       ASP  33  -2.003  13.683  18.649
  229   2HB   ASP  33          2HB       ASP  33  -1.862  12.160  17.754
  230    H    ASP  34           H        ASP  34  -0.022  14.883  14.669
  231    HA   ASP  34           HA       ASP  34   0.732  12.382  13.347
  232   1HB   ASP  34          1HB       ASP  34  -0.245  14.298  12.109
  233   2HB   ASP  34          2HB       ASP  34   1.152  15.292  12.553
  234    H    GLU  35           H        GLU  35   1.921  12.641  15.788
  235    HA   GLU  35           HA       GLU  35   4.646  13.671  15.582
  236   1HB   GLU  35          1HB       GLU  35   3.240  13.571  17.688
  237   2HB   GLU  35          2HB       GLU  35   3.513  11.817  17.716
  238   1HG   GLU  35          1HG       GLU  35   5.993  12.286  17.752
  239   2HG   GLU  35          2HG       GLU  35   5.627  14.022  17.743
  240    H    GLU  36           H        GLU  36   4.831  12.447  13.495
  241    HA   GLU  36           HA       GLU  36   5.630  10.767  12.184
  242   1HB   GLU  36          1HB       GLU  36   7.397  10.203  14.597
  243   2HB   GLU  36          2HB       GLU  36   7.696   9.738  12.921
  244   1HG   GLU  36          1HG       GLU  36   9.038  11.646  13.286
  245   2HG   GLU  36          2HG       GLU  36   7.681  12.204  12.300
  246    HA   PRO  37           HA       PRO  37   3.234   7.308  14.396
  247   1HB   PRO  37          1HB       PRO  37   1.006   7.269  12.767
  248   2HB   PRO  37          2HB       PRO  37   1.142   8.275  14.240
  249   1HG   PRO  37          1HG       PRO  37   1.699   9.119  11.384
  250   2HG   PRO  37          2HG       PRO  37   0.664   9.949  12.575
  251   1HD   PRO  37          1HD       PRO  37   3.213  10.737  12.168
  252   2HD   PRO  37          2HD       PRO  37   2.557  10.619  13.834
  253    H    ASN  38           H        ASN  38   3.553   8.224  10.984
  254    HA   ASN  38           HA       ASN  38   3.523   5.981   9.497
  255   1HB   ASN  38          1HB       ASN  38   5.480   6.972   8.210
  256   2HB   ASN  38          2HB       ASN  38   4.044   7.970   8.461
  257   1HD2  ASN  38          2HD2      ASN  38   5.444   9.708   7.841
  258   2HD2  ASN  38          1HD2      ASN  38   6.264  10.567   9.138
  259    H    VAL  39           H        VAL  39   6.467   6.832  11.402
  260    HA   VAL  39           HA       VAL  39   7.974   4.643  10.574
  261    HB   VAL  39           HB       VAL  39   8.147   6.216  13.158
  262   1HG1  VAL  39          1HG1      VAL  39  10.098   4.169  11.998
  263   2HG1  VAL  39          2HG1      VAL  39  10.457   5.293  13.325
  264   3HG1  VAL  39          3HG1      VAL  39   9.245   4.029  13.552
  265   1HG2  VAL  39          1HG2      VAL  39   9.748   6.271  10.572
  266   2HG2  VAL  39          2HG2      VAL  39   8.553   7.481  11.078
  267   3HG2  VAL  39          3HG2      VAL  39  10.038   7.270  12.010
  268    HA   PRO  40           HA       PRO  40   6.525   1.685  13.987
  269   1HB   PRO  40          1HB       PRO  40   4.478   2.338  15.703
  270   2HB   PRO  40          2HB       PRO  40   6.204   2.658  16.035
  271   1HG   PRO  40          1HG       PRO  40   4.159   4.576  14.894
  272   2HG   PRO  40          2HG       PRO  40   5.298   4.868  16.237
  273   1HD   PRO  40          1HD       PRO  40   5.911   5.713  13.749
  274   2HD   PRO  40          2HD       PRO  40   7.155   4.955  14.773
  275    H    CYS  41           H        CYS  41   4.088   3.785  12.423
  276    HA   CYS  41           HA       CYS  41   2.064   1.737  12.241
  277   1HB   CYS  41          1HB       CYS  41   1.629   4.181  12.306
  278   2HB   CYS  41          2HB       CYS  41   2.331   4.314  10.684
  279    H    LEU  42           H        LEU  42   3.861   0.257  11.461
  280    HA   LEU  42           HA       LEU  42   5.056  -0.801   9.817
  281   1HB   LEU  42          1HB       LEU  42   3.518  -2.373   8.698
  282   2HB   LEU  42          2HB       LEU  42   3.427  -2.252  10.439
  283    HG   LEU  42           HG       LEU  42   1.300  -2.648   9.355
  284   1HD1  LEU  42          1HD1      LEU  42   1.489  -1.497  11.605
  285   2HD1  LEU  42          2HD1      LEU  42   1.065   0.012  10.760
  286   3HD1  LEU  42          3HD1      LEU  42  -0.048  -1.350  10.736
  287   1HD2  LEU  42          1HD2      LEU  42   1.468  -1.354   7.308
  288   2HD2  LEU  42          2HD2      LEU  42   0.026  -0.900   8.224
  289   3HD2  LEU  42          3HD2      LEU  42   1.438   0.169   8.231
  290    H    VAL  43           H        VAL  43   5.593   1.456   8.888
  291    HA   VAL  43           HA       VAL  43   5.329   2.693   6.745
  292    HB   VAL  43           HB       VAL  43   7.726   2.342   6.030
  293   1HG1  VAL  43          1HG1      VAL  43   7.001   4.088   7.601
  294   2HG1  VAL  43          2HG1      VAL  43   7.161   2.938   8.947
  295   3HG1  VAL  43          3HG1      VAL  43   8.591   3.437   8.025
  296   1HG2  VAL  43          1HG2      VAL  43   7.964  -0.040   6.836
  297   2HG2  VAL  43          2HG2      VAL  43   9.178   1.065   7.498
  298   3HG2  VAL  43          3HG2      VAL  43   7.816   0.550   8.503
  299    H    ARG  44           H        ARG  44   3.636   1.756   5.421
  300    HA   ARG  44           HA       ARG  44   4.459  -0.192   3.367
  301   1HB   ARG  44          1HB       ARG  44   2.362   0.643   2.205
  302   2HB   ARG  44          2HB       ARG  44   2.170  -0.261   3.708
  303   1HG   ARG  44          1HG       ARG  44   1.511   1.589   4.946
  304   2HG   ARG  44          2HG       ARG  44   2.236   2.748   3.819
  305   1HD   ARG  44          1HD       ARG  44  -0.102   0.998   3.034
  306   2HD   ARG  44          2HD       ARG  44  -0.308   2.578   3.824
  307    HE   ARG  44           HE       ARG  44   1.422   3.074   1.711
  308   1HH1  ARG  44          1HH1      ARG  44  -1.818   1.709   1.971
  309   2HH1  ARG  44          2HH1      ARG  44  -2.410   2.389   0.488
  310   1HH2  ARG  44          1HH2      ARG  44   0.702   4.002  -0.228
  311   2HH2  ARG  44          2HH2      ARG  44  -0.883   3.660  -0.877
  312    H    VAL  45           H        VAL  45   6.456   0.790   2.783
  313    HA   VAL  45           HA       VAL  45   6.771   3.427   2.098
  314    HB   VAL  45           HB       VAL  45   8.917   2.841   1.006
  315   1HG1  VAL  45          1HG1      VAL  45   8.693   3.356   3.408
  316   2HG1  VAL  45          2HG1      VAL  45   8.391   1.639   3.753
  317   3HG1  VAL  45          3HG1      VAL  45   9.953   2.153   3.098
  318   1HG2  VAL  45          1HG2      VAL  45   8.309   0.515   0.191
  319   2HG2  VAL  45          2HG2      VAL  45   9.744   0.539   1.221
  320   3HG2  VAL  45          3HG2      VAL  45   8.198  -0.017   1.878
  321    H    CYS  46           H        CYS  46   4.762   3.726   0.767
  322    HA   CYS  46           HA       CYS  46   4.999   3.340  -2.125
  323   1HB   CYS  46          1HB       CYS  46   3.218   5.166  -2.134
  324   2HB   CYS  46          2HB       CYS  46   2.798   3.565  -1.546
  325    H    HIS  47           H        HIS  47   7.371   4.012  -1.776
  326    HA   HIS  47           HA       HIS  47   7.840   6.842  -1.356
  327   1HB   HIS  47          1HB       HIS  47   9.306   4.636  -0.872
  328   2HB   HIS  47          2HB       HIS  47   9.972   5.044  -2.455
  329    HD1  HIS  47           HD1      HIS  47   9.532   6.566   1.118
  330    HD2  HIS  47           HD2      HIS  47  11.629   7.077  -2.493
  331    HE1  HIS  47           HE1      HIS  47  11.211   8.406   1.528
  332    H    GLN  48           H        GLN  48   8.549   8.380  -2.946
  333    HA   GLN  48           HA       GLN  48   7.893   9.511  -4.788
  334   1HB   GLN  48          1HB       GLN  48   9.463   7.191  -5.993
  335   2HB   GLN  48          2HB       GLN  48   8.992   8.636  -6.882
  336   1HG   GLN  48          1HG       GLN  48  10.130  10.007  -5.006
  337   2HG   GLN  48          2HG       GLN  48  10.806   8.475  -4.442
  338   1HE2  GLN  48          2HE2      GLN  48  10.464  10.493  -7.432
  339   2HE2  GLN  48          1HE2      GLN  48  12.070  10.099  -8.040
  340    H    ASP  49           H        ASP  49   5.666   8.651  -3.998
  341    HA   ASP  49           HA       ASP  49   4.267   7.259  -6.228
  342   1HB   ASP  49          1HB       ASP  49   4.560   5.894  -4.147
  343   2HB   ASP  49          2HB       ASP  49   3.654   7.126  -3.249
  344    H    CYS  50           H        CYS  50   1.973   8.175  -3.970
  345    HA   CYS  50           HA       CYS  50   1.719  10.975  -4.762
  346   1HB   CYS  50          1HB       CYS  50   1.022   9.412  -6.663
  347   2HB   CYS  50          2HB       CYS  50  -0.309   8.878  -5.619
  348    H    VAL  51           H        VAL  51   0.369  12.043  -3.265
  349    HA   VAL  51           HA       VAL  51  -0.836  10.335  -1.133
  350    HB   VAL  51           HB       VAL  51   1.491  11.315  -0.563
  351   1HG1  VAL  51          1HG1      VAL  51   1.009  13.592  -1.573
  352   2HG1  VAL  51          2HG1      VAL  51  -0.070  13.896  -0.205
  353   3HG1  VAL  51          3HG1      VAL  51   1.643  13.597   0.088
  354   1HG2  VAL  51          1HG2      VAL  51  -0.907  11.845   1.225
  355   2HG2  VAL  51          2HG2      VAL  51   0.061  10.350   1.103
  356   3HG2  VAL  51          3HG2      VAL  51   0.771  11.845   1.713
  357    H    CYS  52           H        CYS  52  -2.550  11.215  -0.035
  358    HA   CYS  52           HA       CYS  52  -4.474  12.855  -1.178
  359   1HB   CYS  52          1HB       CYS  52  -3.778  12.592   1.790
  360   2HB   CYS  52          2HB       CYS  52  -5.324  13.111   1.117
  361    H    GLU  53           H        GLU  53  -4.787  15.030  -1.371
  362    HA   GLU  53           HA       GLU  53  -2.597  16.817  -1.168
  363   1HB   GLU  53          1HB       GLU  53  -5.594  17.323  -1.274
  364   2HB   GLU  53          2HB       GLU  53  -4.387  18.605  -1.431
  365   1HG   GLU  53          1HG       GLU  53  -3.497  17.622  -3.462
  366   2HG   GLU  53          2HG       GLU  53  -4.498  16.181  -3.275
  367    H    GLU  54           H        GLU  54  -2.115  18.524   0.279
  368    HA   GLU  54           HA       GLU  54  -2.419  18.077   3.043
  369   1HB   GLU  54          1HB       GLU  54  -2.038  20.767   1.654
  370   2HB   GLU  54          2HB       GLU  54  -1.637  20.373   3.329
  371   1HG   GLU  54          1HG       GLU  54  -0.271  19.296   0.818
  372   2HG   GLU  54          2HG       GLU  54   0.397  20.395   2.019
  373    H    GLY  55           H        GLY  55  -4.061  18.404   4.438
  374   1HA   GLY  55          1HA       GLY  55  -5.968  19.662   5.265
  375   2HA   GLY  55          2HA       GLY  55  -6.459  20.014   3.605
  376    H    PHE  56           H        PHE  56  -5.843  17.317   2.573
  377    HA   PHE  56           HA       PHE  56  -8.203  15.843   3.558
  378   1HB   PHE  56          1HB       PHE  56  -6.213  15.212   1.373
  379   2HB   PHE  56          2HB       PHE  56  -7.529  14.178   1.889
  380    HD1  PHE  56           HD1      PHE  56  -6.943  17.706   0.648
  381    HD2  PHE  56           HD2      PHE  56  -9.561  14.270   0.701
  382    HE1  PHE  56           HE1      PHE  56  -8.343  18.730  -1.114
  383    HE2  PHE  56           HE2      PHE  56 -10.953  15.305  -1.042
  384    HZ   PHE  56           HZ       PHE  56 -10.354  17.539  -1.962
  385    H    TYR  57           H        TYR  57  -7.967  13.820   4.577
  386    HA   TYR  57           HA       TYR  57  -5.281  13.083   5.625
  387   1HB   TYR  57          1HB       TYR  57  -8.076  12.821   6.824
  388   2HB   TYR  57          2HB       TYR  57  -6.696  11.886   7.379
  389    HD1  TYR  57           HD1      TYR  57  -7.817  15.428   6.833
  390    HD2  TYR  57           HD2      TYR  57  -5.217  12.748   8.978
  391    HE1  TYR  57           HE1      TYR  57  -6.889  17.346   8.050
  392    HE2  TYR  57           HE2      TYR  57  -4.230  14.691  10.188
  393    HH   TYR  57           HH       TYR  57  -5.423  18.006   9.786
  394    H    ARG  58           H        ARG  58  -4.751  10.956   5.368
  395    HA   ARG  58           HA       ARG  58  -6.356   9.336   3.449
  396   1HB   ARG  58          1HB       ARG  58  -4.536   7.657   3.895
  397   2HB   ARG  58          2HB       ARG  58  -4.107   9.076   2.941
  398   1HG   ARG  58          1HG       ARG  58  -2.924  10.097   4.802
  399   2HG   ARG  58          2HG       ARG  58  -3.333   8.722   5.850
  400   1HD   ARG  58          1HD       ARG  58  -1.733   8.622   3.251
  401   2HD   ARG  58          2HD       ARG  58  -1.055   8.523   4.871
  402    HE   ARG  58           HE       ARG  58  -2.868   6.514   4.968
  403   1HH1  ARG  58          1HH1      ARG  58  -0.499   7.155   2.391
  404   2HH1  ARG  58          2HH1      ARG  58  -0.636   5.553   1.730
  405   1HH2  ARG  58          1HH2      ARG  58  -3.085   4.523   4.052
  406   2HH2  ARG  58          2HH2      ARG  58  -2.001   3.986   2.771
  407    H    ASN  59           H        ASN  59  -8.267   9.007   4.663
  408    HA   ASN  59           HA       ASN  59  -8.429   8.576   7.373
  409   1HB   ASN  59          1HB       ASN  59 -10.349   8.826   5.833
  410   2HB   ASN  59          2HB       ASN  59 -10.116   7.158   5.277
  411   1HD2  ASN  59          2HD2      ASN  59 -12.215   6.488   6.010
  412   2HD2  ASN  59          1HD2      ASN  59 -12.617   6.449   7.721
  413    H    LYS  60           H        LYS  60  -7.543   6.227   4.910
  414    HA   LYS  60           HA       LYS  60  -5.962   4.788   6.792
  415   1HB   LYS  60          1HB       LYS  60  -7.041   2.507   6.257
  416   2HB   LYS  60          2HB       LYS  60  -7.706   3.517   7.525
  417   1HG   LYS  60          1HG       LYS  60  -9.548   4.231   6.303
  418   2HG   LYS  60          2HG       LYS  60  -8.967   3.644   4.752
  419   1HD   LYS  60          1HD       LYS  60  -9.507   1.745   7.079
  420   2HD   LYS  60          2HD       LYS  60 -10.812   2.357   6.070
  421   1HE   LYS  60          1HE       LYS  60 -10.203   0.211   5.226
  422   2HE   LYS  60          2HE       LYS  60  -9.737   1.425   4.030
  423   1HZ   LYS  60          1HZ       LYS  60  -7.931   0.145   5.968
  424   2HZ   LYS  60          2HZ       LYS  60  -8.079  -0.271   4.382
  425   3HZ   LYS  60          3HZ       LYS  60  -7.485   1.207   4.789
  426    H    ASP  61           H        ASP  61  -7.241   3.072   4.002
  427    HA   ASP  61           HA       ASP  61  -4.570   3.018   2.823
  428   1HB   ASP  61          1HB       ASP  61  -5.927   1.009   2.809
  429   2HB   ASP  61          2HB       ASP  61  -7.235   1.844   1.950
  430    H    ASP  62           H        ASP  62  -4.569   5.435   2.634
  431    HA   ASP  62           HA       ASP  62  -4.956   7.444   1.614
  432   1HB   ASP  62          1HB       ASP  62  -4.397   5.630  -0.749
  433   2HB   ASP  62          2HB       ASP  62  -4.588   7.372  -0.922
  434    H    LYS  63           H        LYS  63  -7.319   6.253   2.406
  435    HA   LYS  63           HA       LYS  63  -9.337   7.030   0.396
  436   1HB   LYS  63          1HB       LYS  63  -9.538   6.295   3.334
  437   2HB   LYS  63          2HB       LYS  63 -10.920   6.581   2.263
  438   1HG   LYS  63          1HG       LYS  63  -8.801   4.408   1.863
  439   2HG   LYS  63          2HG       LYS  63 -10.350   4.158   2.669
  440   1HD   LYS  63          1HD       LYS  63 -11.601   4.585   0.678
  441   2HD   LYS  63          2HD       LYS  63 -10.181   5.131  -0.224
  442   1HE   LYS  63          1HE       LYS  63 -10.375   2.321   0.921
  443   2HE   LYS  63          2HE       LYS  63 -10.948   2.752  -0.697
  444   1HZ   LYS  63          1HZ       LYS  63  -8.184   3.201   0.205
  445   2HZ   LYS  63          2HZ       LYS  63  -8.693   1.913  -0.688
  446   3HZ   LYS  63          3HZ       LYS  63  -8.795   3.437  -1.298
  447    H    CYS  64           H        CYS  64  -8.386   9.019  -0.053
  448    HA   CYS  64           HA       CYS  64  -7.763  10.979   1.855
  449   1HB   CYS  64          1HB       CYS  64  -8.409  11.485  -1.079
  450   2HB   CYS  64          2HB       CYS  64  -7.508  12.509   0.022
  451    H    VAL  65           H        VAL  65  -9.264  11.726   3.293
  452    HA   VAL  65           HA       VAL  65 -11.466  13.358   2.189
  453    HB   VAL  65           HB       VAL  65 -13.027  12.482   3.911
  454   1HG1  VAL  65          1HG1      VAL  65 -13.180  11.744   1.541
  455   2HG1  VAL  65          2HG1      VAL  65 -12.195  10.319   1.944
  456   3HG1  VAL  65          3HG1      VAL  65 -13.783  10.543   2.696
  457   1HG2  VAL  65          1HG2      VAL  65 -11.393  11.367   5.438
  458   2HG2  VAL  65          2HG2      VAL  65 -12.639  10.231   4.888
  459   3HG2  VAL  65          3HG2      VAL  65 -11.035  10.187   4.163
  460    H    SER  66           H        SER  66 -12.029  15.129   3.702
  461    HA   SER  66           HA       SER  66  -9.677  15.997   5.111
  462   1HB   SER  66          1HB       SER  66 -11.310  17.912   5.674
  463   2HB   SER  66          2HB       SER  66 -10.930  17.623   3.970
  464    HG   SER  66           HG       SER  66 -13.224  17.839   4.450
  465    H    ALA  67           H        ALA  67  -9.710  16.804   7.330
  466    HA   ALA  67           HA       ALA  67 -10.236  14.929   9.305
  467   1HB   ALA  67          1HB       ALA  67 -10.193  17.968   9.526
  468   2HB   ALA  67          2HB       ALA  67 -10.083  16.838  10.889
  469   3HB   ALA  67          3HB       ALA  67  -8.809  16.857   9.669
  470    H    GLU  68           H        GLU  68 -12.347  17.378   7.955
  471    HA   GLU  68           HA       GLU  68 -14.644  17.385   9.478
  472   1HB   GLU  68          1HB       GLU  68 -14.513  17.110   6.446
  473   2HB   GLU  68          2HB       GLU  68 -15.832  17.804   7.390
  474   1HG   GLU  68          1HG       GLU  68 -14.375  19.658   8.125
  475   2HG   GLU  68          2HG       GLU  68 -13.002  18.999   7.228
  476    H    ASP  69           H        ASP  69 -13.654  14.862   7.093
  477    HA   ASP  69           HA       ASP  69 -16.041  13.250   7.500
  478   1HB   ASP  69          1HB       ASP  69 -14.699  13.168   5.406
  479   2HB   ASP  69          2HB       ASP  69 -13.342  12.462   6.309
  480    H    CYS  70           H        CYS  70 -12.620  13.071   8.507
  481    HA   CYS  70           HA       CYS  70 -12.604  10.701   9.967
  482   1HB   CYS  70          1HB       CYS  70 -10.592  12.032   9.490
  483   2HB   CYS  70          2HB       CYS  70 -11.170  13.303  10.571
  484    H    GLU  71           H        GLU  71 -13.515  13.952  11.144
  485    HA   GLU  71           HA       GLU  71 -14.097  13.340  13.821
  486   1HB   GLU  71          1HB       GLU  71 -15.381  15.329  11.904
  487   2HB   GLU  71          2HB       GLU  71 -15.746  15.267  13.634
  488   1HG   GLU  71          1HG       GLU  71 -13.396  15.686  14.205
  489   2HG   GLU  71          2HG       GLU  71 -12.957  15.673  12.497
  490    H    LEU  72           H        LEU  72 -16.160  12.906  10.927
  491    HA   LEU  72           HA       LEU  72 -18.488  12.107  12.530
  492   1HB   LEU  72          1HB       LEU  72 -17.953  11.930   9.536
  493   2HB   LEU  72          2HB       LEU  72 -19.498  11.614  10.327
  494    HG   LEU  72           HG       LEU  72 -18.042  14.302  10.388
  495   1HD1  LEU  72          1HD1      LEU  72 -18.751  13.698   8.109
  496   2HD1  LEU  72          2HD1      LEU  72 -20.398  13.380   8.695
  497   3HD1  LEU  72          3HD1      LEU  72 -19.729  15.026   8.754
  498   1HD2  LEU  72          1HD2      LEU  72 -20.855  13.495  11.254
  499   2HD2  LEU  72          2HD2      LEU  72 -19.545  14.070  12.313
  500   3HD2  LEU  72          3HD2      LEU  72 -20.264  15.164  11.129
  501    H    ASP  73           H        ASP  73 -16.267  10.497  10.234
  502    HA   ASP  73           HA       ASP  73 -17.183   7.811  10.946
  503   1HB   ASP  73          1HB       ASP  73 -16.366   8.361   8.646
  504   2HB   ASP  73          2HB       ASP  73 -14.791   8.818   9.315
  505    H    ASN  74           H        ASN  74 -16.997   8.140  13.186
  506    HA   ASN  74           HA       ASN  74 -14.433   7.255  14.269
  507   1HB   ASN  74          1HB       ASN  74 -14.258   8.983  15.794
  508   2HB   ASN  74          2HB       ASN  74 -14.873   9.900  14.424
  509   1HD2  ASN  74          2HD2      ASN  74 -17.507   9.968  14.414
  510   2HD2  ASN  74          1HD2      ASN  74 -18.218  10.211  15.999
  511    H    MET  75           H        MET  75 -15.226   7.177  16.764
  512    HA   MET  75           HA       MET  75 -16.894   4.829  16.832
  513   1HB   MET  75          1HB       MET  75 -14.824   5.249  18.205
  514   2HB   MET  75          2HB       MET  75 -15.705   6.470  19.125
  515   1HG   MET  75          1HG       MET  75 -15.556   4.311  20.270
  516   2HG   MET  75          2HG       MET  75 -17.229   4.798  20.000
  517   1HE   MET  75          1HE       MET  75 -14.304   2.597  18.508
  518   2HE   MET  75          2HE       MET  75 -15.209   1.532  17.405
  519   3HE   MET  75          3HE       MET  75 -15.072   3.260  17.039
  520    H    ASP  76           H        ASP  76 -17.283   8.171  17.996
  521    HA   ASP  76           HA       ASP  76 -20.160   8.083  17.864
  522   1HB   ASP  76          1HB       ASP  76 -20.106   6.961  19.990
  523   2HB   ASP  76          2HB       ASP  76 -18.810   7.991  20.605
  524    H    PHE  77           H        PHE  77 -17.826   9.757  19.996
  525    HA   PHE  77           HA       PHE  77 -17.652  12.025  18.166
  526   1HB   PHE  77          1HB       PHE  77 -19.361  12.778  19.797
  527   2HB   PHE  77          2HB       PHE  77 -18.299  12.329  21.127
  528    HD1  PHE  77           HD1      PHE  77 -18.710  14.654  18.243
  529    HD2  PHE  77           HD2      PHE  77 -16.367  13.710  21.741
  530    HE1  PHE  77           HE1      PHE  77 -17.417  16.748  17.951
  531    HE2  PHE  77           HE2      PHE  77 -15.046  15.773  21.412
  532    HZ   PHE  77           HZ       PHE  77 -15.583  17.312  19.528
  533    H    ILE  78           H        ILE  78 -15.586  13.014  18.480
  534    HA   ILE  78           HA       ILE  78 -13.705  10.926  19.111
  535    HB   ILE  78           HB       ILE  78 -12.541  13.525  18.277
  536   1HG1  ILE  78          1HG1      ILE  78 -13.228  12.871  15.848
  537   2HG1  ILE  78          2HG1      ILE  78 -14.682  12.210  16.579
  538   1HG2  ILE  78          1HG2      ILE  78 -11.387  11.318  18.440
  539   2HG2  ILE  78          2HG2      ILE  78 -12.473  10.698  17.185
  540   3HG2  ILE  78          3HG2      ILE  78 -11.342  12.011  16.803
  541   1HD1  ILE  78          1HD1      ILE  78 -14.941  14.592  17.672
  542   2HD1  ILE  78          2HD1      ILE  78 -13.610  15.072  16.617
  543   3HD1  ILE  78          3HD1      ILE  78 -15.129  14.494  15.912
  544    H    TYR  79           H        TYR  79 -14.214  10.825  21.377
  545    HA   TYR  79           HA       TYR  79 -13.237  12.878  23.174
  546   1HB   TYR  79          1HB       TYR  79 -13.595   9.928  23.760
  547   2HB   TYR  79          2HB       TYR  79 -13.614  11.240  24.918
  548    HD1  TYR  79           HD1      TYR  79 -15.489  13.093  24.544
  549    HD2  TYR  79           HD2      TYR  79 -15.676   9.048  23.058
  550    HE1  TYR  79           HE1      TYR  79 -17.959  13.266  24.342
  551    HE2  TYR  79           HE2      TYR  79 -18.120   9.222  22.872
  552    HH   TYR  79           HH       TYR  79 -19.926  10.677  22.873
  553    HA   PRO  80           HA       PRO  80  -8.853  11.802  23.430
  554   1HB   PRO  80          1HB       PRO  80  -9.401  11.306  26.362
  555   2HB   PRO  80          2HB       PRO  80  -8.013  12.157  25.620
  556   1HG   PRO  80          1HG       PRO  80 -10.043  13.605  26.669
  557   2HG   PRO  80          2HG       PRO  80  -9.411  14.042  25.052
  558   1HD   PRO  80          1HD       PRO  80 -11.871  12.416  25.717
  559   2HD   PRO  80          2HD       PRO  80 -11.692  13.754  24.544
  560    H    GLY  81           H        GLY  81  -7.634   9.876  23.301
  561   1HA   GLY  81          1HA       GLY  81  -7.431   7.687  22.732
  562   2HA   GLY  81          2HA       GLY  81  -8.004   7.388  24.382
  563    H    THR  82           H        THR  82  -9.799   8.797  21.618
  564    HA   THR  82           HA       THR  82 -11.603   8.259  20.502
  565    HB   THR  82           HB       THR  82 -11.114   5.341  21.224
  566    HG1  THR  82           HG1      THR  82  -9.688   7.161  19.750
  567   1HG2  THR  82          1HG2      THR  82 -12.462   6.683  18.840
  568   2HG2  THR  82          2HG2      THR  82 -12.141   4.946  19.016
  569   3HG2  THR  82          3HG2      THR  82 -13.274   5.753  20.118
  570    H    ARG  83           H        ARG  83 -11.688   6.264  23.496
  571    HA   ARG  83           HA       ARG  83 -14.032   7.741  24.433
  572   1HB   ARG  83          1HB       ARG  83 -15.352   5.722  24.882
  573   2HB   ARG  83          2HB       ARG  83 -15.194   6.040  23.157
  574   1HG   ARG  83          1HG       ARG  83 -13.899   4.169  22.757
  575   2HG   ARG  83          2HG       ARG  83 -13.148   4.184  24.356
  576   1HD   ARG  83          1HD       ARG  83 -14.645   2.252  24.195
  577   2HD   ARG  83          2HD       ARG  83 -15.174   3.392  25.421
  578    HE   ARG  83           HE       ARG  83 -17.086   3.866  24.258
  579   1HH1  ARG  83          1HH1      ARG  83 -14.920   2.043  22.139
  580   2HH1  ARG  83          2HH1      ARG  83 -16.101   1.870  20.861
  581   1HH2  ARG  83          1HH2      ARG  83 -18.665   3.519  22.656
  582   2HH2  ARG  83          2HH2      ARG  83 -18.281   2.626  21.209
  583    H    ASN  84           H        ASN  84 -11.414   7.860  25.354
  584    HA   ASN  84           HA       ASN  84 -10.909   6.026  27.474
  585   1HB   ASN  84          1HB       ASN  84  -9.108   7.366  26.662
  586   2HB   ASN  84          2HB       ASN  84  -9.934   8.868  27.078
  587   1HD2  ASN  84          2HD2      ASN  84  -8.647   5.850  28.591
  588   2HD2  ASN  84          1HD2      ASN  84  -8.273   6.635  30.115
  589    HA   PRO  85           HA       PRO  85 -13.319   8.829  30.487
  590   1HB   PRO  85          1HB       PRO  85 -14.876  10.884  29.597
  591   2HB   PRO  85          2HB       PRO  85 -13.141  11.089  29.977
  592   1HG   PRO  85          1HG       PRO  85 -14.379  10.583  27.253
  593   2HG   PRO  85          2HG       PRO  85 -13.224  11.872  27.706
  594   1HD   PRO  85          1HD       PRO  85 -12.372   9.586  26.557
  595   2HD   PRO  85          2HD       PRO  85 -11.442  10.318  27.898
  Start of MODEL   17
    1   1H    LYS   1          1H        LYS   1   1.836   3.765  -3.861
    2   2H    LYS   1          2H        LYS   1   0.251   3.281  -3.896
    3   3H    LYS   1          3H        LYS   1   1.338   2.539  -2.894
    4    HA   LYS   1           HA       LYS   1   2.569   1.661  -4.678
    5   1HB   LYS   1          1HB       LYS   1  -0.392   1.062  -5.063
    6   2HB   LYS   1          2HB       LYS   1   0.982   0.061  -5.560
    7   1HG   LYS   1          1HG       LYS   1   1.657  -0.083  -3.111
    8   2HG   LYS   1          2HG       LYS   1   0.175   0.783  -2.711
    9   1HD   LYS   1          1HD       LYS   1  -0.232  -1.555  -2.367
   10   2HD   LYS   1          2HD       LYS   1  -1.209  -0.987  -3.720
   11   1HE   LYS   1          1HE       LYS   1  -0.216  -3.227  -4.117
   12   2HE   LYS   1          2HE       LYS   1   0.312  -2.061  -5.330
   13   1HZ   LYS   1          1HZ       LYS   1   1.856  -2.879  -2.963
   14   2HZ   LYS   1          2HZ       LYS   1   2.105  -3.407  -4.505
   15   3HZ   LYS   1          3HZ       LYS   1   2.361  -1.825  -4.126
   16    H    ALA   2           H        ALA   2   0.346   4.160  -5.671
   17    HA   ALA   2           HA       ALA   2   0.441   3.478  -8.529
   18   1HB   ALA   2          1HB       ALA   2  -1.601   4.371  -7.479
   19   2HB   ALA   2          2HB       ALA   2  -0.747   5.871  -7.069
   20   3HB   ALA   2          3HB       ALA   2  -1.006   5.423  -8.768
   21    H    THR   3           H        THR   3   2.907   3.509  -8.189
   22    HA   THR   3           HA       THR   3   4.427   5.693  -7.573
   23    HB   THR   3           HB       THR   3   6.165   4.599  -9.115
   24    HG1  THR   3           HG1      THR   3   4.567   3.734 -10.540
   25   1HG2  THR   3          1HG2      THR   3   5.936   4.024  -6.740
   26   2HG2  THR   3          2HG2      THR   3   4.698   2.806  -7.119
   27   3HG2  THR   3          3HG2      THR   3   6.358   2.594  -7.706
   28    H    MET   4           H        MET   4   4.623   7.668  -8.423
   29    HA   MET   4           HA       MET   4   3.915   9.444  -9.647
   30   1HB   MET   4          1HB       MET   4   6.253   8.715 -10.283
   31   2HB   MET   4          2HB       MET   4   5.587   8.100 -11.800
   32   1HG   MET   4          1HG       MET   4   4.844  10.345 -12.419
   33   2HG   MET   4          2HG       MET   4   5.271  10.983 -10.831
   34   1HE   MET   4          1HE       MET   4   7.683  11.532 -10.034
   35   2HE   MET   4          2HE       MET   4   8.202   9.840 -10.248
   36   3HE   MET   4          3HE       MET   4   9.150  11.155 -10.966
   37    H    GLN   5           H        GLN   5   1.882   7.576  -9.681
   38    HA   GLN   5           HA       GLN   5   0.476   8.271 -12.240
   39   1HB   GLN   5          1HB       GLN   5   0.372   5.754 -10.555
   40   2HB   GLN   5          2HB       GLN   5  -0.888   6.169 -11.720
   41   1HG   GLN   5          1HG       GLN   5   0.522   5.903 -13.569
   42   2HG   GLN   5          2HG       GLN   5   2.003   6.108 -12.631
   43   1HE2  GLN   5          2HE2      GLN   5   2.650   4.435 -11.141
   44   2HE2  GLN   5          1HE2      GLN   5   2.164   2.759 -11.423
   45    H    CYS   6           H        CYS   6   0.303   7.763  -8.699
   46    HA   CYS   6           HA       CYS   6  -0.691   9.059  -7.159
   47   1HB   CYS   6          1HB       CYS   6  -0.693  10.896  -9.132
   48   2HB   CYS   6          2HB       CYS   6  -2.445  10.659  -8.962
   49    H    GLY   7           H        GLY   7  -3.183   9.789  -6.510
   50   1HA   GLY   7          1HA       GLY   7  -4.992   7.580  -7.242
   51   2HA   GLY   7          2HA       GLY   7  -4.373   7.664  -5.583
   52    H    GLU   8           H        GLU   8  -6.476   7.949  -4.929
   53    HA   GLU   8           HA       GLU   8  -8.372   9.781  -6.022
   54   1HB   GLU   8          1HB       GLU   8  -8.377   8.321  -3.351
   55   2HB   GLU   8          2HB       GLU   8  -9.754   9.139  -4.097
   56   1HG   GLU   8          1HG       GLU   8  -9.590   7.581  -6.051
   57   2HG   GLU   8          2HG       GLU   8  -8.270   6.720  -5.240
   58    H    ASN   9           H        ASN   9  -7.568  11.868  -5.990
   59    HA   ASN   9           HA       ASN   9  -7.476  13.949  -5.195
   60   1HB   ASN   9          1HB       ASN   9  -9.597  13.117  -4.037
   61   2HB   ASN   9          2HB       ASN   9  -8.650  12.966  -2.555
   62   1HD2  ASN   9          2HD2      ASN   9  -7.366  15.055  -2.003
   63   2HD2  ASN   9          1HD2      ASN   9  -8.372  16.510  -2.071
   64    H    GLU  10           H        GLU  10  -5.191  12.683  -5.254
   65    HA   GLU  10           HA       GLU  10  -3.669  13.551  -2.845
   66   1HB   GLU  10          1HB       GLU  10  -2.943  11.190  -4.629
   67   2HB   GLU  10          2HB       GLU  10  -2.244  11.667  -3.069
   68   1HG   GLU  10          1HG       GLU  10  -4.571  11.263  -2.084
   69   2HG   GLU  10          2HG       GLU  10  -4.951  10.432  -3.591
   70    H    LYS  11           H        LYS  11  -1.320  13.958  -3.427
   71    HA   LYS  11           HA       LYS  11  -0.897  14.891  -6.199
   72   1HB   LYS  11          1HB       LYS  11  -1.786  16.789  -4.899
   73   2HB   LYS  11          2HB       LYS  11  -0.534  16.547  -3.671
   74   1HG   LYS  11          1HG       LYS  11   0.053  18.422  -5.046
   75   2HG   LYS  11          2HG       LYS  11   1.215  17.138  -5.363
   76   1HD   LYS  11          1HD       LYS  11  -0.068  16.569  -7.476
   77   2HD   LYS  11          2HD       LYS  11  -1.222  17.853  -7.083
   78   1HE   LYS  11          1HE       LYS  11   0.610  19.532  -7.209
   79   2HE   LYS  11          2HE       LYS  11   1.771  18.241  -7.577
   80   1HZ   LYS  11          1HZ       LYS  11  -0.549  18.977  -9.219
   81   2HZ   LYS  11          2HZ       LYS  11   1.023  19.352  -9.539
   82   3HZ   LYS  11          3HZ       LYS  11   0.532  17.779  -9.565
   83    H    TYR  12           H        TYR  12   1.335  15.061  -6.732
   84    HA   TYR  12           HA       TYR  12   2.705  12.805  -6.014
   85   1HB   TYR  12          1HB       TYR  12   3.006  14.049  -8.119
   86   2HB   TYR  12          2HB       TYR  12   3.975  15.244  -7.251
   87    HD1  TYR  12           HD1      TYR  12   3.786  11.705  -8.386
   88    HD2  TYR  12           HD2      TYR  12   6.251  14.667  -6.454
   89    HE1  TYR  12           HE1      TYR  12   5.564  10.012  -8.034
   90    HE2  TYR  12           HE2      TYR  12   7.990  12.956  -6.060
   91    HH   TYR  12           HH       TYR  12   8.429  10.699  -6.048
   92    H    ASP  13           H        ASP  13   4.185  12.120  -4.668
   93    HA   ASP  13           HA       ASP  13   6.148  13.818  -3.474
   94   1HB   ASP  13          1HB       ASP  13   4.349  14.323  -1.842
   95   2HB   ASP  13          2HB       ASP  13   4.023  12.589  -1.657
   96    H    SER  14           H        SER  14   7.949  12.440  -3.224
   97    HA   SER  14           HA       SER  14   7.579   9.660  -3.837
   98   1HB   SER  14          1HB       SER  14  10.105  11.009  -2.825
   99   2HB   SER  14          2HB       SER  14   9.971   9.448  -3.667
  100    HG   SER  14           HG       SER  14  10.558  11.377  -4.970
  101    H    CYS  15           H        CYS  15   5.973   9.616  -1.876
  102    HA   CYS  15           HA       CYS  15   7.169   9.890   0.701
  103   1HB   CYS  15          1HB       CYS  15   5.187  10.186   1.537
  104   2HB   CYS  15          2HB       CYS  15   4.756  10.442  -0.159
  105    H    GLY  16           H        GLY  16   6.578   6.906  -1.186
  106   1HA   GLY  16          1HA       GLY  16   7.597   4.907  -0.715
  107   2HA   GLY  16          2HA       GLY  16   8.342   5.610   0.707
  108    H    SER  17           H        SER  17   6.712   6.094   2.447
  109    HA   SER  17           HA       SER  17   5.529   3.471   3.173
  110   1HB   SER  17          1HB       SER  17   6.727   5.779   4.766
  111   2HB   SER  17          2HB       SER  17   6.144   4.281   5.487
  112    HG   SER  17           HG       SER  17   8.438   4.293   5.003
  113    H    LYS  18           H        LYS  18   4.451   6.702   2.570
  114    HA   LYS  18           HA       LYS  18   2.494   7.803   2.970
  115   1HB   LYS  18          1HB       LYS  18   1.523   5.183   3.045
  116   2HB   LYS  18          2HB       LYS  18   0.979   5.923   4.573
  117   1HG   LYS  18          1HG       LYS  18  -0.729   6.293   3.057
  118   2HG   LYS  18          2HG       LYS  18   0.114   7.847   3.228
  119   1HD   LYS  18          1HD       LYS  18   1.217   7.501   1.065
  120   2HD   LYS  18          2HD       LYS  18   0.449   5.905   0.891
  121   1HE   LYS  18          1HE       LYS  18  -1.102   8.523   1.136
  122   2HE   LYS  18          2HE       LYS  18  -0.546   7.874  -0.408
  123   1HZ   LYS  18          1HZ       LYS  18  -2.254   6.373   1.431
  124   2HZ   LYS  18          2HZ       LYS  18  -2.802   7.246   0.143
  125   3HZ   LYS  18          3HZ       LYS  18  -1.811   5.947  -0.092
  126    H    GLU  19           H        GLU  19   3.635   5.917   5.700
  127    HA   GLU  19           HA       GLU  19   4.085   6.292   7.835
  128   1HB   GLU  19          1HB       GLU  19   4.512   9.150   6.805
  129   2HB   GLU  19          2HB       GLU  19   4.919   8.615   8.442
  130   1HG   GLU  19          1HG       GLU  19   6.399   6.828   7.358
  131   2HG   GLU  19          2HG       GLU  19   6.107   7.669   5.817
  132    H    CYS  20           H        CYS  20   3.347   7.538   9.873
  133    HA   CYS  20           HA       CYS  20   0.452   8.204   9.604
  134   1HB   CYS  20          1HB       CYS  20   2.250   7.497  11.868
  135   2HB   CYS  20          2HB       CYS  20   0.933   8.634  12.183
  136    H    ASP  21           H        ASP  21   1.495   9.734   7.975
  137    HA   ASP  21           HA       ASP  21   2.257  12.366   9.087
  138   1HB   ASP  21          1HB       ASP  21   3.427  11.559   7.094
  139   2HB   ASP  21          2HB       ASP  21   1.910  11.293   6.240
  140    H    LYS  22           H        LYS  22   0.178  12.629   6.354
  141    HA   LYS  22           HA       LYS  22  -1.929  13.691   8.068
  142   1HB   LYS  22          1HB       LYS  22  -2.858  14.604   6.085
  143   2HB   LYS  22          2HB       LYS  22  -1.120  14.894   6.206
  144   1HG   LYS  22          1HG       LYS  22  -0.969  12.763   4.598
  145   2HG   LYS  22          2HG       LYS  22  -2.648  13.192   4.256
  146   1HD   LYS  22          1HD       LYS  22  -0.139  14.900   3.911
  147   2HD   LYS  22          2HD       LYS  22  -1.202  14.299   2.634
  148   1HE   LYS  22          1HE       LYS  22  -3.040  15.786   3.529
  149   2HE   LYS  22          2HE       LYS  22  -1.898  16.437   4.713
  150   1HZ   LYS  22          1HZ       LYS  22  -0.516  17.143   2.892
  151   2HZ   LYS  22          2HZ       LYS  22  -1.626  16.577   1.808
  152   3HZ   LYS  22          3HZ       LYS  22  -2.015  17.816   2.822
  153    H    LYS  23           H        LYS  23  -1.884  11.265   8.871
  154    HA   LYS  23           HA       LYS  23  -3.851   9.557   7.534
  155   1HB   LYS  23          1HB       LYS  23  -3.725   8.117   9.358
  156   2HB   LYS  23          2HB       LYS  23  -2.082   8.640   9.020
  157   1HG   LYS  23          1HG       LYS  23  -3.854   9.581  11.350
  158   2HG   LYS  23          2HG       LYS  23  -2.503   8.449  11.400
  159   1HD   LYS  23          1HD       LYS  23  -1.023  10.291  10.534
  160   2HD   LYS  23          2HD       LYS  23  -2.350  11.437  10.863
  161   1HE   LYS  23          1HE       LYS  23  -2.290  10.833  13.243
  162   2HE   LYS  23          2HE       LYS  23  -1.086   9.571  12.903
  163   1HZ   LYS  23          1HZ       LYS  23   0.399  11.280  12.133
  164   2HZ   LYS  23          2HZ       LYS  23  -0.666  12.447  12.612
  165   3HZ   LYS  23          3HZ       LYS  23   0.007  11.417  13.724
  166    H    CYS  24           H        CYS  24  -6.063   9.156   8.853
  167    HA   CYS  24           HA       CYS  24  -7.273  11.699   9.411
  168   1HB   CYS  24          1HB       CYS  24  -8.192   8.924   9.125
  169   2HB   CYS  24          2HB       CYS  24  -9.097   9.799  10.327
  170    H    LYS  25           H        LYS  25  -5.403  12.036  11.090
  171    HA   LYS  25           HA       LYS  25  -4.961  12.852  13.111
  172   1HB   LYS  25          1HB       LYS  25  -7.902  12.512  13.793
  173   2HB   LYS  25          2HB       LYS  25  -6.751  13.672  14.456
  174   1HG   LYS  25          1HG       LYS  25  -7.904  13.606  11.630
  175   2HG   LYS  25          2HG       LYS  25  -8.220  14.773  12.914
  176   1HD   LYS  25          1HD       LYS  25  -5.806  15.483  12.831
  177   2HD   LYS  25          2HD       LYS  25  -5.535  14.337  11.510
  178   1HE   LYS  25          1HE       LYS  25  -5.829  16.555  10.592
  179   2HE   LYS  25          2HE       LYS  25  -7.169  15.508  10.088
  180   1HZ   LYS  25          1HZ       LYS  25  -7.256  17.467  12.280
  181   2HZ   LYS  25          2HZ       LYS  25  -7.895  17.679  10.776
  182   3HZ   LYS  25          3HZ       LYS  25  -8.513  16.527  11.776
  183    H    TYR  26           H        TYR  26  -7.326  10.293  13.856
  184    HA   TYR  26           HA       TYR  26  -5.527   9.221  16.000
  185   1HB   TYR  26          1HB       TYR  26  -7.869   8.602  17.033
  186   2HB   TYR  26          2HB       TYR  26  -7.138  10.171  17.254
  187    HD1  TYR  26           HD1      TYR  26  -9.593   8.501  14.925
  188    HD2  TYR  26           HD2      TYR  26  -8.333  12.116  16.919
  189    HE1  TYR  26           HE1      TYR  26 -11.634   9.657  14.141
  190    HE2  TYR  26           HE2      TYR  26 -10.392  13.241  16.183
  191    HH   TYR  26           HH       TYR  26 -12.285  13.058  14.818
  192    H    ASP  27           H        ASP  27  -4.977   8.284  13.725
  193    HA   ASP  27           HA       ASP  27  -6.490   6.128  12.588
  194   1HB   ASP  27          1HB       ASP  27  -4.634   7.140  11.441
  195   2HB   ASP  27          2HB       ASP  27  -3.521   6.657  12.743
  196    H    GLY  28           H        GLY  28  -7.391   4.801  14.270
  197   1HA   GLY  28          1HA       GLY  28  -7.343   2.911  15.543
  198   2HA   GLY  28          2HA       GLY  28  -5.571   2.797  15.376
  199    H    VAL  29           H        VAL  29  -7.495   5.576  16.379
  200    HA   VAL  29           HA       VAL  29  -7.856   6.643  18.338
  201    HB   VAL  29           HB       VAL  29  -6.358   4.488  19.873
  202   1HG1  VAL  29          1HG1      VAL  29  -8.389   6.577  20.752
  203   2HG1  VAL  29          2HG1      VAL  29  -7.684   5.311  21.775
  204   3HG1  VAL  29          3HG1      VAL  29  -6.654   6.591  21.133
  205   1HG2  VAL  29          1HG2      VAL  29  -8.337   3.490  18.653
  206   2HG2  VAL  29          2HG2      VAL  29  -8.501   3.494  20.408
  207   3HG2  VAL  29          3HG2      VAL  29  -9.363   4.703  19.450
  208    H    GLU  30           H        GLU  30  -6.822   8.301  19.259
  209    HA   GLU  30           HA       GLU  30  -4.121   8.976  18.498
  210   1HB   GLU  30          1HB       GLU  30  -4.465  10.977  19.942
  211   2HB   GLU  30          2HB       GLU  30  -5.605  10.809  18.639
  212   1HG   GLU  30          1HG       GLU  30  -6.319   9.774  21.413
  213   2HG   GLU  30          2HG       GLU  30  -6.400  11.495  21.044
  214    H    GLU  31           H        GLU  31  -3.812   6.571  19.788
  215    HA   GLU  31           HA       GLU  31  -2.752   7.002  22.502
  216   1HB   GLU  31          1HB       GLU  31  -2.546   4.698  20.503
  217   2HB   GLU  31          2HB       GLU  31  -1.846   4.696  22.129
  218   1HG   GLU  31          1HG       GLU  31  -4.066   4.918  23.143
  219   2HG   GLU  31          2HG       GLU  31  -4.815   5.076  21.549
  220    H    GLU  32           H        GLU  32  -1.631   8.977  21.601
  221    HA   GLU  32           HA       GLU  32   0.190  10.119  20.899
  222   1HB   GLU  32          1HB       GLU  32   1.769   7.524  21.169
  223   2HB   GLU  32          2HB       GLU  32   2.398   9.168  21.196
  224   1HG   GLU  32          1HG       GLU  32   0.599   7.890  23.307
  225   2HG   GLU  32          2HG       GLU  32   2.310   8.285  23.461
  226    H    ASP  33           H        ASP  33  -1.526   9.206  18.937
  227    HA   ASP  33           HA       ASP  33  -0.108   7.979  16.753
  228   1HB   ASP  33          1HB       ASP  33  -2.579   7.865  17.103
  229   2HB   ASP  33          2HB       ASP  33  -2.691   9.585  16.669
  230    H    ASP  34           H        ASP  34  -0.445  11.282  17.851
  231    HA   ASP  34           HA       ASP  34  -0.078  12.693  15.433
  232   1HB   ASP  34          1HB       ASP  34  -0.816  13.780  17.480
  233   2HB   ASP  34          2HB       ASP  34   0.726  13.430  18.276
  234    H    GLU  35           H        GLU  35   2.345  11.611  17.822
  235    HA   GLU  35           HA       GLU  35   4.599  12.588  16.238
  236   1HB   GLU  35          1HB       GLU  35   5.940  11.437  18.029
  237   2HB   GLU  35          2HB       GLU  35   4.942  12.796  18.533
  238   1HG   GLU  35          1HG       GLU  35   3.862   9.972  18.821
  239   2HG   GLU  35          2HG       GLU  35   5.034  10.605  19.974
  240    H    GLU  36           H        GLU  36   3.662  11.370  14.420
  241    HA   GLU  36           HA       GLU  36   3.123   9.294  13.417
  242   1HB   GLU  36          1HB       GLU  36   5.963   9.820  12.533
  243   2HB   GLU  36          2HB       GLU  36   4.539   9.254  11.637
  244   1HG   GLU  36          1HG       GLU  36   3.563  11.614  12.103
  245   2HG   GLU  36          2HG       GLU  36   5.192  12.049  12.622
  246    HA   PRO  37           HA       PRO  37   5.302   5.979  15.763
  247   1HB   PRO  37          1HB       PRO  37   2.531   4.800  15.423
  248   2HB   PRO  37          2HB       PRO  37   3.640   4.674  16.822
  249   1HG   PRO  37          1HG       PRO  37   1.577   6.403  16.896
  250   2HG   PRO  37          2HG       PRO  37   3.194   6.996  17.379
  251   1HD   PRO  37          1HD       PRO  37   1.869   7.274  14.652
  252   2HD   PRO  37          2HD       PRO  37   2.578   8.538  15.694
  253    H    ASN  38           H        ASN  38   6.238   6.142  13.391
  254    HA   ASN  38           HA       ASN  38   5.134   4.440  11.306
  255   1HB   ASN  38          1HB       ASN  38   7.780   5.914  11.514
  256   2HB   ASN  38          2HB       ASN  38   7.111   5.184  10.043
  257   1HD2  ASN  38          2HD2      ASN  38   7.793   7.988  10.303
  258   2HD2  ASN  38          1HD2      ASN  38   6.312   8.913  10.186
  259    H    VAL  39           H        VAL  39   5.378   2.803  13.348
  260    HA   VAL  39           HA       VAL  39   7.082   0.726  12.200
  261    HB   VAL  39           HB       VAL  39   7.138   1.303  15.200
  262   1HG1  VAL  39          1HG1      VAL  39   8.189  -1.076  13.608
  263   2HG1  VAL  39          2HG1      VAL  39   8.511  -0.751  15.324
  264   3HG1  VAL  39          3HG1      VAL  39   6.867  -1.125  14.796
  265   1HG2  VAL  39          1HG2      VAL  39   9.314   1.205  13.084
  266   2HG2  VAL  39          2HG2      VAL  39   8.745   2.647  13.954
  267   3HG2  VAL  39          3HG2      VAL  39   9.573   1.358  14.833
  268    HA   PRO  40           HA       PRO  40   3.043  -1.080  14.025
  269   1HB   PRO  40          1HB       PRO  40   1.320   0.527  15.444
  270   2HB   PRO  40          2HB       PRO  40   2.576  -0.491  16.199
  271   1HG   PRO  40          1HG       PRO  40   2.755   2.444  15.504
  272   2HG   PRO  40          2HG       PRO  40   3.176   1.665  17.056
  273   1HD   PRO  40          1HD       PRO  40   5.103   2.236  15.288
  274   2HD   PRO  40          2HD       PRO  40   5.117   0.661  16.121
  275    H    CYS  41           H        CYS  41   3.041   2.473  13.294
  276    HA   CYS  41           HA       CYS  41   0.927   2.187  11.266
  277   1HB   CYS  41          1HB       CYS  41   1.375   4.239  12.653
  278   2HB   CYS  41          2HB       CYS  41   2.822   4.536  11.702
  279    H    LEU  42           H        LEU  42   2.270   0.252  10.619
  280    HA   LEU  42           HA       LEU  42   4.814   0.474   9.541
  281   1HB   LEU  42          1HB       LEU  42   3.654  -1.614  10.295
  282   2HB   LEU  42          2HB       LEU  42   2.623  -1.537   8.863
  283    HG   LEU  42           HG       LEU  42   4.622  -1.841   7.409
  284   1HD1  LEU  42          1HD1      LEU  42   6.105  -2.073  10.074
  285   2HD1  LEU  42          2HD1      LEU  42   6.767  -2.585   8.508
  286   3HD1  LEU  42          3HD1      LEU  42   6.417  -0.880   8.793
  287   1HD2  LEU  42          1HD2      LEU  42   3.303  -3.778   8.182
  288   2HD2  LEU  42          2HD2      LEU  42   5.016  -4.196   7.995
  289   3HD2  LEU  42          3HD2      LEU  42   4.343  -3.920   9.616
  290    H    VAL  43           H        VAL  43   5.593   0.956   7.613
  291    HA   VAL  43           HA       VAL  43   4.812   2.530   5.741
  292    HB   VAL  43           HB       VAL  43   6.312   1.591   4.089
  293   1HG1  VAL  43          1HG1      VAL  43   7.197   2.498   6.363
  294   2HG1  VAL  43          2HG1      VAL  43   7.465   0.807   6.804
  295   3HG1  VAL  43          3HG1      VAL  43   8.293   1.493   5.401
  296   1HG2  VAL  43          1HG2      VAL  43   6.109  -1.017   5.655
  297   2HG2  VAL  43          2HG2      VAL  43   5.813  -0.753   3.919
  298   3HG2  VAL  43          3HG2      VAL  43   7.444  -0.632   4.553
  299    H    ARG  44           H        ARG  44   2.827   2.866   4.985
  300    HA   ARG  44           HA       ARG  44   1.100   0.637   4.217
  301   1HB   ARG  44          1HB       ARG  44   0.634   2.837   5.590
  302   2HB   ARG  44          2HB       ARG  44   0.335   3.557   4.012
  303   1HG   ARG  44          1HG       ARG  44  -1.419   1.907   3.556
  304   2HG   ARG  44          2HG       ARG  44  -1.053   1.052   5.067
  305   1HD   ARG  44          1HD       ARG  44  -2.083   3.917   4.877
  306   2HD   ARG  44          2HD       ARG  44  -3.042   2.488   5.312
  307    HE   ARG  44           HE       ARG  44  -0.770   2.659   7.019
  308   1HH1  ARG  44          1HH1      ARG  44  -4.004   4.125   6.559
  309   2HH1  ARG  44          2HH1      ARG  44  -4.072   4.698   8.198
  310   1HH2  ARG  44          1HH2      ARG  44  -0.889   3.460   9.125
  311   2HH2  ARG  44          2HH2      ARG  44  -2.317   4.260   9.701
  312    H    VAL  45           H        VAL  45   3.107   0.466   2.653
  313    HA   VAL  45           HA       VAL  45   4.224   1.069   0.677
  314    HB   VAL  45           HB       VAL  45   3.155  -0.457  -1.006
  315   1HG1  VAL  45          1HG1      VAL  45   4.810  -1.166   0.703
  316   2HG1  VAL  45          2HG1      VAL  45   3.497  -1.501   1.844
  317   3HG1  VAL  45          3HG1      VAL  45   3.632  -2.443   0.346
  318   1HG2  VAL  45          1HG2      VAL  45   0.752  -0.132  -0.299
  319   2HG2  VAL  45          2HG2      VAL  45   1.267  -1.828  -0.322
  320   3HG2  VAL  45          3HG2      VAL  45   1.120  -0.970   1.219
  321    H    CYS  46           H        CYS  46   3.925   3.361   0.710
  322    HA   CYS  46           HA       CYS  46   1.952   4.583  -1.121
  323   1HB   CYS  46          1HB       CYS  46   2.699   5.796   0.808
  324   2HB   CYS  46          2HB       CYS  46   4.371   5.611   0.379
  325    H    HIS  47           H        HIS  47   5.423   3.822  -0.968
  326    HA   HIS  47           HA       HIS  47   7.113   3.928  -2.475
  327   1HB   HIS  47          1HB       HIS  47   4.950   3.110  -4.436
  328   2HB   HIS  47          2HB       HIS  47   6.687   3.164  -4.783
  329    HD1  HIS  47           HD1      HIS  47   8.302   1.786  -3.076
  330    HD2  HIS  47           HD2      HIS  47   4.173   1.176  -2.718
  331    HE1  HIS  47           HE1      HIS  47   7.998   0.130  -1.231
  332    H    GLN  48           H        GLN  48   7.555   4.967  -4.813
  333    HA   GLN  48           HA       GLN  48   7.595   7.720  -4.339
  334   1HB   GLN  48          1HB       GLN  48   8.329   6.182  -6.851
  335   2HB   GLN  48          2HB       GLN  48   8.829   7.831  -6.432
  336   1HG   GLN  48          1HG       GLN  48   9.887   6.878  -4.304
  337   2HG   GLN  48          2HG       GLN  48   9.512   5.254  -4.862
  338   1HE2  GLN  48          2HE2      GLN  48  10.986   8.238  -6.353
  339   2HE2  GLN  48          1HE2      GLN  48  12.340   7.353  -7.030
  340    H    ASP  49           H        ASP  49   5.227   7.823  -4.045
  341    HA   ASP  49           HA       ASP  49   3.584   8.053  -6.533
  342   1HB   ASP  49          1HB       ASP  49   3.331   6.014  -5.204
  343   2HB   ASP  49          2HB       ASP  49   2.983   6.959  -3.758
  344    H    CYS  50           H        CYS  50   1.951   8.727  -3.561
  345    HA   CYS  50           HA       CYS  50   2.119  11.629  -3.885
  346   1HB   CYS  50          1HB       CYS  50  -0.309   9.916  -4.654
  347   2HB   CYS  50          2HB       CYS  50  -0.413  11.616  -4.206
  348    H    VAL  51           H        VAL  51   0.647  12.686  -2.345
  349    HA   VAL  51           HA       VAL  51  -0.351  11.003  -0.117
  350    HB   VAL  51           HB       VAL  51   0.409  12.695   1.528
  351   1HG1  VAL  51          1HG1      VAL  51   1.678  10.620   1.208
  352   2HG1  VAL  51          2HG1      VAL  51   2.681  11.407  -0.025
  353   3HG1  VAL  51          3HG1      VAL  51   2.747  11.961   1.657
  354   1HG2  VAL  51          1HG2      VAL  51   2.085  13.837  -0.753
  355   2HG2  VAL  51          2HG2      VAL  51   0.728  14.648   0.054
  356   3HG2  VAL  51          3HG2      VAL  51   2.206  14.282   0.957
  357    H    CYS  52           H        CYS  52  -2.019  12.241   1.133
  358    HA   CYS  52           HA       CYS  52  -4.020  13.103  -0.577
  359   1HB   CYS  52          1HB       CYS  52  -3.732  13.970   2.325
  360   2HB   CYS  52          2HB       CYS  52  -5.201  13.905   1.367
  361    H    GLU  53           H        GLU  53  -4.940  15.106  -1.164
  362    HA   GLU  53           HA       GLU  53  -3.222  17.416  -1.306
  363   1HB   GLU  53          1HB       GLU  53  -6.239  17.135  -1.523
  364   2HB   GLU  53          2HB       GLU  53  -5.355  18.616  -1.895
  365   1HG   GLU  53          1HG       GLU  53  -4.152  17.561  -3.710
  366   2HG   GLU  53          2HG       GLU  53  -4.779  15.964  -3.289
  367    H    GLU  54           H        GLU  54  -3.463  19.437  -0.171
  368    HA   GLU  54           HA       GLU  54  -3.484  19.225   2.628
  369   1HB   GLU  54          1HB       GLU  54  -4.077  21.722   0.979
  370   2HB   GLU  54          2HB       GLU  54  -3.500  21.666   2.648
  371   1HG   GLU  54          1HG       GLU  54  -1.961  20.828   0.149
  372   2HG   GLU  54          2HG       GLU  54  -1.632  22.192   1.213
  373    H    GLY  55           H        GLY  55  -5.030  19.179   4.146
  374   1HA   GLY  55          1HA       GLY  55  -7.084  19.756   5.141
  375   2HA   GLY  55          2HA       GLY  55  -7.782  20.159   3.572
  376    H    PHE  56           H        PHE  56  -6.386  17.390   2.685
  377    HA   PHE  56           HA       PHE  56  -8.684  15.679   3.508
  378   1HB   PHE  56          1HB       PHE  56  -6.762  15.470   1.173
  379   2HB   PHE  56          2HB       PHE  56  -8.021  14.316   1.583
  380    HD1  PHE  56           HD1      PHE  56  -7.471  17.929   0.657
  381    HD2  PHE  56           HD2      PHE  56 -10.147  14.545   0.579
  382    HE1  PHE  56           HE1      PHE  56  -8.964  19.143  -0.881
  383    HE2  PHE  56           HE2      PHE  56 -11.644  15.768  -0.944
  384    HZ   PHE  56           HZ       PHE  56 -11.080  18.081  -1.668
  385    H    TYR  57           H        TYR  57  -8.231  13.602   4.338
  386    HA   TYR  57           HA       TYR  57  -5.466  13.071   5.260
  387   1HB   TYR  57          1HB       TYR  57  -8.022  13.152   6.914
  388   2HB   TYR  57          2HB       TYR  57  -6.448  12.600   7.486
  389    HD1  TYR  57           HD1      TYR  57  -4.565  14.182   7.742
  390    HD2  TYR  57           HD2      TYR  57  -8.523  15.534   6.731
  391    HE1  TYR  57           HE1      TYR  57  -3.870  16.541   8.160
  392    HE2  TYR  57           HE2      TYR  57  -7.858  17.869   7.203
  393    HH   TYR  57           HH       TYR  57  -6.138  19.283   7.809
  394    H    ARG  58           H        ARG  58  -5.093  10.859   5.727
  395    HA   ARG  58           HA       ARG  58  -6.650   9.102   4.031
  396   1HB   ARG  58          1HB       ARG  58  -4.548   8.202   6.007
  397   2HB   ARG  58          2HB       ARG  58  -5.148   7.385   4.566
  398   1HG   ARG  58          1HG       ARG  58  -4.300   9.306   3.187
  399   2HG   ARG  58          2HG       ARG  58  -3.513   9.959   4.648
  400   1HD   ARG  58          1HD       ARG  58  -2.943   7.441   3.104
  401   2HD   ARG  58          2HD       ARG  58  -1.862   8.756   3.500
  402    HE   ARG  58           HE       ARG  58  -2.853   6.531   5.249
  403   1HH1  ARG  58          1HH1      ARG  58  -0.750   9.405   5.065
  404   2HH1  ARG  58          2HH1      ARG  58   0.411   8.714   6.191
  405   1HH2  ARG  58          1HH2      ARG  58  -1.411   5.817   6.892
  406   2HH2  ARG  58          2HH2      ARG  58  -0.045   6.848   7.307
  407    H    ASN  59           H        ASN  59  -8.698   8.648   4.687
  408    HA   ASN  59           HA       ASN  59  -9.351   7.866   7.440
  409   1HB   ASN  59          1HB       ASN  59 -11.059   8.867   6.084
  410   2HB   ASN  59          2HB       ASN  59 -10.902   7.600   4.843
  411   1HD2  ASN  59          2HD2      ASN  59 -12.252   5.788   5.093
  412   2HD2  ASN  59          1HD2      ASN  59 -12.904   5.306   6.660
  413    H    LYS  60           H        LYS  60  -8.146   6.329   4.563
  414    HA   LYS  60           HA       LYS  60  -7.694   3.823   6.116
  415   1HB   LYS  60          1HB       LYS  60  -8.626   3.987   3.225
  416   2HB   LYS  60          2HB       LYS  60  -7.943   2.546   3.965
  417   1HG   LYS  60          1HG       LYS  60 -10.473   3.911   4.998
  418   2HG   LYS  60          2HG       LYS  60 -10.457   2.629   3.777
  419   1HD   LYS  60          1HD       LYS  60  -9.231   1.142   5.399
  420   2HD   LYS  60          2HD       LYS  60  -9.445   2.395   6.635
  421   1HE   LYS  60          1HE       LYS  60 -11.928   2.239   6.319
  422   2HE   LYS  60          2HE       LYS  60 -11.680   0.961   5.120
  423   1HZ   LYS  60          1HZ       LYS  60 -10.875   0.821   7.939
  424   2HZ   LYS  60          2HZ       LYS  60 -12.185   0.084   7.270
  425   3HZ   LYS  60          3HZ       LYS  60 -10.667  -0.366   6.816
  426    H    ASP  61           H        ASP  61  -6.972   5.233   2.926
  427    HA   ASP  61           HA       ASP  61  -4.124   5.477   3.417
  428   1HB   ASP  61          1HB       ASP  61  -4.241   3.041   3.279
  429   2HB   ASP  61          2HB       ASP  61  -5.219   3.122   1.816
  430    H    ASP  62           H        ASP  62  -5.651   4.343   0.421
  431    HA   ASP  62           HA       ASP  62  -5.013   6.732  -1.076
  432   1HB   ASP  62          1HB       ASP  62  -6.222   5.677  -2.863
  433   2HB   ASP  62          2HB       ASP  62  -5.228   4.438  -2.082
  434    H    LYS  63           H        LYS  63  -7.702   5.545   0.845
  435    HA   LYS  63           HA       LYS  63  -9.655   7.385  -0.033
  436   1HB   LYS  63          1HB       LYS  63  -9.502   6.002   2.661
  437   2HB   LYS  63          2HB       LYS  63 -10.930   6.720   1.935
  438   1HG   LYS  63          1HG       LYS  63  -9.415   4.250   0.970
  439   2HG   LYS  63          2HG       LYS  63 -11.022   4.313   1.681
  440   1HD   LYS  63          1HD       LYS  63 -10.206   5.421  -1.044
  441   2HD   LYS  63          2HD       LYS  63 -11.114   3.949  -0.731
  442   1HE   LYS  63          1HE       LYS  63 -12.953   5.296   0.304
  443   2HE   LYS  63          2HE       LYS  63 -12.062   6.782  -0.090
  444   1HZ   LYS  63          1HZ       LYS  63 -12.164   6.179  -2.382
  445   2HZ   LYS  63          2HZ       LYS  63 -13.022   4.813  -2.035
  446   3HZ   LYS  63          3HZ       LYS  63 -13.679   6.296  -1.737
  447    H    CYS  64           H        CYS  64  -8.184   9.231  -0.134
  448    HA   CYS  64           HA       CYS  64  -7.551  10.738   2.287
  449   1HB   CYS  64          1HB       CYS  64  -7.364  11.256  -0.680
  450   2HB   CYS  64          2HB       CYS  64  -6.971  12.487   0.506
  451    H    VAL  65           H        VAL  65  -9.326  11.537   3.370
  452    HA   VAL  65           HA       VAL  65 -11.387  13.064   1.848
  453    HB   VAL  65           HB       VAL  65 -13.091  12.039   3.390
  454   1HG1  VAL  65          1HG1      VAL  65 -12.885  11.404   0.999
  455   2HG1  VAL  65          2HG1      VAL  65 -11.751  10.110   1.444
  456   3HG1  VAL  65          3HG1      VAL  65 -13.430  10.056   2.013
  457   1HG2  VAL  65          1HG2      VAL  65 -11.523  11.039   5.055
  458   2HG2  VAL  65          2HG2      VAL  65 -12.610   9.826   4.336
  459   3HG2  VAL  65          3HG2      VAL  65 -10.930   9.917   3.814
  460    H    SER  66           H        SER  66 -12.490  14.663   3.160
  461    HA   SER  66           HA       SER  66 -10.698  16.254   4.451
  462   1HB   SER  66          1HB       SER  66 -13.677  16.240   4.963
  463   2HB   SER  66          2HB       SER  66 -12.601  17.650   4.868
  464    HG   SER  66           HG       SER  66 -12.292  17.121   2.629
  465    H    ALA  67           H        ALA  67 -10.514  17.039   6.623
  466    HA   ALA  67           HA       ALA  67 -10.399  15.371   8.823
  467   1HB   ALA  67          1HB       ALA  67 -11.228  18.302   8.777
  468   2HB   ALA  67          2HB       ALA  67 -10.669  17.404  10.204
  469   3HB   ALA  67          3HB       ALA  67  -9.567  17.674   8.843
  470    H    GLU  68           H        GLU  68 -13.190  17.125   7.600
  471    HA   GLU  68           HA       GLU  68 -15.178  16.671   9.449
  472   1HB   GLU  68          1HB       GLU  68 -15.573  16.395   6.438
  473   2HB   GLU  68          2HB       GLU  68 -16.740  16.923   7.653
  474   1HG   GLU  68          1HG       GLU  68 -15.262  18.922   8.125
  475   2HG   GLU  68          2HG       GLU  68 -14.227  18.449   6.766
  476    H    ASP  69           H        ASP  69 -13.977  14.331   6.986
  477    HA   ASP  69           HA       ASP  69 -16.001  12.330   7.567
  478   1HB   ASP  69          1HB       ASP  69 -14.877  12.398   5.389
  479   2HB   ASP  69          2HB       ASP  69 -13.312  12.105   6.169
  480    H    CYS  70           H        CYS  70 -12.596  12.937   8.519
  481    HA   CYS  70           HA       CYS  70 -12.174  10.644  10.102
  482   1HB   CYS  70          1HB       CYS  70 -11.185  13.418  10.836
  483   2HB   CYS  70          2HB       CYS  70 -10.468  11.863  11.243
  484    H    GLU  71           H        GLU  71 -13.528  13.825  10.970
  485    HA   GLU  71           HA       GLU  71 -14.239  13.215  13.671
  486   1HB   GLU  71          1HB       GLU  71 -15.366  15.285  11.746
  487   2HB   GLU  71          2HB       GLU  71 -15.649  15.259  13.488
  488   1HG   GLU  71          1HG       GLU  71 -12.902  15.552  12.207
  489   2HG   GLU  71          2HG       GLU  71 -13.911  16.875  12.797
  490    H    LEU  72           H        LEU  72 -15.730  12.032  10.761
  491    HA   LEU  72           HA       LEU  72 -18.398  11.900  12.001
  492   1HB   LEU  72          1HB       LEU  72 -18.227  12.712   9.711
  493   2HB   LEU  72          2HB       LEU  72 -17.298  11.286   9.233
  494    HG   LEU  72           HG       LEU  72 -19.133   9.835   9.710
  495   1HD1  LEU  72          1HD1      LEU  72 -20.629  12.425  10.368
  496   2HD1  LEU  72          2HD1      LEU  72 -21.452  10.880  10.046
  497   3HD1  LEU  72          3HD1      LEU  72 -20.386  11.034  11.447
  498   1HD2  LEU  72          1HD2      LEU  72 -18.819  10.794   7.456
  499   2HD2  LEU  72          2HD2      LEU  72 -20.549  10.555   7.779
  500   3HD2  LEU  72          3HD2      LEU  72 -19.836  12.183   7.889
  501    H    ASP  73           H        ASP  73 -15.723   9.906  10.676
  502    HA   ASP  73           HA       ASP  73 -16.665   7.348  11.530
  503   1HB   ASP  73          1HB       ASP  73 -14.754   7.592  10.022
  504   2HB   ASP  73          2HB       ASP  73 -13.842   8.455  11.268
  505    H    ASN  74           H        ASN  74 -14.692   9.806  13.129
  506    HA   ASN  74           HA       ASN  74 -13.705   9.730  15.225
  507   1HB   ASN  74          1HB       ASN  74 -15.208  11.565  14.970
  508   2HB   ASN  74          2HB       ASN  74 -16.586  10.615  15.549
  509   1HD2  ASN  74          2HD2      ASN  74 -13.319  11.802  16.431
  510   2HD2  ASN  74          1HD2      ASN  74 -13.642  11.934  18.162
  511    H    MET  75           H        MET  75 -16.932   8.363  15.932
  512    HA   MET  75           HA       MET  75 -16.304   7.374  18.506
  513   1HB   MET  75          1HB       MET  75 -18.349   6.371  16.467
  514   2HB   MET  75          2HB       MET  75 -18.270   5.895  18.161
  515   1HG   MET  75          1HG       MET  75 -19.953   7.518  18.066
  516   2HG   MET  75          2HG       MET  75 -18.569   8.281  18.839
  517   1HE   MET  75          1HE       MET  75 -20.780   8.025  15.602
  518   2HE   MET  75          2HE       MET  75 -20.082   9.303  14.579
  519   3HE   MET  75          3HE       MET  75 -19.161   7.820  14.880
  520    H    ASP  76           H        ASP  76 -15.884   5.925  15.303
  521    HA   ASP  76           HA       ASP  76 -15.049   3.300  16.297
  522   1HB   ASP  76          1HB       ASP  76 -16.140   3.384  14.185
  523   2HB   ASP  76          2HB       ASP  76 -15.087   4.669  13.598
  524    H    PHE  77           H        PHE  77 -13.486   6.364  15.979
  525    HA   PHE  77           HA       PHE  77 -11.377   7.095  15.855
  526   1HB   PHE  77          1HB       PHE  77 -11.038   4.731  17.723
  527   2HB   PHE  77          2HB       PHE  77  -9.819   5.969  17.458
  528    HD1  PHE  77           HD1      PHE  77 -10.224   8.367  18.037
  529    HD2  PHE  77           HD2      PHE  77 -12.987   5.244  19.138
  530    HE1  PHE  77           HE1      PHE  77 -11.337   9.912  19.611
  531    HE2  PHE  77           HE2      PHE  77 -14.135   6.807  20.674
  532    HZ   PHE  77           HZ       PHE  77 -13.318   9.147  20.917
  533    H    ILE  78           H        ILE  78 -11.982   5.730  13.600
  534    HA   ILE  78           HA       ILE  78 -11.059   4.785  11.752
  535    HB   ILE  78           HB       ILE  78  -8.612   6.158  12.882
  536   1HG1  ILE  78          1HG1      ILE  78 -10.635   7.653  12.929
  537   2HG1  ILE  78          2HG1      ILE  78  -9.260   8.215  12.009
  538   1HG2  ILE  78          1HG2      ILE  78  -9.423   5.604   9.991
  539   2HG2  ILE  78          2HG2      ILE  78  -8.069   6.642  10.475
  540   3HG2  ILE  78          3HG2      ILE  78  -8.026   4.917  10.828
  541   1HD1  ILE  78          1HD1      ILE  78 -11.627   6.831  10.693
  542   2HD1  ILE  78          2HD1      ILE  78 -11.525   8.585  10.945
  543   3HD1  ILE  78          3HD1      ILE  78 -10.346   7.764   9.912
  544    H    TYR  79           H        TYR  79 -11.458   2.886  13.260
  545    HA   TYR  79           HA       TYR  79 -10.938   0.892  14.171
  546   1HB   TYR  79          1HB       TYR  79  -9.820  -0.352  11.906
  547   2HB   TYR  79          2HB       TYR  79 -11.492  -0.225  12.394
  548    HD1  TYR  79           HD1      TYR  79  -8.829   1.574  10.490
  549    HD2  TYR  79           HD2      TYR  79 -13.062   1.047  11.123
  550    HE1  TYR  79           HE1      TYR  79  -9.295   3.356   8.856
  551    HE2  TYR  79           HE2      TYR  79 -13.528   2.800   9.436
  552    HH   TYR  79           HH       TYR  79 -10.923   4.649   7.861
  553    HA   PRO  80           HA       PRO  80  -6.477   0.690  15.291
  554   1HB   PRO  80          1HB       PRO  80  -6.704  -0.681  17.622
  555   2HB   PRO  80          2HB       PRO  80  -7.140   1.040  17.480
  556   1HG   PRO  80          1HG       PRO  80  -8.990  -1.352  17.340
  557   2HG   PRO  80          2HG       PRO  80  -9.179   0.117  18.342
  558   1HD   PRO  80          1HD       PRO  80 -10.421  -0.206  15.947
  559   2HD   PRO  80          2HD       PRO  80  -9.842   1.407  16.463
  560    H    GLY  81           H        GLY  81  -6.828  -0.541  13.228
  561   1HA   GLY  81          1HA       GLY  81  -6.100  -3.431  13.516
  562   2HA   GLY  81          2HA       GLY  81  -7.043  -2.763  12.172
  563    H    THR  82           H        THR  82  -5.596  -0.234  11.876
  564    HA   THR  82           HA       THR  82  -3.224  -0.987  10.405
  565    HB   THR  82           HB       THR  82  -3.047   1.609  10.474
  566    HG1  THR  82           HG1      THR  82  -5.035   2.585  11.244
  567   1HG2  THR  82          1HG2      THR  82  -5.659   0.399   9.444
  568   2HG2  THR  82          2HG2      THR  82  -4.947   1.944   8.936
  569   3HG2  THR  82          3HG2      THR  82  -4.110   0.425   8.572
  570    H    ARG  83           H        ARG  83  -3.505   1.417  12.978
  571    HA   ARG  83           HA       ARG  83  -1.028   0.464  14.324
  572   1HB   ARG  83          1HB       ARG  83  -2.952   2.749  14.898
  573   2HB   ARG  83          2HB       ARG  83  -1.576   2.309  15.922
  574   1HG   ARG  83          1HG       ARG  83  -0.012   2.665  14.059
  575   2HG   ARG  83          2HG       ARG  83  -1.353   3.089  12.978
  576   1HD   ARG  83          1HD       ARG  83  -0.186   5.096  13.906
  577   2HD   ARG  83          2HD       ARG  83  -1.879   5.061  14.298
  578    HE   ARG  83           HE       ARG  83   0.473   4.515  16.056
  579   1HH1  ARG  83          1HH1      ARG  83  -3.057   4.989  15.897
  580   2HH1  ARG  83          2HH1      ARG  83  -3.207   5.484  17.548
  581   1HH2  ARG  83          1HH2      ARG  83   0.318   5.072  18.179
  582   2HH2  ARG  83          2HH2      ARG  83  -1.155   5.552  18.925
  583    H    ASN  84           H        ASN  84  -2.290  -1.693  14.414
  584    HA   ASN  84           HA       ASN  84  -4.322  -1.943  16.453
  585   1HB   ASN  84          1HB       ASN  84  -4.025  -3.644  14.706
  586   2HB   ASN  84          2HB       ASN  84  -2.411  -4.021  15.325
  587   1HD2  ASN  84          2HD2      ASN  84  -5.856  -3.751  16.471
  588   2HD2  ASN  84          1HD2      ASN  84  -5.725  -5.129  17.560
  589    HA   PRO  85           HA       PRO  85  -1.177  -1.223  19.616
  590   1HB   PRO  85          1HB       PRO  85  -2.696  -1.269  21.882
  591   2HB   PRO  85          2HB       PRO  85  -2.772   0.063  20.695
  592   1HG   PRO  85          1HG       PRO  85  -4.628  -2.325  20.896
  593   2HG   PRO  85          2HG       PRO  85  -5.074  -0.596  20.776
  594   1HD   PRO  85          1HD       PRO  85  -5.011  -2.225  18.597
  595   2HD   PRO  85          2HD       PRO  85  -4.477  -0.516  18.488
  Start of MODEL   18
    1   1H    LYS   1          1H        LYS   1  -6.806  13.257 -10.140
    2   2H    LYS   1          2H        LYS   1  -7.566  13.554  -8.696
    3   3H    LYS   1          3H        LYS   1  -6.706  14.745  -9.458
    4    HA   LYS   1           HA       LYS   1  -5.458  13.950  -7.653
    5   1HB   LYS   1          1HB       LYS   1  -4.782  11.638  -7.474
    6   2HB   LYS   1          2HB       LYS   1  -6.545  11.725  -7.598
    7   1HG   LYS   1          1HG       LYS   1  -6.403  11.075  -9.999
    8   2HG   LYS   1          2HG       LYS   1  -4.631  11.014  -9.870
    9   1HD   LYS   1          1HD       LYS   1  -4.879   9.297  -8.036
   10   2HD   LYS   1          2HD       LYS   1  -6.613   9.268  -8.348
   11   1HE   LYS   1          1HE       LYS   1  -6.223   8.534 -10.667
   12   2HE   LYS   1          2HE       LYS   1  -4.464   8.675 -10.452
   13   1HZ   LYS   1          1HZ       LYS   1  -6.154   6.878  -8.869
   14   2HZ   LYS   1          2HZ       LYS   1  -5.315   6.419 -10.221
   15   3HZ   LYS   1          3HZ       LYS   1  -4.517   6.943  -8.876
   16    H    ALA   2           H        ALA   2  -3.030  13.329  -7.851
   17    HA   ALA   2           HA       ALA   2  -1.920  14.517 -10.264
   18   1HB   ALA   2          1HB       ALA   2  -0.572  12.827  -8.132
   19   2HB   ALA   2          2HB       ALA   2   0.257  13.667  -9.453
   20   3HB   ALA   2          3HB       ALA   2  -0.623  14.611  -8.243
   21    H    THR   3           H        THR   3  -1.670  13.578 -12.254
   22    HA   THR   3           HA       THR   3  -2.463  10.836 -12.708
   23    HB   THR   3           HB       THR   3  -1.890  11.510 -15.073
   24    HG1  THR   3           HG1      THR   3  -0.247  12.952 -14.516
   25   1HG2  THR   3          1HG2      THR   3  -4.159  11.943 -14.151
   26   2HG2  THR   3          2HG2      THR   3  -3.620  13.524 -13.547
   27   3HG2  THR   3          3HG2      THR   3  -3.656  13.206 -15.291
   28    H    MET   4           H        MET   4  -0.747  10.089 -11.133
   29    HA   MET   4           HA       MET   4   1.591   9.084 -12.627
   30   1HB   MET   4          1HB       MET   4   1.824  10.431  -9.883
   31   2HB   MET   4          2HB       MET   4   3.131   9.633 -10.775
   32   1HG   MET   4          1HG       MET   4   2.889  11.323 -12.589
   33   2HG   MET   4          2HG       MET   4   1.729  12.195 -11.569
   34   1HE   MET   4          1HE       MET   4   4.312  13.538 -12.831
   35   2HE   MET   4          2HE       MET   4   3.140  14.403 -11.804
   36   3HE   MET   4          3HE       MET   4   4.880  14.492 -11.441
   37    H    GLN   5           H        GLN   5   2.689   7.738 -10.373
   38    HA   GLN   5           HA       GLN   5   0.739   5.652  -9.798
   39   1HB   GLN   5          1HB       GLN   5   3.411   6.286  -8.451
   40   2HB   GLN   5          2HB       GLN   5   2.480   4.790  -8.305
   41   1HG   GLN   5          1HG       GLN   5   3.849   5.860 -10.815
   42   2HG   GLN   5          2HG       GLN   5   4.328   4.460  -9.856
   43   1HE2  GLN   5          2HE2      GLN   5   2.272   2.845  -9.524
   44   2HE2  GLN   5          1HE2      GLN   5   1.482   2.466 -11.045
   45    H    CYS   6           H        CYS   6  -1.059   6.520  -8.817
   46    HA   CYS   6           HA       CYS   6  -0.796   7.861  -6.201
   47   1HB   CYS   6          1HB       CYS   6  -0.871   9.366  -8.485
   48   2HB   CYS   6          2HB       CYS   6  -2.596   9.088  -8.298
   49    H    GLY   7           H        GLY   7  -2.747   7.588  -4.924
   50   1HA   GLY   7          1HA       GLY   7  -4.374   5.302  -5.813
   51   2HA   GLY   7          2HA       GLY   7  -4.292   6.014  -4.205
   52    H    GLU   8           H        GLU   8  -5.866   7.444  -3.582
   53    HA   GLU   8           HA       GLU   8  -8.080   7.882  -5.497
   54   1HB   GLU   8          1HB       GLU   8  -8.320   6.830  -3.189
   55   2HB   GLU   8          2HB       GLU   8  -7.947   8.408  -2.526
   56   1HG   GLU   8          1HG       GLU   8 -10.017   8.953  -4.390
   57   2HG   GLU   8          2HG       GLU   8 -10.418   7.336  -3.827
   58    H    ASN   9           H        ASN   9  -8.576  10.220  -3.309
   59    HA   ASN   9           HA       ASN   9  -7.864  12.462  -5.048
   60   1HB   ASN   9          1HB       ASN   9  -9.946  12.468  -3.838
   61   2HB   ASN   9          2HB       ASN   9  -9.134  12.165  -2.304
   62   1HD2  ASN   9          2HD2      ASN   9  -9.650  13.993  -1.139
   63   2HD2  ASN   9          1HD2      ASN   9  -9.129  15.600  -1.674
   64    H    GLU  10           H        GLU  10  -5.615  11.725  -5.118
   65    HA   GLU  10           HA       GLU  10  -3.971  12.753  -2.838
   66   1HB   GLU  10          1HB       GLU  10  -3.764  10.261  -4.598
   67   2HB   GLU  10          2HB       GLU  10  -2.414  10.930  -3.684
   68   1HG   GLU  10          1HG       GLU  10  -3.786  10.785  -1.606
   69   2HG   GLU  10          2HG       GLU  10  -4.921   9.754  -2.510
   70    H    LYS  11           H        LYS  11  -1.743  13.217  -3.389
   71    HA   LYS  11           HA       LYS  11  -1.246  14.011  -6.172
   72   1HB   LYS  11          1HB       LYS  11  -0.410  16.192  -5.480
   73   2HB   LYS  11          2HB       LYS  11  -2.151  16.011  -5.203
   74   1HG   LYS  11          1HG       LYS  11  -1.700  15.506  -2.780
   75   2HG   LYS  11          2HG       LYS  11   0.018  15.775  -3.047
   76   1HD   LYS  11          1HD       LYS  11  -2.258  17.782  -3.388
   77   2HD   LYS  11          2HD       LYS  11  -1.069  17.745  -2.077
   78   1HE   LYS  11          1HE       LYS  11  -0.520  18.413  -5.003
   79   2HE   LYS  11          2HE       LYS  11  -0.446  19.499  -3.616
   80   1HZ   LYS  11          1HZ       LYS  11   1.361  18.184  -2.753
   81   2HZ   LYS  11          2HZ       LYS  11   1.314  17.191  -4.067
   82   3HZ   LYS  11          3HZ       LYS  11   1.717  18.776  -4.250
   83    H    TYR  12           H        TYR  12   0.954  14.264  -6.672
   84    HA   TYR  12           HA       TYR  12   2.446  12.108  -5.650
   85   1HB   TYR  12          1HB       TYR  12   2.535  12.946  -7.964
   86   2HB   TYR  12          2HB       TYR  12   3.379  14.391  -7.402
   87    HD1  TYR  12           HD1      TYR  12   3.595  10.682  -7.760
   88    HD2  TYR  12           HD2      TYR  12   5.727  14.295  -6.761
   89    HE1  TYR  12           HE1      TYR  12   5.668   9.372  -7.426
   90    HE2  TYR  12           HE2      TYR  12   7.774  12.981  -6.380
   91    HH   TYR  12           HH       TYR  12   8.487  10.845  -5.868
   92    H    ASP  13           H        ASP  13   4.104  11.860  -4.266
   93    HA   ASP  13           HA       ASP  13   5.652  14.075  -3.237
   94   1HB   ASP  13          1HB       ASP  13   3.703  14.437  -1.793
   95   2HB   ASP  13          2HB       ASP  13   3.589  12.690  -1.480
   96    H    SER  14           H        SER  14   7.609  13.020  -3.338
   97    HA   SER  14           HA       SER  14   7.830  10.198  -3.280
   98   1HB   SER  14          1HB       SER  14  10.024  12.252  -2.818
   99   2HB   SER  14          2HB       SER  14  10.222  10.579  -3.369
  100    HG   SER  14           HG       SER  14  10.212  12.317  -5.018
  101    H    CYS  15           H        CYS  15   6.531   9.953  -1.177
  102    HA   CYS  15           HA       CYS  15   8.506   9.031   0.673
  103   1HB   CYS  15          1HB       CYS  15   7.868  11.595   1.303
  104   2HB   CYS  15          2HB       CYS  15   6.643  10.763   2.225
  105    H    GLY  16           H        GLY  16   6.497   7.728  -0.918
  106   1HA   GLY  16          1HA       GLY  16   5.774   5.565  -0.230
  107   2HA   GLY  16          2HA       GLY  16   5.490   6.104   1.407
  108    H    SER  17           H        SER  17   3.974   5.023  -1.243
  109    HA   SER  17           HA       SER  17   1.724   6.376  -1.825
  110   1HB   SER  17          1HB       SER  17   1.719   3.420  -1.113
  111   2HB   SER  17          2HB       SER  17   0.948   4.240  -2.485
  112    HG   SER  17           HG       SER  17   2.871   3.112  -3.084
  113    H    LYS  18           H        LYS  18   0.522   7.521  -0.423
  114    HA   LYS  18           HA       LYS  18  -0.535   8.154   1.435
  115   1HB   LYS  18          1HB       LYS  18  -2.446   6.848   2.126
  116   2HB   LYS  18          2HB       LYS  18  -2.386   7.104   0.414
  117   1HG   LYS  18          1HG       LYS  18  -1.542   4.492   1.747
  118   2HG   LYS  18          2HG       LYS  18  -3.191   4.879   1.292
  119   1HD   LYS  18          1HD       LYS  18  -0.911   4.074  -0.463
  120   2HD   LYS  18          2HD       LYS  18  -2.584   3.577  -0.465
  121   1HE   LYS  18          1HE       LYS  18  -3.231   5.788  -1.449
  122   2HE   LYS  18          2HE       LYS  18  -1.521   6.238  -1.527
  123   1HZ   LYS  18          1HZ       LYS  18  -1.161   4.362  -2.955
  124   2HZ   LYS  18          2HZ       LYS  18  -2.765   3.978  -2.908
  125   3HZ   LYS  18          3HZ       LYS  18  -2.274   5.400  -3.580
  126    H    GLU  19           H        GLU  19   1.950   7.540   2.113
  127    HA   GLU  19           HA       GLU  19   2.306   5.799   4.249
  128   1HB   GLU  19          1HB       GLU  19   4.072   7.340   5.012
  129   2HB   GLU  19          2HB       GLU  19   4.178   7.040   3.285
  130   1HG   GLU  19          1HG       GLU  19   3.490   9.192   2.704
  131   2HG   GLU  19          2HG       GLU  19   2.617   9.469   4.208
  132    H    CYS  20           H        CYS  20   2.669   6.562   6.639
  133    HA   CYS  20           HA       CYS  20   0.061   7.372   7.537
  134   1HB   CYS  20          1HB       CYS  20   1.723   5.657   8.590
  135   2HB   CYS  20          2HB       CYS  20   2.368   7.068   9.424
  136    H    ASP  21           H        ASP  21   1.224   9.500   6.143
  137    HA   ASP  21           HA       ASP  21   1.584  11.696   8.103
  138   1HB   ASP  21          1HB       ASP  21   3.283  11.689   6.255
  139   2HB   ASP  21          2HB       ASP  21   1.962  11.606   5.071
  140    H    LYS  22           H        LYS  22  -0.035  13.395   7.839
  141    HA   LYS  22           HA       LYS  22  -2.288  13.828   8.032
  142   1HB   LYS  22          1HB       LYS  22  -2.451  12.970   5.123
  143   2HB   LYS  22          2HB       LYS  22  -3.409  14.187   5.975
  144   1HG   LYS  22          1HG       LYS  22  -0.463  14.393   5.242
  145   2HG   LYS  22          2HG       LYS  22  -1.815  15.179   4.425
  146   1HD   LYS  22          1HD       LYS  22  -2.376  16.462   6.437
  147   2HD   LYS  22          2HD       LYS  22  -1.031  15.724   7.332
  148   1HE   LYS  22          1HE       LYS  22  -0.741  17.376   4.780
  149   2HE   LYS  22          2HE       LYS  22  -0.519  18.003   6.419
  150   1HZ   LYS  22          1HZ       LYS  22   1.260  16.417   6.713
  151   2HZ   LYS  22          2HZ       LYS  22   1.079  15.867   5.175
  152   3HZ   LYS  22          3HZ       LYS  22   1.556  17.420   5.440
  153    H    LYS  23           H        LYS  23  -1.691  11.304   9.029
  154    HA   LYS  23           HA       LYS  23  -3.502   9.336   7.953
  155   1HB   LYS  23          1HB       LYS  23  -2.863   7.950   9.709
  156   2HB   LYS  23          2HB       LYS  23  -1.452   8.856   9.223
  157   1HG   LYS  23          1HG       LYS  23  -1.247   8.895  11.522
  158   2HG   LYS  23          2HG       LYS  23  -1.947  10.471  11.176
  159   1HD   LYS  23          1HD       LYS  23  -2.964   9.514  13.134
  160   2HD   LYS  23          2HD       LYS  23  -4.196   9.602  11.910
  161   1HE   LYS  23          1HE       LYS  23  -3.868   7.149  11.403
  162   2HE   LYS  23          2HE       LYS  23  -2.642   7.087  12.680
  163   1HZ   LYS  23          1HZ       LYS  23  -4.425   7.777  14.193
  164   2HZ   LYS  23          2HZ       LYS  23  -5.496   7.742  12.932
  165   3HZ   LYS  23          3HZ       LYS  23  -4.763   6.354  13.429
  166    H    CYS  24           H        CYS  24  -5.585   8.731   8.869
  167    HA   CYS  24           HA       CYS  24  -6.987  11.086   9.894
  168   1HB   CYS  24          1HB       CYS  24  -8.024   9.820   8.146
  169   2HB   CYS  24          2HB       CYS  24  -7.967   8.326   9.131
  170    H    LYS  25           H        LYS  25  -7.263  11.508  12.012
  171    HA   LYS  25           HA       LYS  25  -6.266   9.564  13.927
  172   1HB   LYS  25          1HB       LYS  25  -5.479  11.826  13.967
  173   2HB   LYS  25          2HB       LYS  25  -7.108  12.461  14.204
  174   1HG   LYS  25          1HG       LYS  25  -5.668  12.423  16.243
  175   2HG   LYS  25          2HG       LYS  25  -7.222  11.614  16.437
  176   1HD   LYS  25          1HD       LYS  25  -6.217   9.427  16.328
  177   2HD   LYS  25          2HD       LYS  25  -4.649  10.094  15.820
  178   1HE   LYS  25          1HE       LYS  25  -4.258  11.055  17.983
  179   2HE   LYS  25          2HE       LYS  25  -5.953  10.861  18.463
  180   1HZ   LYS  25          1HZ       LYS  25  -4.162   8.602  17.958
  181   2HZ   LYS  25          2HZ       LYS  25  -4.524   9.212  19.447
  182   3HZ   LYS  25          3HZ       LYS  25  -5.720   8.569  18.520
  183    H    TYR  26           H        TYR  26  -9.346  11.441  13.677
  184    HA   TYR  26           HA       TYR  26 -11.144  11.346  15.074
  185   1HB   TYR  26          1HB       TYR  26 -12.630   9.531  14.690
  186   2HB   TYR  26          2HB       TYR  26 -11.896  10.098  13.209
  187    HD1  TYR  26           HD1      TYR  26  -9.694   8.727  12.452
  188    HD2  TYR  26           HD2      TYR  26 -13.112   7.251  14.626
  189    HE1  TYR  26           HE1      TYR  26  -9.465   6.556  11.329
  190    HE2  TYR  26           HE2      TYR  26 -12.961   5.138  13.397
  191    HH   TYR  26           HH       TYR  26 -11.581   3.795  12.109
  192    H    ASP  27           H        ASP  27  -9.419  11.505  16.727
  193    HA   ASP  27           HA       ASP  27  -8.492  11.082  18.718
  194   1HB   ASP  27          1HB       ASP  27 -10.786  11.897  19.154
  195   2HB   ASP  27          2HB       ASP  27 -11.328  10.248  19.437
  196    H    GLY  28           H        GLY  28 -10.749   8.320  19.114
  197   1HA   GLY  28          1HA       GLY  28  -8.551   6.699  20.158
  198   2HA   GLY  28          2HA       GLY  28 -10.279   6.331  20.136
  199    H    VAL  29           H        VAL  29  -9.816   7.262  17.018
  200    HA   VAL  29           HA       VAL  29  -9.746   6.158  15.071
  201    HB   VAL  29           HB       VAL  29  -7.674   4.305  16.355
  202   1HG1  VAL  29          1HG1      VAL  29  -8.292   4.938  13.436
  203   2HG1  VAL  29          2HG1      VAL  29  -6.916   3.982  14.019
  204   3HG1  VAL  29          3HG1      VAL  29  -8.558   3.384  14.244
  205   1HG2  VAL  29          1HG2      VAL  29  -7.023   6.750  16.434
  206   2HG2  VAL  29          2HG2      VAL  29  -5.972   5.696  15.483
  207   3HG2  VAL  29          3HG2      VAL  29  -7.135   6.737  14.655
  208    H    GLU  30           H        GLU  30  -9.096   3.101  16.579
  209    HA   GLU  30           HA       GLU  30 -11.968   2.320  16.658
  210   1HB   GLU  30          1HB       GLU  30  -9.565   0.795  15.640
  211   2HB   GLU  30          2HB       GLU  30 -10.855  -0.052  16.516
  212   1HG   GLU  30          1HG       GLU  30 -11.303  -0.247  14.189
  213   2HG   GLU  30          2HG       GLU  30 -12.537   0.763  14.938
  214    H    GLU  31           H        GLU  31  -8.733   1.267  17.862
  215    HA   GLU  31           HA       GLU  31  -9.633   1.595  20.656
  216   1HB   GLU  31          1HB       GLU  31  -8.967  -0.635  21.230
  217   2HB   GLU  31          2HB       GLU  31 -10.224  -0.688  19.998
  218   1HG   GLU  31          1HG       GLU  31  -7.245  -1.255  19.569
  219   2HG   GLU  31          2HG       GLU  31  -8.556  -2.419  19.631
  220    H    GLU  32           H        GLU  32  -8.032   3.419  19.504
  221    HA   GLU  32           HA       GLU  32  -5.224   2.831  19.838
  222   1HB   GLU  32          1HB       GLU  32  -6.350   4.641  18.401
  223   2HB   GLU  32          2HB       GLU  32  -6.480   5.603  19.878
  224   1HG   GLU  32          1HG       GLU  32  -3.910   4.442  18.707
  225   2HG   GLU  32          2HG       GLU  32  -4.493   6.076  18.408
  226    H    ASP  33           H        ASP  33  -5.539   1.709  21.863
  227    HA   ASP  33           HA       ASP  33  -6.288   3.133  24.259
  228   1HB   ASP  33          1HB       ASP  33  -6.008   1.026  25.340
  229   2HB   ASP  33          2HB       ASP  33  -6.768   0.730  23.769
  230    H    ASP  34           H        ASP  34  -3.248   1.854  22.919
  231    HA   ASP  34           HA       ASP  34  -1.668   3.974  24.093
  232   1HB   ASP  34          1HB       ASP  34  -1.855   2.454  26.069
  233   2HB   ASP  34          2HB       ASP  34  -1.235   1.116  25.087
  234    H    GLU  35           H        GLU  35  -2.085   3.652  21.569
  235    HA   GLU  35           HA       GLU  35   0.331   2.330  20.400
  236   1HB   GLU  35          1HB       GLU  35  -2.579   2.172  19.482
  237   2HB   GLU  35          2HB       GLU  35  -1.205   1.746  18.464
  238   1HG   GLU  35          1HG       GLU  35  -1.889   0.394  21.119
  239   2HG   GLU  35          2HG       GLU  35  -2.277  -0.236  19.517
  240    H    GLU  36           H        GLU  36   1.310   4.377  20.348
  241    HA   GLU  36           HA       GLU  36   0.312   6.789  19.610
  242   1HB   GLU  36          1HB       GLU  36   2.996   5.756  18.603
  243   2HB   GLU  36          2HB       GLU  36   2.502   7.434  18.816
  244   1HG   GLU  36          1HG       GLU  36   3.688   7.161  20.750
  245   2HG   GLU  36          2HG       GLU  36   2.103   6.670  21.353
  246    HA   PRO  37           HA       PRO  37  -1.480   5.796  15.684
  247   1HB   PRO  37          1HB       PRO  37  -2.312   8.241  14.809
  248   2HB   PRO  37          2HB       PRO  37  -2.997   7.424  16.235
  249   1HG   PRO  37          1HG       PRO  37  -0.784   9.500  16.195
  250   2HG   PRO  37          2HG       PRO  37  -2.295   9.555  17.148
  251   1HD   PRO  37          1HD       PRO  37  -0.024   8.621  18.248
  252   2HD   PRO  37          2HD       PRO  37  -1.565   7.756  18.548
  253    H    ASN  38           H        ASN  38   0.692   5.129  15.078
  254    HA   ASN  38           HA       ASN  38   1.517   5.716  12.448
  255   1HB   ASN  38          1HB       ASN  38   2.637   7.604  14.402
  256   2HB   ASN  38          2HB       ASN  38   3.898   6.565  13.761
  257   1HD2  ASN  38          2HD2      ASN  38   1.064   8.426  12.541
  258   2HD2  ASN  38          1HD2      ASN  38   1.817   8.937  11.029
  259    H    VAL  39           H        VAL  39   2.267   4.478  15.707
  260    HA   VAL  39           HA       VAL  39   4.248   2.618  14.902
  261    HB   VAL  39           HB       VAL  39   2.366   2.717  17.277
  262   1HG1  VAL  39          1HG1      VAL  39   4.618   0.734  16.725
  263   2HG1  VAL  39          2HG1      VAL  39   3.834   0.986  18.298
  264   3HG1  VAL  39          3HG1      VAL  39   2.900   0.335  16.950
  265   1HG2  VAL  39          1HG2      VAL  39   4.161   4.448  17.077
  266   2HG2  VAL  39          2HG2      VAL  39   4.387   3.364  18.461
  267   3HG2  VAL  39          3HG2      VAL  39   5.364   3.150  16.996
  268    HA   PRO  40           HA       PRO  40   0.983  -0.739  14.105
  269   1HB   PRO  40          1HB       PRO  40  -1.699  -0.201  14.061
  270   2HB   PRO  40          2HB       PRO  40  -0.818  -0.640  15.551
  271   1HG   PRO  40          1HG       PRO  40  -1.525   2.146  14.591
  272   2HG   PRO  40          2HG       PRO  40  -1.791   1.443  16.206
  273   1HD   PRO  40          1HD       PRO  40   0.365   2.989  15.687
  274   2HD   PRO  40          2HD       PRO  40   0.519   1.546  16.733
  275    H    CYS  41           H        CYS  41   0.010   2.532  13.100
  276    HA   CYS  41           HA       CYS  41  -0.551   1.822  10.312
  277   1HB   CYS  41          1HB       CYS  41  -1.762   3.584  11.422
  278   2HB   CYS  41          2HB       CYS  41  -0.282   4.428  11.843
  279    H    LEU  42           H        LEU  42   1.734   0.653  10.646
  280    HA   LEU  42           HA       LEU  42   4.066   2.240  10.687
  281   1HB   LEU  42          1HB       LEU  42   5.257   0.267  10.565
  282   2HB   LEU  42          2HB       LEU  42   3.775  -0.140  11.427
  283    HG   LEU  42           HG       LEU  42   4.472  -0.842   8.532
  284   1HD1  LEU  42          1HD1      LEU  42   5.666  -2.129  10.257
  285   2HD1  LEU  42          2HD1      LEU  42   4.117  -2.565  11.011
  286   3HD1  LEU  42          3HD1      LEU  42   4.506  -3.138   9.375
  287   1HD2  LEU  42          1HD2      LEU  42   1.956  -1.548  10.097
  288   2HD2  LEU  42          2HD2      LEU  42   2.030  -0.492   8.662
  289   3HD2  LEU  42          3HD2      LEU  42   2.420  -2.206   8.519
  290    H    VAL  43           H        VAL  43   2.264   2.866   8.327
  291    HA   VAL  43           HA       VAL  43   3.884   1.990   5.998
  292    HB   VAL  43           HB       VAL  43   2.268   3.403   4.674
  293   1HG1  VAL  43          1HG1      VAL  43   2.241   0.951   4.719
  294   2HG1  VAL  43          2HG1      VAL  43   1.268   0.962   6.206
  295   3HG1  VAL  43          3HG1      VAL  43   0.588   1.582   4.688
  296   1HG2  VAL  43          1HG2      VAL  43   1.238   4.665   6.608
  297   2HG2  VAL  43          2HG2      VAL  43   0.060   3.814   5.612
  298   3HG2  VAL  43          3HG2      VAL  43   0.526   3.150   7.187
  299    H    ARG  44           H        ARG  44   5.768   2.905   6.938
  300    HA   ARG  44           HA       ARG  44   6.153   5.696   5.878
  301   1HB   ARG  44          1HB       ARG  44   7.551   4.334   8.222
  302   2HB   ARG  44          2HB       ARG  44   8.039   5.881   7.519
  303   1HG   ARG  44          1HG       ARG  44   5.334   5.350   8.836
  304   2HG   ARG  44          2HG       ARG  44   6.719   6.164   9.570
  305   1HD   ARG  44          1HD       ARG  44   6.644   7.865   7.699
  306   2HD   ARG  44          2HD       ARG  44   5.101   7.146   7.180
  307    HE   ARG  44           HE       ARG  44   4.807   7.657   9.905
  308   1HH1  ARG  44          1HH1      ARG  44   5.330   9.572   6.949
  309   2HH1  ARG  44          2HH1      ARG  44   4.753  11.043   7.684
  310   1HH2  ARG  44          1HH2      ARG  44   4.014   9.456  10.776
  311   2HH2  ARG  44          2HH2      ARG  44   3.856  10.972   9.897
  312    H    VAL  45           H        VAL  45   6.108   3.266   4.406
  313    HA   VAL  45           HA       VAL  45   8.876   2.643   3.704
  314    HB   VAL  45           HB       VAL  45   7.171   0.959   3.513
  315   1HG1  VAL  45          1HG1      VAL  45   5.174   2.328   2.900
  316   2HG1  VAL  45          2HG1      VAL  45   5.828   2.503   1.259
  317   3HG1  VAL  45          3HG1      VAL  45   5.420   0.907   1.883
  318   1HG2  VAL  45          1HG2      VAL  45   9.139   0.850   2.063
  319   2HG2  VAL  45          2HG2      VAL  45   7.717   0.107   1.311
  320   3HG2  VAL  45          3HG2      VAL  45   8.260   1.705   0.780
  321    H    CYS  46           H        CYS  46   9.267   5.071   3.728
  322    HA   CYS  46           HA       CYS  46   8.137   6.642   1.672
  323   1HB   CYS  46          1HB       CYS  46  10.599   7.067   3.352
  324   2HB   CYS  46          2HB       CYS  46  10.191   8.120   1.998
  325    H    HIS  47           H        HIS  47   8.471   6.750  -0.392
  326    HA   HIS  47           HA       HIS  47  11.048   6.500  -1.619
  327   1HB   HIS  47          1HB       HIS  47  10.359   4.669  -3.233
  328   2HB   HIS  47          2HB       HIS  47  10.782   4.185  -1.603
  329    HD1  HIS  47           HD1      HIS  47   7.181   5.382  -1.965
  330    HD2  HIS  47           HD2      HIS  47   9.489   1.861  -1.971
  331    HE1  HIS  47           HE1      HIS  47   5.557   3.433  -1.727
  332    H    GLN  48           H        GLN  48   8.536   5.696  -3.733
  333    HA   GLN  48           HA       GLN  48   8.300   8.515  -4.614
  334   1HB   GLN  48          1HB       GLN  48   7.458   6.013  -6.104
  335   2HB   GLN  48          2HB       GLN  48   7.662   7.658  -6.739
  336   1HG   GLN  48          1HG       GLN  48   9.756   5.655  -5.847
  337   2HG   GLN  48          2HG       GLN  48   9.555   6.401  -7.430
  338   1HE2  GLN  48          2HE2      GLN  48   9.395   9.174  -6.760
  339   2HE2  GLN  48          1HE2      GLN  48  10.962   9.602  -6.088
  340    H    ASP  49           H        ASP  49   5.813   7.082  -5.930
  341    HA   ASP  49           HA       ASP  49   3.723   7.565  -6.089
  342   1HB   ASP  49          1HB       ASP  49   4.040   5.456  -4.620
  343   2HB   ASP  49          2HB       ASP  49   3.427   6.447  -3.311
  344    H    CYS  50           H        CYS  50   1.812   7.999  -3.742
  345    HA   CYS  50           HA       CYS  50   2.088  10.973  -3.631
  346   1HB   CYS  50          1HB       CYS  50  -0.280   9.132  -4.216
  347   2HB   CYS  50          2HB       CYS  50  -0.394  10.853  -3.871
  348    H    VAL  51           H        VAL  51   0.537  11.984  -2.187
  349    HA   VAL  51           HA       VAL  51  -0.477  10.432   0.095
  350    HB   VAL  51           HB       VAL  51   0.304  12.023   1.745
  351   1HG1  VAL  51          1HG1      VAL  51   1.716  10.051   1.229
  352   2HG1  VAL  51          2HG1      VAL  51   2.692  11.048   0.129
  353   3HG1  VAL  51          3HG1      VAL  51   2.636  11.431   1.856
  354   1HG2  VAL  51          1HG2      VAL  51   1.680  13.445  -0.566
  355   2HG2  VAL  51          2HG2      VAL  51   0.471  14.094   0.545
  356   3HG2  VAL  51          3HG2      VAL  51   2.086  13.708   1.145
  357    H    CYS  52           H        CYS  52  -1.920  12.174   1.426
  358    HA   CYS  52           HA       CYS  52  -3.912  13.131  -0.451
  359   1HB   CYS  52          1HB       CYS  52  -3.648  13.657   2.529
  360   2HB   CYS  52          2HB       CYS  52  -5.078  13.937   1.532
  361    H    GLU  53           H        GLU  53  -4.845  15.406  -0.175
  362    HA   GLU  53           HA       GLU  53  -2.797  17.393  -0.614
  363   1HB   GLU  53          1HB       GLU  53  -5.646  18.134   0.023
  364   2HB   GLU  53          2HB       GLU  53  -4.486  18.909  -1.050
  365   1HG   GLU  53          1HG       GLU  53  -5.804  17.971  -2.634
  366   2HG   GLU  53          2HG       GLU  53  -4.770  16.560  -2.394
  367    H    GLU  54           H        GLU  54  -2.612  19.356   0.649
  368    HA   GLU  54           HA       GLU  54  -1.490  19.077   3.015
  369   1HB   GLU  54          1HB       GLU  54  -1.659  21.439   3.381
  370   2HB   GLU  54          2HB       GLU  54  -1.421  21.097   1.670
  371   1HG   GLU  54          1HG       GLU  54  -3.962  22.069   3.039
  372   2HG   GLU  54          2HG       GLU  54  -2.973  22.908   1.853
  373    H    GLY  55           H        GLY  55  -4.983  19.965   2.900
  374   1HA   GLY  55          1HA       GLY  55  -5.170  19.437   5.855
  375   2HA   GLY  55          2HA       GLY  55  -6.207  20.498   4.900
  376    H    PHE  56           H        PHE  56  -5.246  17.324   3.650
  377    HA   PHE  56           HA       PHE  56  -7.994  16.256   4.160
  378   1HB   PHE  56          1HB       PHE  56  -6.227  16.179   1.706
  379   2HB   PHE  56          2HB       PHE  56  -7.448  14.958   2.012
  380    HD1  PHE  56           HD1      PHE  56  -7.181  18.749   1.905
  381    HD2  PHE  56           HD2      PHE  56  -9.505  15.238   1.005
  382    HE1  PHE  56           HE1      PHE  56  -8.906  20.156   0.834
  383    HE2  PHE  56           HE2      PHE  56 -11.188  16.624  -0.121
  384    HZ   PHE  56           HZ       PHE  56 -10.922  19.108  -0.181
  385    H    TYR  57           H        TYR  57  -8.055  14.178   4.895
  386    HA   TYR  57           HA       TYR  57  -5.464  13.061   5.801
  387   1HB   TYR  57          1HB       TYR  57  -8.208  13.008   7.110
  388   2HB   TYR  57          2HB       TYR  57  -6.733  12.296   7.766
  389    HD1  TYR  57           HD1      TYR  57  -4.932  13.711   8.668
  390    HD2  TYR  57           HD2      TYR  57  -8.535  15.472   7.070
  391    HE1  TYR  57           HE1      TYR  57  -4.133  15.955   9.336
  392    HE2  TYR  57           HE2      TYR  57  -7.713  17.717   7.720
  393    HH   TYR  57           HH       TYR  57  -4.540  18.228   9.258
  394    H    ARG  58           H        ARG  58  -5.112  10.886   5.487
  395    HA   ARG  58           HA       ARG  58  -6.755   9.595   3.438
  396   1HB   ARG  58          1HB       ARG  58  -5.186   7.745   3.655
  397   2HB   ARG  58          2HB       ARG  58  -4.392   9.249   3.269
  398   1HG   ARG  58          1HG       ARG  58  -3.276   9.423   5.274
  399   2HG   ARG  58          2HG       ARG  58  -4.541   8.592   6.185
  400   1HD   ARG  58          1HD       ARG  58  -2.568   7.284   4.307
  401   2HD   ARG  58          2HD       ARG  58  -2.530   7.205   6.069
  402    HE   ARG  58           HE       ARG  58  -5.064   6.326   5.478
  403   1HH1  ARG  58          1HH1      ARG  58  -1.827   5.283   4.350
  404   2HH1  ARG  58          2HH1      ARG  58  -2.312   3.625   4.168
  405   1HH2  ARG  58          1HH2      ARG  58  -5.725   4.172   4.960
  406   2HH2  ARG  58          2HH2      ARG  58  -4.529   2.995   4.501
  407    H    ASN  59           H        ASN  59  -8.809   9.670   4.761
  408    HA   ASN  59           HA       ASN  59  -8.988   8.055   7.114
  409   1HB   ASN  59          1HB       ASN  59 -10.634   9.825   6.444
  410   2HB   ASN  59          2HB       ASN  59 -11.217   8.716   5.178
  411   1HD2  ASN  59          2HD2      ASN  59 -13.344   9.132   6.530
  412   2HD2  ASN  59          1HD2      ASN  59 -13.567   7.864   7.738
  413    H    LYS  60           H        LYS  60  -9.383   5.953   7.431
  414    HA   LYS  60           HA       LYS  60  -8.731   3.800   6.908
  415   1HB   LYS  60          1HB       LYS  60 -10.806   2.655   5.928
  416   2HB   LYS  60          2HB       LYS  60 -10.943   3.553   7.432
  417   1HG   LYS  60          1HG       LYS  60 -12.021   5.404   6.432
  418   2HG   LYS  60          2HG       LYS  60 -11.749   4.833   4.784
  419   1HD   LYS  60          1HD       LYS  60 -13.139   2.774   5.391
  420   2HD   LYS  60          2HD       LYS  60 -13.505   3.570   6.932
  421   1HE   LYS  60          1HE       LYS  60 -14.206   4.573   4.129
  422   2HE   LYS  60          2HE       LYS  60 -15.324   3.940   5.349
  423   1HZ   LYS  60          1HZ       LYS  60 -14.674   5.806   6.757
  424   2HZ   LYS  60          2HZ       LYS  60 -13.765   6.421   5.534
  425   3HZ   LYS  60          3HZ       LYS  60 -15.398   6.286   5.351
  426    H    ASP  61           H        ASP  61 -10.506   3.635   3.960
  427    HA   ASP  61           HA       ASP  61  -8.192   2.364   2.713
  428   1HB   ASP  61          1HB       ASP  61 -11.039   2.763   1.720
  429   2HB   ASP  61          2HB       ASP  61  -9.812   1.728   0.976
  430    H    ASP  62           H        ASP  62  -7.175   4.643   2.873
  431    HA   ASP  62           HA       ASP  62  -6.487   6.613   1.996
  432   1HB   ASP  62          1HB       ASP  62  -5.412   4.992   0.436
  433   2HB   ASP  62          2HB       ASP  62  -6.798   5.144  -0.654
  434    H    LYS  63           H        LYS  63  -9.250   6.659   2.575
  435    HA   LYS  63           HA       LYS  63 -10.498   8.222   0.390
  436   1HB   LYS  63          1HB       LYS  63 -11.448   7.775   3.229
  437   2HB   LYS  63          2HB       LYS  63 -12.349   8.493   1.898
  438   1HG   LYS  63          1HG       LYS  63 -11.381   5.601   2.095
  439   2HG   LYS  63          2HG       LYS  63 -13.031   6.196   2.330
  440   1HD   LYS  63          1HD       LYS  63 -13.016   7.024  -0.063
  441   2HD   LYS  63          2HD       LYS  63 -11.411   6.294  -0.260
  442   1HE   LYS  63          1HE       LYS  63 -13.083   4.822  -1.189
  443   2HE   LYS  63          2HE       LYS  63 -12.306   4.062   0.205
  444   1HZ   LYS  63          1HZ       LYS  63 -14.920   5.412   0.226
  445   2HZ   LYS  63          2HZ       LYS  63 -14.684   3.781   0.197
  446   3HZ   LYS  63          3HZ       LYS  63 -14.218   4.655   1.512
  447    H    CYS  64           H        CYS  64  -8.805   9.691   0.110
  448    HA   CYS  64           HA       CYS  64  -7.782  11.369   2.245
  449   1HB   CYS  64          1HB       CYS  64  -7.746  11.566  -0.743
  450   2HB   CYS  64          2HB       CYS  64  -7.106  12.850   0.283
  451    H    VAL  65           H        VAL  65  -9.423  12.260   3.403
  452    HA   VAL  65           HA       VAL  65 -11.342  14.097   2.004
  453    HB   VAL  65           HB       VAL  65 -13.037  13.381   3.612
  454   1HG1  VAL  65          1HG1      VAL  65 -12.941  12.338   1.384
  455   2HG1  VAL  65          2HG1      VAL  65 -11.938  11.030   2.032
  456   3HG1  VAL  65          3HG1      VAL  65 -13.596  11.243   2.614
  457   1HG2  VAL  65          1HG2      VAL  65 -10.922  11.401   4.570
  458   2HG2  VAL  65          2HG2      VAL  65 -11.801  12.601   5.511
  459   3HG2  VAL  65          3HG2      VAL  65 -12.642  11.185   4.854
  460    H    SER  66           H        SER  66 -11.861  16.012   3.125
  461    HA   SER  66           HA       SER  66 -10.014  17.098   4.895
  462   1HB   SER  66          1HB       SER  66 -12.950  17.846   4.736
  463   2HB   SER  66          2HB       SER  66 -11.550  18.916   4.978
  464    HG   SER  66           HG       SER  66 -10.898  18.230   2.800
  465    H    ALA  67           H        ALA  67 -10.140  17.572   7.123
  466    HA   ALA  67           HA       ALA  67 -10.470  15.649   8.976
  467   1HB   ALA  67          1HB       ALA  67 -11.061  18.604   9.396
  468   2HB   ALA  67          2HB       ALA  67 -10.686  17.426  10.671
  469   3HB   ALA  67          3HB       ALA  67  -9.465  17.827   9.452
  470    H    GLU  68           H        GLU  68 -12.961  17.880   7.985
  471    HA   GLU  68           HA       GLU  68 -15.252  17.528   9.272
  472   1HB   GLU  68          1HB       GLU  68 -15.003  17.136   6.253
  473   2HB   GLU  68          2HB       GLU  68 -16.414  17.715   7.147
  474   1HG   GLU  68          1HG       GLU  68 -15.021  19.695   7.918
  475   2HG   GLU  68          2HG       GLU  68 -13.733  19.162   6.819
  476    H    ASP  69           H        ASP  69 -14.150  15.062   6.864
  477    HA   ASP  69           HA       ASP  69 -16.366  13.250   7.695
  478   1HB   ASP  69          1HB       ASP  69 -15.806  13.338   5.306
  479   2HB   ASP  69          2HB       ASP  69 -14.129  12.899   5.658
  480    H    CYS  70           H        CYS  70 -12.823  13.301   7.498
  481    HA   CYS  70           HA       CYS  70 -12.208  10.807   8.446
  482   1HB   CYS  70          1HB       CYS  70 -10.384  12.004   7.657
  483   2HB   CYS  70          2HB       CYS  70 -10.791  13.454   8.588
  484    H    GLU  71           H        GLU  71 -12.577  13.713  10.556
  485    HA   GLU  71           HA       GLU  71 -11.853  12.250  12.880
  486   1HB   GLU  71          1HB       GLU  71 -13.242  14.925  12.555
  487   2HB   GLU  71          2HB       GLU  71 -12.742  14.258  14.119
  488   1HG   GLU  71          1HG       GLU  71 -10.846  14.771  11.776
  489   2HG   GLU  71          2HG       GLU  71 -11.037  15.810  13.192
  490    H    LEU  72           H        LEU  72 -14.865  12.239  11.195
  491    HA   LEU  72           HA       LEU  72 -16.263  11.035  13.535
  492   1HB   LEU  72          1HB       LEU  72 -17.116  11.845  10.724
  493   2HB   LEU  72          2HB       LEU  72 -18.048  10.734  11.730
  494    HG   LEU  72           HG       LEU  72 -18.216  12.414  13.508
  495   1HD1  LEU  72          1HD1      LEU  72 -16.775  14.240  11.554
  496   2HD1  LEU  72          2HD1      LEU  72 -17.738  14.829  12.923
  497   3HD1  LEU  72          3HD1      LEU  72 -16.305  13.848  13.225
  498   1HD2  LEU  72          1HD2      LEU  72 -19.977  12.172  11.777
  499   2HD2  LEU  72          2HD2      LEU  72 -19.856  13.847  12.338
  500   3HD2  LEU  72          3HD2      LEU  72 -19.153  13.385  10.772
  501    H    ASP  73           H        ASP  73 -15.417  10.277  10.154
  502    HA   ASP  73           HA       ASP  73 -15.304   8.381   8.997
  503   1HB   ASP  73          1HB       ASP  73 -13.120   8.178  10.028
  504   2HB   ASP  73          2HB       ASP  73 -13.807   7.445  11.479
  505    H    ASN  74           H        ASN  74 -15.853   7.024  12.252
  506    HA   ASN  74           HA       ASN  74 -18.312   5.657  11.371
  507   1HB   ASN  74          1HB       ASN  74 -16.535   4.101  10.730
  508   2HB   ASN  74          2HB       ASN  74 -15.833   4.200  12.355
  509   1HD2  ASN  74          2HD2      ASN  74 -16.378   1.692  11.618
  510   2HD2  ASN  74          1HD2      ASN  74 -17.864   1.105  12.350
  511    H    MET  75           H        MET  75 -19.539   6.578  12.873
  512    HA   MET  75           HA       MET  75 -18.801   7.423  15.450
  513   1HB   MET  75          1HB       MET  75 -21.528   6.742  14.278
  514   2HB   MET  75          2HB       MET  75 -21.273   7.485  15.858
  515   1HG   MET  75          1HG       MET  75 -21.764   9.270  14.405
  516   2HG   MET  75          2HG       MET  75 -20.056   9.369  14.802
  517   1HE   MET  75          1HE       MET  75 -22.756   8.728  12.061
  518   2HE   MET  75          2HE       MET  75 -21.772   8.274  10.651
  519   3HE   MET  75          3HE       MET  75 -21.921   7.154  12.021
  520    H    ASP  76           H        ASP  76 -19.322   4.136  14.434
  521    HA   ASP  76           HA       ASP  76 -20.127   3.043  16.957
  522   1HB   ASP  76          1HB       ASP  76 -20.066   1.781  14.795
  523   2HB   ASP  76          2HB       ASP  76 -18.291   1.845  14.845
  524    H    PHE  77           H        PHE  77 -17.113   4.430  15.794
  525    HA   PHE  77           HA       PHE  77 -15.711   3.611  18.296
  526   1HB   PHE  77          1HB       PHE  77 -14.496   4.215  15.594
  527   2HB   PHE  77          2HB       PHE  77 -13.663   3.775  17.094
  528    HD1  PHE  77           HD1      PHE  77 -14.098   1.506  18.151
  529    HD2  PHE  77           HD2      PHE  77 -15.395   2.507  14.164
  530    HE1  PHE  77           HE1      PHE  77 -14.361  -0.895  17.637
  531    HE2  PHE  77           HE2      PHE  77 -15.672   0.091  13.657
  532    HZ   PHE  77           HZ       PHE  77 -15.174  -1.612  15.395
  533    H    ILE  78           H        ILE  78 -13.927   5.905  16.656
  534    HA   ILE  78           HA       ILE  78 -13.390   8.014  17.043
  535    HB   ILE  78           HB       ILE  78 -16.169   8.555  18.166
  536   1HG1  ILE  78          1HG1      ILE  78 -15.080   8.976  15.353
  537   2HG1  ILE  78          2HG1      ILE  78 -16.204   7.687  15.806
  538   1HG2  ILE  78          1HG2      ILE  78 -14.397  10.211  18.797
  539   2HG2  ILE  78          2HG2      ILE  78 -14.027  10.429  17.076
  540   3HG2  ILE  78          3HG2      ILE  78 -15.610  10.896  17.732
  541   1HD1  ILE  78          1HD1      ILE  78 -17.841   9.427  16.583
  542   2HD1  ILE  78          2HD1      ILE  78 -16.784  10.666  15.864
  543   3HD1  ILE  78          3HD1      ILE  78 -17.509   9.421  14.840
  544    H    TYR  79           H        TYR  79 -15.478   7.145  19.815
  545    HA   TYR  79           HA       TYR  79 -15.163   7.420  22.090
  546   1HB   TYR  79          1HB       TYR  79 -12.613   5.968  21.399
  547   2HB   TYR  79          2HB       TYR  79 -13.456   5.969  22.954
  548    HD1  TYR  79           HD1      TYR  79 -16.346   5.627  21.558
  549    HD2  TYR  79           HD2      TYR  79 -12.560   3.550  21.363
  550    HE1  TYR  79           HE1      TYR  79 -17.492   3.613  20.758
  551    HE2  TYR  79           HE2      TYR  79 -13.745   1.496  20.648
  552    HH   TYR  79           HH       TYR  79 -17.056   1.655  19.500
  553    HA   PRO  80           HA       PRO  80 -12.702  11.329  21.927
  554   1HB   PRO  80          1HB       PRO  80 -14.670  11.610  24.218
  555   2HB   PRO  80          2HB       PRO  80 -14.046  12.891  23.134
  556   1HG   PRO  80          1HG       PRO  80 -16.472  11.809  22.633
  557   2HG   PRO  80          2HG       PRO  80 -15.317  11.999  21.278
  558   1HD   PRO  80          1HD       PRO  80 -15.926   9.509  22.883
  559   2HD   PRO  80          2HD       PRO  80 -15.754   9.688  21.112
  560    H    GLY  81           H        GLY  81 -10.856  11.745  23.175
  561   1HA   GLY  81          1HA       GLY  81  -9.152  11.261  24.613
  562   2HA   GLY  81          2HA       GLY  81 -10.386  11.153  25.880
  563    H    THR  82           H        THR  82  -9.876   9.140  22.981
  564    HA   THR  82           HA       THR  82  -9.462   7.060  22.539
  565    HB   THR  82           HB       THR  82  -7.959   5.693  23.820
  566    HG1  THR  82           HG1      THR  82  -8.370   7.610  25.855
  567   1HG2  THR  82          1HG2      THR  82  -7.070   7.521  22.407
  568   2HG2  THR  82          2HG2      THR  82  -7.061   8.609  23.814
  569   3HG2  THR  82          3HG2      THR  82  -6.026   7.167  23.793
  570    H    ARG  83           H        ARG  83 -10.778   7.202  25.852
  571    HA   ARG  83           HA       ARG  83 -12.562   4.869  25.210
  572   1HB   ARG  83          1HB       ARG  83 -10.649   5.327  27.515
  573   2HB   ARG  83          2HB       ARG  83 -12.026   4.241  27.697
  574   1HG   ARG  83          1HG       ARG  83 -11.255   2.654  26.258
  575   2HG   ARG  83          2HG       ARG  83 -10.307   3.773  25.280
  576   1HD   ARG  83          1HD       ARG  83  -9.530   3.043  28.128
  577   2HD   ARG  83          2HD       ARG  83  -8.958   2.203  26.668
  578    HE   ARG  83           HE       ARG  83  -8.612   5.092  26.521
  579   1HH1  ARG  83          1HH1      ARG  83  -7.034   2.135  27.710
  580   2HH1  ARG  83          2HH1      ARG  83  -5.437   2.719  27.292
  581   1HH2  ARG  83          1HH2      ARG  83  -6.618   5.802  26.047
  582   2HH2  ARG  83          2HH2      ARG  83  -5.201   4.759  26.191
  583    H    ASN  84           H        ASN  84 -12.920   7.990  25.497
  584    HA   ASN  84           HA       ASN  84 -14.421   9.409  26.403
  585   1HB   ASN  84          1HB       ASN  84 -15.786   7.735  25.083
  586   2HB   ASN  84          2HB       ASN  84 -16.284   7.035  26.625
  587   1HD2  ASN  84          2HD2      ASN  84 -17.128   8.803  28.257
  588   2HD2  ASN  84          1HD2      ASN  84 -18.192  10.025  27.551
  589    HA   PRO  85           HA       PRO  85 -13.626   8.015  30.821
  590   1HB   PRO  85          1HB       PRO  85 -11.784   9.914  31.534
  591   2HB   PRO  85          2HB       PRO  85 -11.335   8.381  30.732
  592   1HG   PRO  85          1HG       PRO  85 -11.790  11.078  29.416
  593   2HG   PRO  85          2HG       PRO  85 -10.382   9.991  29.219
  594   1HD   PRO  85          1HD       PRO  85 -12.411   9.980  27.433
  595   2HD   PRO  85          2HD       PRO  85 -11.650   8.445  27.946